diff --git a/.gitignore b/.gitignore
index cbc60aa1..7804c07b 100644
--- a/.gitignore
+++ b/.gitignore
@@ -165,6 +165,9 @@ configs/local/default.yaml
 # Forks
 /workdir/
 /forks/alphafold3/*prediction_outputs/
+/forks/boltz/boltz/
+/forks/boltz/prediction_inputs/
+/forks/boltz/prediction_outputs/
 /forks/chai-lab-orig/
 /forks/chai-lab*/chai-lab/
 /forks/chai-lab*/prediction_inputs/
@@ -199,3 +202,4 @@ configs/local/default.yaml
 /forks/TULIP/outputs/
 /forks/Vina/ADFR/
 scripts/*inference*/
+scoring/
diff --git a/.pre-commit-config.yaml b/.pre-commit-config.yaml
index 45779def..9724400d 100644
--- a/.pre-commit-config.yaml
+++ b/.pre-commit-config.yaml
@@ -128,7 +128,7 @@ repos:
     hooks:
       - id: codespell
         args:
-          - --skip=logs/**,data/**,*.ipynb,posebench/utils/data_utils.py,posebench/utils/residue_utils.py,posebench/data/components/fasta_preparation.py,posebench/models/minimize_energy.py,posebench/data/components/create_casp15_ensemble_input_csv.py,posebench/analysis/casp15_ligand_scoring/casp_parser.py,*Components-smiles-stereo-oe.smi,notebooks/pdb_reports/transferase/*
+          - --skip=logs/**,data/**,notebooks/**,*.ipynb,posebench/utils/data_utils.py,posebench/utils/residue_utils.py,posebench/data/components/fasta_preparation.py,posebench/models/minimize_energy.py,posebench/data/components/create_casp15_ensemble_input_csv.py,posebench/analysis/casp15_ligand_scoring/casp_parser.py,*Components-smiles-stereo-oe.smi,notebooks/pdb_reports/transferase/*
           # - --ignore-words-list=abc,def
 
   # jupyter notebook cell output clearing
diff --git a/CHANGELOG.md b/CHANGELOG.md
index 34a98a2b..b7aba26d 100644
--- a/CHANGELOG.md
+++ b/CHANGELOG.md
@@ -1,3 +1,24 @@
+### 0.7.0 - 08/11/2025
+
+**Additions**:
+
+- Added new baseline methods (Boltz-1/2 w/ and w/o with multiple sequence alignments (MSAs)).
+- Added a new failure mode analysis notebook incorporating PLINDER for robust method generalization analysis(n.b., see new arXiv preprint for more details).
+- Added a script for performing custom method generalization analyses (e.g., when new methods are released which were trained on more recent splits of the PDB compared to AlphaFold 3's cutoff date of September 30, 2021).
+
+**Changes**:
+
+- Updated the `posebusters` package version to (at the time of writing) the latest version `0.4.5` to integrate new (stricter) pose checks (e.g., regarding flat aliphatic rings). Overall, each method's PoseBusters validity scores have decreased slightly on average (as expected).
+
+**Bug Fixes**:
+
+- Fixed a bug related to the number of DockGen-E protein chains provided to Chai-1 for inference on this dataset. Chai-1's DockGen-E results accordingly have been updated.
+
+**Results**:
+
+- With all the above changes in place, re-analyzed all baseline methods for each benchmark dataset, and updated the baseline predictions hosted on Zenodo
+- **NOTE**: The updated arXiv preprint should be publicly available by 08/15/2025
+
 ### 0.6.0 - 02/09/2025
 
 **Additions**:
@@ -21,7 +42,7 @@
 
 **Results**:
 
-- With all the above changed in place, simplified, re-ran, and re-analyzed all baseline methods for each benchmark dataset, and updated the baseline predictions and datasets (now containing standardized MSAs) hosted on Zenodo
+- With all the above changes in place, simplified, re-ran, and re-analyzed all baseline methods for each benchmark dataset, and updated the baseline predictions and datasets (now containing standardized MSAs) hosted on Zenodo
 - **NOTE**: The updated arXiv preprint should be publicly available by 02/12/2025
 
 ### 0.5.0 - 09/30/2024
diff --git a/README.md b/README.md
index eccec5c4..3ab40da3 100644
--- a/README.md
+++ b/README.md
@@ -3,7 +3,7 @@
 # PoseBench
 
 [![Paper](http://img.shields.io/badge/arXiv-2405.14108-B31B1B.svg)](https://arxiv.org/abs/2405.14108)
-[![DOI](https://zenodo.org/badge/DOI/10.5281/zenodo.14629652.svg)](https://doi.org/10.5281/zenodo.14629652)
+[![DOI](https://zenodo.org/badge/DOI/10.5281/zenodo.16791095.svg)](https://doi.org/10.5281/zenodo.16791095)
 [![PyPI version](https://badge.fury.io/py/posebench.svg)](https://badge.fury.io/py/posebench)
 [![Project Status: Active – The project has reached a stable, usable state and is being actively developed.](https://www.repostatus.org/badges/latest/active.svg)](https://www.repostatus.org/#active)
 [![Docs](https://assets.readthedocs.org/static/projects/badges/passing-flat.svg)](https://bioinfomachinelearning.github.io/PoseBench/)
@@ -113,6 +113,10 @@ cd forks/RoseTTAFold-All-Atom/rf2aa/SE3Transformer/ && pip3 install --no-cache-d
 mamba env create -f environments/chai_lab_environment.yaml --prefix forks/chai-lab/chai-lab/
 conda activate forks/chai-lab/chai-lab/  # NOTE: one still needs to use `conda` to (de)activate environments
 pip3 install forks/chai-lab/
+# - Boltz environment (~5 GB)
+mamba env create -f environments/boltz_environment.yaml --prefix forks/boltz/boltz/
+conda activate forks/boltz/boltz/  # NOTE: one still needs to use `conda` to (de)activate environments
+cd forks/boltz/ && pip3 install -e .[cuda] && cd ../../
 # - AutoDock Vina Tools environment (~1 GB)
 mamba env create -f environments/adfr_environment.yaml --prefix forks/Vina/ADFR/
 conda activate forks/Vina/ADFR/  # NOTE: one still needs to use `conda` to (de)activate environments
@@ -152,6 +156,37 @@ wget http://files.ipd.uw.edu/pub/RF-All-Atom/weights/RFAA_paper_weights.pt
 cd ../../
 ```
 
+(Optional) Download PLINDER-based similarity metrics for method generalization analysis (~0.5 GB total)
+
+```bash
+mkdir -p ./data/plinder/
+wget -P ./data/plinder/ https://zenodo.org/records/16754298/files/annotations.csv
+wget -P ./data/plinder/ https://zenodo.org/records/16754298/files/all_similarity_scores.parquet
+```
+
+(Optional) Alternatively, download PLINDER to perform a method generalization analysis for custom (new) datasets (~500 GB total)
+
+```bash
+# download fixed version of PLINDER
+export PLINDER_RELEASE=2024-06
+export PLINDER_ITERATION=v2
+mkdir -p ./data/plinder/${PLINDER_RELEASE}/${PLINDER_ITERATION}/
+gsutil -m cp -r "gs://plinder/${PLINDER_RELEASE}/${PLINDER_ITERATION}/*" ./data/plinder/${PLINDER_RELEASE}/${PLINDER_ITERATION}/
+
+# unpack system files of fixed version of PLINDER
+cd ./data/plinder/${PLINDER_RELEASE}/${PLINDER_ITERATION}/systems; for i in `ls *zip`; do unzip $i; touch ${i//.zip/}_done; done
+cd ../../../../../
+
+# customize `similarity_scoring.py` to similarity-match a (bespoke) subset of new PDB complex IDs for (blind) benchmarking
+python3 posebench/analysis/similarity_scoring.py $PDB_ID_FROM_NEW_SUBSET # e.g., in a for-loop or in parallel
+
+# combine each score of the new subset into a singular (new) `all_similarity_scores.parquet` file
+python3 -c "import os, pandas as pd; from glob import glob; files = glob(os.path.join('scoring', 'scores', 'scores', 'all_scores', '*.parquet')); pd.concat([pd.read_parquet(f) for f in files], ignore_index=True).to_parquet('data', 'plinder', 'all_similarity_scores.parquet')"
+
+# update annotations
+python3 -c "import re; pdb_ids_pattern = '|'.join(map(re.escape, $PDB_IDS_IN_NEW_SUBSET)); similarity_df_custom = all_similarity_scores[~all_similarity_scores["target_system"].str.contains(pdb_ids_pattern, na=False)].sort_values(by='sucos_shape_pocket_qcov', ascending=False).groupby('group_key').head(1).reset_index(drop=True); similarity_custom = dict(zip(similarity_df_custom['group_key'], similarity_df_custom['sucos_shape_pocket_qcov'])); annotated_df['sucos_shape_pocket_qcov_custom'] = annotated_df['group_key'].map(similarity_custom); annotated_df.to_csv(os.path.join('data', 'plinder', 'annotations.csv'))"
+```
+
 </details>
 
 ## Tutorials
@@ -174,10 +209,10 @@ of how to extend `PoseBench`, as outlined below.
 
 ```bash
 # fetch, extract, and clean-up preprocessed Astex Diverse, PoseBusters Benchmark, DockGen, and CASP15 data (~3 GB) #
-wget https://zenodo.org/records/14629652/files/astex_diverse_set.tar.gz
-wget https://zenodo.org/records/14629652/files/posebusters_benchmark_set.tar.gz
-wget https://zenodo.org/records/14629652/files/dockgen_set.tar.gz
-wget https://zenodo.org/records/14629652/files/casp15_set.tar.gz
+wget https://zenodo.org/records/16791095/files/astex_diverse_set.tar.gz
+wget https://zenodo.org/records/16791095/files/posebusters_benchmark_set.tar.gz
+wget https://zenodo.org/records/16791095/files/dockgen_set.tar.gz
+wget https://zenodo.org/records/16791095/files/casp15_set.tar.gz
 tar -xzf astex_diverse_set.tar.gz
 tar -xzf posebusters_benchmark_set.tar.gz
 tar -xzf dockgen_set.tar.gz
@@ -193,35 +228,39 @@ rm casp15_set.tar.gz
 ```bash
 # fetch, extract, and clean-up benchmark method predictions to reproduce paper results (~19 GB) #
 # AutoDock Vina predictions and results
-wget https://zenodo.org/records/14629652/files/vina_benchmark_method_predictions.tar.gz
+wget https://zenodo.org/records/16791095/files/vina_benchmark_method_predictions.tar.gz
 tar -xzf vina_benchmark_method_predictions.tar.gz
 rm vina_benchmark_method_predictions.tar.gz
 # DiffDock predictions and results
-wget https://zenodo.org/records/14629652/files/diffdock_benchmark_method_predictions.tar.gz
+wget https://zenodo.org/records/16791095/files/diffdock_benchmark_method_predictions.tar.gz
 tar -xzf diffdock_benchmark_method_predictions.tar.gz
 rm diffdock_benchmark_method_predictions.tar.gz
 # DynamicBind predictions and results
-wget https://zenodo.org/records/14629652/files/dynamicbind_benchmark_method_predictions.tar.gz
+wget https://zenodo.org/records/16791095/files/dynamicbind_benchmark_method_predictions.tar.gz
 tar -xzf dynamicbind_benchmark_method_predictions.tar.gz
 rm dynamicbind_benchmark_method_predictions.tar.gz
 # NeuralPLexer predictions and results
-wget https://zenodo.org/records/14629652/files/neuralplexer_benchmark_method_predictions.tar.gz
+wget https://zenodo.org/records/16791095/files/neuralplexer_benchmark_method_predictions.tar.gz
 tar -xzf neuralplexer_benchmark_method_predictions.tar.gz
 rm neuralplexer_benchmark_method_predictions.tar.gz
 # RoseTTAFold-All-Atom predictions and results
-wget https://zenodo.org/records/14629652/files/rfaa_benchmark_method_predictions.tar.gz
+wget https://zenodo.org/records/16791095/files/rfaa_benchmark_method_predictions.tar.gz
 tar -xzf rfaa_benchmark_method_predictions.tar.gz
 rm rfaa_benchmark_method_predictions.tar.gz
 # Chai-1 predictions and results
-wget https://zenodo.org/records/14629652/files/chai_benchmark_method_predictions.tar.gz
+wget https://zenodo.org/records/16791095/files/chai_benchmark_method_predictions.tar.gz
 tar -xzf chai_benchmark_method_predictions.tar.gz
 rm chai_benchmark_method_predictions.tar.gz
+# Boltz-1 predictions and results
+wget https://zenodo.org/records/16791095/files/boltz_benchmark_method_predictions.tar.gz
+tar -xzf boltz_benchmark_method_predictions.tar.gz
+rm boltz_benchmark_method_predictions.tar.gz
 # AlphaFold 3 predictions and results
-wget https://zenodo.org/records/14629652/files/af3_benchmark_method_predictions.tar.gz
+wget https://zenodo.org/records/16791095/files/af3_benchmark_method_predictions.tar.gz
 tar -xzf af3_benchmark_method_predictions.tar.gz
 rm af3_benchmark_method_predictions.tar.gz
 # CASP15 predictions and results for all methods
-wget https://zenodo.org/records/14629652/files/casp15_benchmark_method_predictions.tar.gz
+wget https://zenodo.org/records/16791095/files/casp15_benchmark_method_predictions.tar.gz
 tar -xzf casp15_benchmark_method_predictions.tar.gz
 rm casp15_benchmark_method_predictions.tar.gz
 ```
@@ -231,7 +270,7 @@ rm casp15_benchmark_method_predictions.tar.gz
 ```bash
 # fetch, extract, and clean-up benchmark method interactions to reproduce paper results (~12 GB) #
 # cached ProLIF interactions for notebook plots
-wget https://zenodo.org/records/14629652/files/posebench_notebooks.tar.gz
+wget https://zenodo.org/records/16791095/files/posebench_notebooks.tar.gz
 tar -xzf posebench_notebooks.tar.gz
 rm posebench_notebooks.tar.gz
 ```
@@ -318,7 +357,7 @@ python3 posebench/data/components/protein_apo_to_holo_alignment.py dataset=casp1
 conda deactivate
 ```
 
-**NOTE:** The preprocessed Astex Diverse, PoseBusters Benchmark, DockGen, and CASP15 data available via [Zenodo](https://doi.org/10.5281/zenodo.14629652) provide pre-holo-aligned protein structures predicted by AlphaFold 3 (and alternatively MIT-licensed ESMFold) for these respective datasets. Accordingly, users must ensure their usage of such predicted protein structures from AlphaFold 3 aligns with AlphaFold 3's [Terms of Use](https://github.com/google-deepmind/alphafold3/blob/main/WEIGHTS_TERMS_OF_USE.md).
+**NOTE:** The preprocessed Astex Diverse, PoseBusters Benchmark, DockGen, and CASP15 data available via [Zenodo](https://doi.org/10.5281/zenodo.16791095) provide pre-holo-aligned protein structures predicted by AlphaFold 3 (and alternatively MIT-licensed ESMFold) for these respective datasets. Accordingly, users must ensure their usage of such predicted protein structures from AlphaFold 3 aligns with AlphaFold 3's [Terms of Use](https://github.com/google-deepmind/alphafold3/blob/main/WEIGHTS_TERMS_OF_USE.md).
 
 </details>
 
@@ -339,14 +378,15 @@ conda deactivate
 
 #### Flexible Protein Methods
 
-| Name                   | Source                                                                        | Astex Benchmarked | PoseBusters Benchmarked | DockGen Benchmarked | CASP Benchmarked |
-| ---------------------- | ----------------------------------------------------------------------------- | ----------------- | ----------------------- | ------------------- | ---------------- |
-| `DynamicBind`          | [Lu et al.](https://www.nature.com/articles/s41467-024-45461-2)               | ✓                 | ✓                       | ✓                   | ✓                |
-| `NeuralPLexer`         | [Qiao et al.](https://www.nature.com/articles/s42256-024-00792-z)             | ✓                 | ✓                       | ✓                   | ✓                |
-| `FlowDock`             | [Morehead et al.](https://arxiv.org/abs/2412.10966)                           | ✓                 | ✓                       | ✓                   | ✓                |
-| `RoseTTAFold-All-Atom` | [Krishna et al.](https://www.science.org/doi/10.1126/science.adl2528)         | ✓                 | ✓                       | ✓                   | ✓                |
-| `Chai-1`               | [Chai Discovery](https://chaiassets.com/chai-1/paper/technical_report_v1.pdf) | ✓                 | ✓                       | ✓                   | ✓                |
-| `AlphaFold 3`          | [Abramson et al.](https://www.nature.com/articles/s41586-024-07487-w)         | ✓                 | ✓                       | ✓                   | ✓                |
+| Name                   | Source                                                                         | Astex Benchmarked | PoseBusters Benchmarked | DockGen Benchmarked | CASP Benchmarked |
+| ---------------------- | ------------------------------------------------------------------------------ | ----------------- | ----------------------- | ------------------- | ---------------- |
+| `DynamicBind`          | [Lu et al.](https://www.nature.com/articles/s41467-024-45461-2)                | ✓                 | ✓                       | ✓                   | ✓                |
+| `NeuralPLexer`         | [Qiao et al.](https://www.nature.com/articles/s42256-024-00792-z)              | ✓                 | ✓                       | ✓                   | ✓                |
+| `FlowDock`             | [Morehead et al.](https://arxiv.org/abs/2412.10966)                            | ✓                 | ✓                       | ✓                   | ✓                |
+| `RoseTTAFold-All-Atom` | [Krishna et al.](https://www.science.org/doi/10.1126/science.adl2528)          | ✓                 | ✓                       | ✓                   | ✓                |
+| `Chai-1`               | [Chai Discovery](https://chaiassets.com/chai-1/paper/technical_report_v1.pdf)  | ✓                 | ✓                       | ✓                   | ✓                |
+| `Boltz`                | [Wohlwend et al.](https://www.biorxiv.org/content/10.1101/2024.11.19.624167v4) | ✓                 | ✓                       | ✓                   | ✓                |
+| `AlphaFold 3`          | [Abramson et al.](https://www.nature.com/articles/s41586-024-07487-w)          | ✓                 | ✓                       | ✓                   | ✓                |
 
 ### Methods available for ensembling
 
@@ -360,14 +400,15 @@ conda deactivate
 
 #### Flexible Protein Methods
 
-| Name                   | Source                                                                        | Astex Benchmarked | PoseBusters Benchmarked | DockGen Benchmarked | CASP Benchmarked |
-| ---------------------- | ----------------------------------------------------------------------------- | ----------------- | ----------------------- | ------------------- | ---------------- |
-| `DynamicBind`          | [Lu et al.](https://www.nature.com/articles/s41467-024-45461-2)               | ✓                 | ✓                       | ✓                   | ✓                |
-| `NeuralPLexer`         | [Qiao et al.](https://www.nature.com/articles/s42256-024-00792-z)             | ✓                 | ✓                       | ✓                   | ✓                |
-| `FlowDock`             | [Morehead et al.](https://arxiv.org/abs/2412.10966)                           | ✓                 | ✓                       | ✓                   | ✓                |
-| `RoseTTAFold-All-Atom` | [Krishna et al.](https://www.science.org/doi/10.1126/science.adl2528)         | ✓                 | ✓                       | ✓                   | ✓                |
-| `Chai-1`               | [Chai Discovery](https://chaiassets.com/chai-1/paper/technical_report_v1.pdf) | ✓                 | ✓                       | ✓                   | ✓                |
-| `AlphaFold 3`          | [Abramson et al.](https://www.nature.com/articles/s41586-024-07487-w)         | ✓                 | ✓                       | ✓                   | ✓                |
+| Name                   | Source                                                                         | Astex Benchmarked | PoseBusters Benchmarked | DockGen Benchmarked | CASP Benchmarked |
+| ---------------------- | ------------------------------------------------------------------------------ | ----------------- | ----------------------- | ------------------- | ---------------- |
+| `DynamicBind`          | [Lu et al.](https://www.nature.com/articles/s41467-024-45461-2)                | ✓                 | ✓                       | ✓                   | ✓                |
+| `NeuralPLexer`         | [Qiao et al.](https://www.nature.com/articles/s42256-024-00792-z)              | ✓                 | ✓                       | ✓                   | ✓                |
+| `FlowDock`             | [Morehead et al.](https://arxiv.org/abs/2412.10966)                            | ✓                 | ✓                       | ✓                   | ✓                |
+| `RoseTTAFold-All-Atom` | [Krishna et al.](https://www.science.org/doi/10.1126/science.adl2528)          | ✓                 | ✓                       | ✓                   | ✓                |
+| `Chai-1`               | [Chai Discovery](https://chaiassets.com/chai-1/paper/technical_report_v1.pdf)  | ✓                 | ✓                       | ✓                   | ✓                |
+| `Boltz`                | [Wohlwend et al.](https://www.biorxiv.org/content/10.1101/2024.11.19.624167v4) | ✓                 | ✓                       | ✓                   | ✓                |
+| `AlphaFold 3`          | [Abramson et al.](https://www.nature.com/articles/s41586-024-07487-w)          | ✓                 | ✓                       | ✓                   | ✓                |
 
 **NOTE**: Have a new method to add? Please let us know by creating a pull request. We would be happy to work with you to integrate new methodology into this benchmark!
 
@@ -859,6 +900,93 @@ python3 posebench/analysis/inference_analysis_casp.py method=chai-lab dataset=ca
 ...
 ```
 
+### How to run inference with `Boltz`
+
+Prepare CSV input files
+
+```bash
+python3 posebench/data/boltz_input_preparation.py dataset=posebusters_benchmark
+python3 posebench/data/boltz_input_preparation.py dataset=astex_diverse
+python3 posebench/data/boltz_input_preparation.py dataset=dockgen
+python3 posebench/data/boltz_input_preparation.py dataset=casp15 input_data_dir=data/casp15_set/targets
+```
+
+Run inference on each dataset
+
+```bash
+conda activate forks/boltz/boltz/
+python3 posebench/models/boltz_inference.py dataset=posebusters_benchmark repeat_index=1
+...
+python3 posebench/models/boltz_inference.py dataset=astex_diverse repeat_index=1
+...
+python3 posebench/models/boltz_inference.py dataset=dockgen repeat_index=1
+...
+python3 posebench/models/boltz_inference.py dataset=casp15 repeat_index=1
+...
+conda deactivate
+```
+
+Extract predictions into separate files for proteins and ligands
+
+```bash
+python3 posebench/data/boltz_output_extraction.py dataset=posebusters_benchmark repeat_index=1
+...
+python3 posebench/data/boltz_output_extraction.py dataset=astex_diverse repeat_index=1
+...
+python3 posebench/data/boltz_output_extraction.py dataset=dockgen repeat_index=1
+...
+python3 posebench/data/boltz_output_extraction.py dataset=casp15 repeat_index=1
+...
+```
+
+Relax the generated ligand structures inside of their respective protein pockets
+
+```bash
+python3 posebench/models/inference_relaxation.py method=boltz dataset=posebusters_benchmark remove_initial_protein_hydrogens=true repeat_index=1
+...
+python3 posebench/models/inference_relaxation.py method=boltz dataset=astex_diverse remove_initial_protein_hydrogens=true repeat_index=1
+...
+python3 posebench/models/inference_relaxation.py method=boltz dataset=dockgen remove_initial_protein_hydrogens=true repeat_index=1
+...
+```
+
+Align predicted protein-ligand structures to ground-truth complex structures
+
+```bash
+conda activate PyMOL-PoseBench
+python3 posebench/analysis/complex_alignment.py method=boltz dataset=posebusters_benchmark repeat_index=1
+...
+python3 posebench/analysis/complex_alignment.py method=boltz dataset=astex_diverse repeat_index=1
+...
+python3 posebench/analysis/complex_alignment.py method=boltz dataset=dockgen repeat_index=1
+conda deactivate
+...
+```
+
+Analyze inference results for each dataset
+
+```bash
+python3 posebench/analysis/inference_analysis.py method=boltz dataset=posebusters_benchmark repeat_index=1
+...
+python3 posebench/analysis/inference_analysis.py method=boltz dataset=astex_diverse repeat_index=1
+...
+python3 posebench/analysis/inference_analysis.py method=boltz dataset=dockgen repeat_index=1
+...
+```
+
+Analyze inference results for the CASP15 dataset
+
+```bash
+# first assemble (unrelaxed and post ranking-relaxed) CASP15-compliant prediction submission files for scoring
+python3 posebench/models/ensemble_generation.py ensemble_methods=\[boltz\] input_csv_filepath=data/test_cases/casp15/ensemble_inputs.csv output_dir=data/test_cases/casp15/top_boltz_ensemble_predictions_1 skip_existing=true relax_method_ligands_post_ranking=false export_file_format=casp15 export_top_n=5 combine_casp_output_files=true max_method_predictions=5 method_top_n_to_select=5 resume=true ensemble_benchmarking=true ensemble_benchmarking_dataset=casp15 cuda_device_index=0 ensemble_benchmarking_repeat_index=1
+python3 posebench/models/ensemble_generation.py ensemble_methods=\[boltz\] input_csv_filepath=data/test_cases/casp15/ensemble_inputs.csv output_dir=data/test_cases/casp15/top_boltz_ensemble_predictions_1 skip_existing=true relax_method_ligands_post_ranking=true export_file_format=casp15 export_top_n=5 combine_casp_output_files=true max_method_predictions=5 method_top_n_to_select=5 resume=true ensemble_benchmarking=true ensemble_benchmarking_dataset=casp15 cuda_device_index=0 ensemble_benchmarking_repeat_index=1
+# NOTE: the suffixes for both `output_dir` and `ensemble_benchmarking_repeat_index` should be modified to e.g., 2, 3, ...
+...
+# now score the CASP15-compliant submissions using the official CASP scoring pipeline
+python3 posebench/analysis/inference_analysis_casp.py method=boltz dataset=casp15 repeat_index=1
+...
+```
+
 ### How to run inference with `AlphaFold 3`
 
 Run inference (3x) using the academically-available inference code released on [GitHub](https://github.com/google-deepmind/alphafold3), saving each run's structures to a unique output directory located at `forks/alphafold3/prediction_outputs/{dataset=posebusters_benchmark,astex_diverse,dockgen,casp15}_{repeat_index=1,2,3}`
@@ -1130,6 +1258,8 @@ jupyter notebook notebooks/casp15_inference_results_plotting.ipynb
 Inspect the failure modes of each method
 
 ```bash
+jupyter notebook notebooks/failure_modes_analysis_plotting_plinder.ipynb
+# or
 jupyter notebook notebooks/failure_modes_analysis_plotting.ipynb
 ```
 
@@ -1181,6 +1311,7 @@ rm -rf docs/build/ && sphinx-build docs/source/ docs/build/ # NOTE: errors can s
 
 - [AutoDock-Vina](https://github.com/ccsb-scripps/AutoDock-Vina)
 - [alphafold3](https://github.com/google-deepmind/alphafold3)
+- [boltz](https://github.com/jwohlwend/boltz)
 - [casp15_ligand](https://git.scicore.unibas.ch/schwede/casp15_ligand)
 - [chai-lab](https://github.com/chaidiscovery/chai-lab)
 - [DiffDock](https://github.com/gcorso/DiffDock)
@@ -1189,10 +1320,12 @@ rm -rf docs/build/ && sphinx-build docs/source/ docs/build/ # NOTE: errors can s
 - [FlowDock](https://github.com/BioinfoMachineLearning/FlowDock)
 - [lightning-hydra-template](https://github.com/ashleve/lightning-hydra-template)
 - [NeuralPLexer](https://github.com/zrqiao/NeuralPLexer)
+- [plinder](https://github.com/plinder-org/plinder)
 - [ProteinWorkshop](https://github.com/a-r-j/ProteinWorkshop)
 - [posebusters](https://github.com/maabuu/posebusters)
 - [posebusters_em](https://github.com/maabuu/posebusters_em)
 - [RoseTTAFold-All-Atom](https://github.com/baker-laboratory/RoseTTAFold-All-Atom)
+- [runs-n-poses](https://github.com/plinder-org/runs-n-poses)
 - [tulip](https://github.com/BioinfoMachineLearning/tulip)
 
 We thank all their contributors and maintainers!
diff --git a/configs/analysis/complex_alignment.yaml b/configs/analysis/complex_alignment.yaml
index 657e7776..55240ced 100644
--- a/configs/analysis/complex_alignment.yaml
+++ b/configs/analysis/complex_alignment.yaml
@@ -1,5 +1,5 @@
-method: neuralplexer # the method for which to align predictions - NOTE: must be one of (`diffdock`, `fabind`, `dynamicbind`, `neuralplexer`, `flowdock`, `rfaa`, `chai-lab`, `alphafold3`)
-vina_binding_site_method: p2rank # the method to use for Vina binding site prediction - NOTE: must be one of (`diffdock`, `fabind`, `dynamicbind`, `neuralplexer`, `flowdock`, `rfaa`, `chai-lab`, `alphafold3`, `p2rank`)
+method: neuralplexer # the method for which to align predictions - NOTE: must be one of (`diffdock`, `fabind`, `dynamicbind`, `neuralplexer`, `flowdock`, `rfaa`, `chai-lab`, `boltz`, `alphafold3`)
+vina_binding_site_method: p2rank # the method to use for Vina binding site prediction - NOTE: must be one of (`diffdock`, `fabind`, `dynamicbind`, `neuralplexer`, `flowdock`, `rfaa`, `chai-lab`, `boltz`, `alphafold3`, `p2rank`)
 dataset: posebusters_benchmark # the dataset to use - NOTE: must be one of (`posebusters_benchmark`, `astex_diverse`, `dockgen`, `casp15`)
 ensemble_ranking_method: consensus # the method with which to rank-order and select the top ensemble prediction for each target - NOTE: must be one of (`consensus`, `ff`)
 input_data_dir: ${oc.env:PROJECT_ROOT}/data/${dataset}_set # the input protein-ligand complex directory to recursively parse
diff --git a/configs/analysis/inference_analysis.yaml b/configs/analysis/inference_analysis.yaml
index 3e21251d..0e9c3d86 100644
--- a/configs/analysis/inference_analysis.yaml
+++ b/configs/analysis/inference_analysis.yaml
@@ -1,6 +1,6 @@
 full_report: true # whether to generate a full PoseBusters report (i.e. with all metrics) or a summary report (i.e. with only the most important metrics)
-method: diffdock # the method for which to score predictions - NOTE: must be one of (`diffdock`, `fabind`, `dynamicbind`, `neuralplexer`, `flowdock`, `rfaa`, `chai-lab`, `alphafold3`, `vina`, `ensemble`)
-vina_binding_site_method: p2rank # the method to use for Vina binding site prediction - NOTE: must be one of (`diffdock`, `fabind`, `dynamicbind`, `neuralplexer`, `flowdock`, `rfaa`, `chai-lab`, `alphafold3`, `p2rank`)
+method: diffdock # the method for which to score predictions - NOTE: must be one of (`diffdock`, `fabind`, `dynamicbind`, `neuralplexer`, `flowdock`, `rfaa`, `chai-lab`, `boltz`, `alphafold3`, `vina`, `ensemble`)
+vina_binding_site_method: p2rank # the method to use for Vina binding site prediction - NOTE: must be one of (`diffdock`, `fabind`, `dynamicbind`, `neuralplexer`, `flowdock`, `rfaa`, `chai-lab`, `boltz`, `alphafold3`, `p2rank`)
 dataset: posebusters_benchmark # the dataset to use - NOTE: must be one of (`posebusters_benchmark`, `astex_diverse`, `dockgen`, `casp15`)
 ensemble_ranking_method: consensus # the method with which to rank-order and select the top ensemble prediction for each target - NOTE: must be one of (`consensus`, `ff`)
 input_csv_path: ${resolve_method_input_csv_path:${method},${dataset},${pocket_only_baseline}} # the input CSV filepath with which to run inference
diff --git a/configs/analysis/inference_analysis_casp.yaml b/configs/analysis/inference_analysis_casp.yaml
index da1520d1..aa1bfc1a 100644
--- a/configs/analysis/inference_analysis_casp.yaml
+++ b/configs/analysis/inference_analysis_casp.yaml
@@ -1,8 +1,8 @@
 full_report: true # whether to generate a full PoseBusters report (i.e. with all metrics) or a summary report (i.e. with only the most important metrics)
 python_exec_path: ${oc.env:HOME}/mambaforge/envs/casp15_ligand_scoring/bin/python3 # the Python executable to use
 scoring_script_path: ${oc.env:PROJECT_ROOT}/posebench/analysis/casp15_ligand_scoring/score_predictions.py # the path to the script to use for scoring CASP predictions
-method: diffdock # the method for which to score predictions - NOTE: must be one of (`diffdock`, `fabind`, `dynamicbind`, `neuralplexer`, `flowdock`, `rfaa`, `chai-lab`, `alphafold3`, `vina`, `ensemble`, `tulip`)
-vina_binding_site_method: p2rank # the method to use for Vina binding site prediction - NOTE: must be one of (`diffdock`, `fabind`, `dynamicbind`, `neuralplexer`, `flowdock`, `rfaa`, `chai-lab`, `alphafold3`, `p2rank`)
+method: diffdock # the method for which to score predictions - NOTE: must be one of (`diffdock`, `fabind`, `dynamicbind`, `neuralplexer`, `flowdock`, `rfaa`, `chai-lab`, `boltz`, `alphafold3`, `vina`, `ensemble`, `tulip`)
+vina_binding_site_method: p2rank # the method to use for Vina binding site prediction - NOTE: must be one of (`diffdock`, `fabind`, `dynamicbind`, `neuralplexer`, `flowdock`, `rfaa`, `chai-lab`, `boltz`, `alphafold3`, `p2rank`)
 dataset: casp15 # the dataset to use - NOTE: must be one of (`casp15`)
 ensemble_ranking_method: consensus # the method with which to rank-order and select the top ensemble prediction for each target - NOTE: must be one of (`consensus`, `ff`)
 predictions_dir: ${oc.env:PROJECT_ROOT}/data/test_cases/${dataset}/top_${method}_ensemble_predictions_${repeat_index} # the directory containing the predictions to analyze
@@ -15,4 +15,5 @@ no_ilcl: false # whether to score a model trained without an inter-ligand clash
 relax_protein: false # whether to relax the protein - NOTE: currently periodically yields unpredictable protein-ligand separation
 v1_baseline: false # whether to score the v1 baseline predictions
 allow_missing_predictions: true # whether to allow missing predictions for a target
-force_rescore: false # whether to force CASP15 and PoseBusters rescoring of the predictions
+force_casp15_rescore: false # whether to force CASP15 rescoring of the predictions
+force_pb_rescore: false # whether to force PoseBusters rescoring of the predictions
diff --git a/configs/data/boltz_input_preparation.yaml b/configs/data/boltz_input_preparation.yaml
new file mode 100644
index 00000000..aa791960
--- /dev/null
+++ b/configs/data/boltz_input_preparation.yaml
@@ -0,0 +1,10 @@
+dataset: posebusters_benchmark # the dataset to use - NOTE: must be one of (`posebusters_benchmark`, `astex_diverse`, `dockgen`, `casp15`)
+input_data_dir: ${oc.env:PROJECT_ROOT}/data/${dataset}_set # the input protein-ligand complex directory to recursively parse
+msa_dir: ${oc.env:PROJECT_ROOT}/data/${dataset}_set/${dataset}_boltz_msas # the directory containing the `.csv` MSA files prepared for Boltz via `posebench/data/components/prepare_boltz_msas.py`; if not provided, Boltz will be run in single-sequence mode
+output_scripts_path: ${oc.env:PROJECT_ROOT}/forks/boltz/prediction_inputs/${dataset} # the output directory in which to save the input files
+posebusters_ccd_ids_filepath: ${oc.env:PROJECT_ROOT}/data/posebusters_pdb_ccd_ids.txt # the path to the PoseBusters PDB CCD IDs file that lists the targets that do not contain any crystal contacts
+dockgen_test_ids_filepath: ${oc.env:PROJECT_ROOT}/data/dockgen_set/split_test.txt # the path to the DockGen test set IDs file
+protein_filepath: null # the path to the protein structure file to use
+ligand_smiles: null # the ligand SMILES string for which to predict the binding pose
+input_id: null # the input ID to use for inference
+pocket_only_baseline: false # whether to prepare the pocket-only baseline
diff --git a/configs/data/boltz_output_extraction.yaml b/configs/data/boltz_output_extraction.yaml
new file mode 100644
index 00000000..aa8e02b6
--- /dev/null
+++ b/configs/data/boltz_output_extraction.yaml
@@ -0,0 +1,13 @@
+dataset: posebusters_benchmark # the dataset to use - NOTE: must be one of (`posebusters_benchmark`, `astex_diverse`, `dockgen`, `casp15`)
+prediction_inputs_dir: ${oc.env:PROJECT_ROOT}/forks/boltz/prediction_inputs/${dataset}
+prediction_outputs_dir: ${oc.env:PROJECT_ROOT}/forks/boltz/prediction_outputs/${dataset}_${repeat_index}
+inference_outputs_dir: ${oc.env:PROJECT_ROOT}/forks/boltz/inference/boltz_${dataset}_outputs_${repeat_index}
+input_data_dir: ${oc.env:PROJECT_ROOT}/data/${dataset}_set # the input protein-ligand complex directory to recursively parse
+posebusters_ccd_ids_filepath: ${oc.env:PROJECT_ROOT}/data/posebusters_pdb_ccd_ids.txt # the path to the PoseBusters PDB CCD IDs file that lists the targets that do not contain any crystal contacts
+dockgen_test_ids_filepath: ${oc.env:PROJECT_ROOT}/data/dockgen_set/split_test.txt # the path to the DockGen test set IDs file
+complex_filepath: null # if not `null`, this should be the path to the complex PDB file for which to extract outputs
+complex_id: null # if not `null`, this should be the complex ID of the single complex for which to extract outputs
+ligand_smiles: null # if not `null`, this should be the (i.e., `.` fragment-separated) complex ligand SMILES string of the single complex for which to extract outputs
+output_dir: null # if not `null`, this should be the path to the output file to which to write the extracted outputs
+repeat_index: 1 # the repeat index with which inference was run
+pocket_only_baseline: false # whether to prepare the pocket-only baseline
diff --git a/configs/data/components/prepare_boltz_msas.yaml b/configs/data/components/prepare_boltz_msas.yaml
new file mode 100644
index 00000000..01b74815
--- /dev/null
+++ b/configs/data/components/prepare_boltz_msas.yaml
@@ -0,0 +1,6 @@
+dataset: posebusters_benchmark # the dataset to use - NOTE: must be one of (`posebusters_benchmark`, `astex_diverse`, `dockgen`, `casp15`)
+input_data_dir: ${oc.env:PROJECT_ROOT}/data/${dataset}_set # the input protein-ligand complex directory to recursively parse
+input_msa_dir: ${oc.env:PROJECT_ROOT}/data/${dataset}_set/${dataset}_msas # where the original MSA files are placed
+output_msa_dir: ${oc.env:PROJECT_ROOT}/data/${dataset}_set/${dataset}_boltz_msas # where the processed MSA files should be stored
+skip_existing: true # whether to skip processing if the output file already exists
+pocket_only_baseline: false # whether to prepare the pocket-only baseline
diff --git a/configs/data/components/prepare_chai_msas.yaml b/configs/data/components/prepare_chai_msas.yaml
index 6ad9aaee..96b34e9c 100644
--- a/configs/data/components/prepare_chai_msas.yaml
+++ b/configs/data/components/prepare_chai_msas.yaml
@@ -1,4 +1,4 @@
 dataset: posebusters_benchmark # the dataset to use - NOTE: must be one of (`posebusters_benchmark`, `astex_diverse`, `dockgen`, `casp15`)
 input_msa_dir: ${oc.env:PROJECT_ROOT}/data/${dataset}_set/${dataset}_msas # where the original MSA files are placed
 output_msa_dir: ${oc.env:PROJECT_ROOT}/data/${dataset}_set/${dataset}_chai_msas # where the processed MSA files should be stored
-skip_existing: True # whether to skip processing if the output file already exists
+skip_existing: true # whether to skip processing if the output file already exists
diff --git a/configs/model/boltz_inference.yaml b/configs/model/boltz_inference.yaml
new file mode 100644
index 00000000..bbd0aea6
--- /dev/null
+++ b/configs/model/boltz_inference.yaml
@@ -0,0 +1,10 @@
+model: boltz1 # the model to use for inference - NOTE: must be one of (`boltz1`, `boltz2`)
+dataset: posebusters_benchmark # the dataset to use - NOTE: must be one of (`posebusters_benchmark`, `astex_diverse`, `dockgen`, `casp15`)
+input_dir: ${oc.env:PROJECT_ROOT}/forks/boltz/prediction_inputs/${dataset} # the input directory with which to run inference
+output_dir: ${oc.env:PROJECT_ROOT}/forks/boltz/prediction_outputs/${dataset}_${repeat_index} # the output directory to which to save the inference results
+cuda_device_index: 0 # the CUDA device to use for inference, or `null` to use CPU
+repeat_index: 1 # the repeat index to use for inference
+use_potentials: true # whether to use inference-time potentials to potentially improve pose plausibility
+skip_existing: true # whether to skip running inference if the prediction for a target already exists
+pocket_only_baseline: false # whether to run the pocket-only baseline
+max_num_inputs: null # if provided, the number of (dataset subset) inputs over which to run inference
diff --git a/configs/model/ensemble_generation.yaml b/configs/model/ensemble_generation.yaml
index eab80f89..16e3af4b 100644
--- a/configs/model/ensemble_generation.yaml
+++ b/configs/model/ensemble_generation.yaml
@@ -1,5 +1,5 @@
 # General inference arguments:
-ensemble_methods: [diffdock, dynamicbind, neuralplexer, rfaa] # the methods from which to gather predictions for ensembling - NOTE: must be one of (`diffdock`, `dynamicbind`, `neuralplexer`, `flowdock`, `rfaa`, `chai-lab`, `alphafold3`, `vina`, `tulip`)
+ensemble_methods: [diffdock, dynamicbind, neuralplexer, rfaa] # the methods from which to gather predictions for ensembling - NOTE: must be one of (`diffdock`, `dynamicbind`, `neuralplexer`, `flowdock`, `rfaa`, `chai-lab`, `boltz`, `alphafold3`, `vina`, `tulip`)
 generate_vina_scripts: false # whether to generate Vina scripts using other methods' binding site predictions - NOTE: `resume` must also be `true` when this is `true`, meaning other methods' predictions must have already been generated locally
 rank_single_method_intrinsically: true # whether to rank single-method predictions using either `consensus` or `vina` ranking (false) or instead using their intrinsic (explicit) rank assignment (true)
 output_bash_file_dir: ensemble_generation_scripts # the directory in which to save the generated Bash scripts
@@ -146,6 +146,9 @@ rfaa_inference_dir_name: null # the name of the inference output directory to us
 # Chai-1 inference arguments:
 chai_out_path: ${oc.env:PROJECT_ROOT}/forks/chai-lab/inference/chai-lab_ensemble_outputs # the output directory to which to write the predictions
 chai_skip_existing: true # whether to skip running inference if the prediction for a target already exists
+# Boltz inference arguments:
+boltz_out_path: ${oc.env:PROJECT_ROOT}/forks/boltz/inference/boltz_ensemble_outputs # the output directory to which to write the predictions
+boltz_skip_existing: true # whether to skip running inference if the prediction for a target already exists
 # AlphaFold 3 inference arguments:
 alphafold3_out_path: ${oc.env:PROJECT_ROOT}/forks/alphafold3/inference/alphafold3_ensemble_outputs # the output directory to which to write the predictions
 # Vina inference arguments:
diff --git a/configs/model/inference_relaxation.yaml b/configs/model/inference_relaxation.yaml
index 59babf23..82592c48 100644
--- a/configs/model/inference_relaxation.yaml
+++ b/configs/model/inference_relaxation.yaml
@@ -1,5 +1,5 @@
-method: diffdock # the method for which to relax predictions - NOTE: must be one of (`diffdock`, `fabind`, `dynamicbind`, `neuralplexer`, `flowdock`, `rfaa`, `chai-lab`, `alphafold3`, `vina`, `tulip`)
-vina_binding_site_method: p2rank # the method to use for Vina binding site prediction - NOTE: must be one of (`diffdock`, `fabind`, `dynamicbind`, `neuralplexer`, `flowdock`, `rfaa`, `chai-lab`, `alphafold3`, `p2rank`)
+method: diffdock # the method for which to relax predictions - NOTE: must be one of (`diffdock`, `fabind`, `dynamicbind`, `neuralplexer`, `flowdock`, `rfaa`, `chai-lab`, `boltz`, `alphafold3`, `vina`, `tulip`)
+vina_binding_site_method: p2rank # the method to use for Vina binding site prediction - NOTE: must be one of (`diffdock`, `fabind`, `dynamicbind`, `neuralplexer`, `flowdock`, `rfaa`, `chai-lab`, `boltz`, `alphafold3`, `p2rank`)
 dataset: posebusters_benchmark # the dataset for which to relax predictions - NOTE: must be one of (`posebusters_benchmark`, `astex_diverse`, `dockgen`, `casp15`)
 ensemble_ranking_method: consensus # the method with which to rank-order and select the top ensemble prediction for each target - NOTE: must be one of (`consensus`, `ff`)
 num_processes: 1 # the number of parallel processes to use for relaxation
diff --git a/configs/scripts/benchmark_baseline_compute_resources.yaml b/configs/scripts/benchmark_baseline_compute_resources.yaml
index ed60a9fd..ac6650c1 100644
--- a/configs/scripts/benchmark_baseline_compute_resources.yaml
+++ b/configs/scripts/benchmark_baseline_compute_resources.yaml
@@ -1,5 +1,5 @@
-method: diffdock # the method for which to score predictions - NOTE: must be one of (`diffdock`, `fabind`, `dynamicbind`, `neuralplexer`, `flowdock`, `rfaa`, `chai-lab`, `vina`, `ensemble`)
-vina_binding_site_method: p2rank # the method to use for Vina binding site prediction - NOTE: must be one of (`diffdock`, `fabind`, `dynamicbind`, `neuralplexer`, `flowdock`, `rfaa`, `chai-lab`, `p2rank`)
+method: diffdock # the method for which to score predictions - NOTE: must be one of (`diffdock`, `fabind`, `dynamicbind`, `neuralplexer`, `flowdock`, `rfaa`, `chai-lab`, `boltz`, `vina`, `ensemble`)
+vina_binding_site_method: p2rank # the method to use for Vina binding site prediction - NOTE: must be one of (`diffdock`, `fabind`, `dynamicbind`, `neuralplexer`, `flowdock`, `rfaa`, `chai-lab`, `boltz`, `p2rank`)
 dataset: astex_diverse # the dataset to use - NOTE: must be one of (`posebusters_benchmark`, `astex_diverse`, `dockgen`, `casp15`)
 repeat_index: 1 # the repeat index which was used for inference
 max_num_inputs: 21 # the number of (dataset subset) inputs over which to benchmark each baseline method's compute resource usage
diff --git a/configs/scripts/build_inference_script.yaml b/configs/scripts/build_inference_script.yaml
index 19398849..8cd637dd 100644
--- a/configs/scripts/build_inference_script.yaml
+++ b/configs/scripts/build_inference_script.yaml
@@ -1,6 +1,6 @@
 # run arguments:
-method: diffdock # the method for which to score predictions - NOTE: must be one of (`diffdock`, `fabind`, `dynamicbind`, `neuralplexer`, `flowdock`, `rfaa`, `chai-lab`, `vina`, `ensemble`)
-vina_binding_site_method: p2rank # the method to use for Vina binding site prediction - NOTE: must be one of (`diffdock`, `fabind`, `dynamicbind`, `neuralplexer`, `flowdock`, `rfaa`, `chai-lab`, `p2rank`)
+method: diffdock # the method for which to score predictions - NOTE: must be one of (`diffdock`, `fabind`, `dynamicbind`, `neuralplexer`, `flowdock`, `rfaa`, `chai-lab`, `boltz`, `vina`, `ensemble`)
+vina_binding_site_method: p2rank # the method to use for Vina binding site prediction - NOTE: must be one of (`diffdock`, `fabind`, `dynamicbind`, `neuralplexer`, `flowdock`, `rfaa`, `chai-lab`, `boltz`, `p2rank`)
 ensemble_ranking_method: consensus # the method to use for ensemble ranking - NOTE: must be one of (`consensus`, `ff`)
 dataset: astex_diverse # the dataset to use - NOTE: must be one of (`posebusters_benchmark`, `astex_diverse`, `dockgen`, `casp15`)
 repeat_index: 1 # the repeat index which was used for inference
@@ -22,6 +22,7 @@ methods_to_sweep: [
     "flowdock",
     "rfaa",
     "chai-lab",
+    "boltz",
     "vina",
     "ensemble",
   ] # the methods to sweep
diff --git a/docs/source/data_preparation.rst b/docs/source/data_preparation.rst
index 0f220b84..51f0cb01 100644
--- a/docs/source/data_preparation.rst
+++ b/docs/source/data_preparation.rst
@@ -6,4 +6,4 @@ How to prepare `PoseBench` data
     :end-line: 319
 
 .. note::
-    The preprocessed Astex Diverse, PoseBusters Benchmark, DockGen, and CASP15 data (available via Zenodo at https://doi.org/10.5281/zenodo.14629652) provide pre-holo-aligned protein structures predicted by AlphaFold 3 (and alternatively MIT-licensed ESMFold) for these respective datasets. Accordingly, users must ensure their usage of such predicted protein structures from AlphaFold 3 aligns with AlphaFold 3's Terms of Use at https://github.com/google-deepmind/alphafold3/blob/main/WEIGHTS_TERMS_OF_USE.md.
+    The preprocessed Astex Diverse, PoseBusters Benchmark, DockGen, and CASP15 data (available via Zenodo at https://doi.org/10.5281/zenodo.16791095) provide pre-holo-aligned protein structures predicted by AlphaFold 3 (and alternatively MIT-licensed ESMFold) for these respective datasets. Accordingly, users must ensure their usage of such predicted protein structures from AlphaFold 3 aligns with AlphaFold 3's Terms of Use at https://github.com/google-deepmind/alphafold3/blob/main/WEIGHTS_TERMS_OF_USE.md.
diff --git a/environments/boltz_environment.yaml b/environments/boltz_environment.yaml
new file mode 100644
index 00000000..755d36da
--- /dev/null
+++ b/environments/boltz_environment.yaml
@@ -0,0 +1,127 @@
+name: boltz
+channels:
+  - conda-forge
+dependencies:
+  - _libgcc_mutex=0.1=conda_forge
+  - _openmp_mutex=4.5=2_gnu
+  - bzip2=1.0.8=h4bc722e_7
+  - ca-certificates=2025.7.14=hbd8a1cb_0
+  - icu=75.1=he02047a_0
+  - ld_impl_linux-64=2.44=h1423503_1
+  - libexpat=2.7.1=hecca717_0
+  - libffi=3.4.6=h2dba641_1
+  - libgcc=15.1.0=h767d61c_4
+  - libgcc-ng=15.1.0=h69a702a_4
+  - libgomp=15.1.0=h767d61c_4
+  - liblzma=5.8.1=hb9d3cd8_2
+  - libnsl=2.0.1=hb9d3cd8_1
+  - libsqlite=3.50.3=hee844dc_1
+  - libstdcxx=15.1.0=h8f9b012_4
+  - libstdcxx-ng=15.1.0=h4852527_4
+  - libuuid=2.38.1=h0b41bf4_0
+  - libxcrypt=4.4.36=hd590300_1
+  - libzlib=1.3.1=hb9d3cd8_2
+  - ncurses=6.5=h2d0b736_3
+  - openssl=3.5.1=h7b32b05_0
+  - pip=25.1.1=pyh8b19718_0
+  - python=3.10.18=hd6af730_0_cpython
+  - readline=8.2=h8c095d6_2
+  - setuptools=80.9.0=pyhff2d567_0
+  - tk=8.6.13=noxft_hd72426e_102
+  - wheel=0.45.1=pyhd8ed1ab_1
+  - pip:
+      - aiohappyeyeballs==2.6.1
+      - aiohttp==3.12.15
+      - aiosignal==1.4.0
+      - antlr4-python3-runtime==4.9.3
+      - async-timeout==5.0.1
+      - attrs==25.3.0
+      - biopython==1.84
+      - certifi==2025.7.14
+      - charset-normalizer==3.4.2
+      - chembl-structure-pipeline==1.2.2
+      - click==8.1.7
+      - cuequivariance==0.5.1
+      - cuequivariance-ops-cu12==0.5.1
+      - cuequivariance-ops-torch-cu12==0.5.1
+      - cuequivariance-torch==0.5.1
+      - dm-tree==0.1.8
+      - docker-pycreds==0.4.0
+      - einops==0.8.0
+      - einx==0.3.0
+      - fairscale==0.4.13
+      - filelock==3.18.0
+      - frozendict==2.4.6
+      - frozenlist==1.7.0
+      - fsspec==2025.7.0
+      - gemmi==0.6.5
+      - gitdb==4.0.12
+      - gitpython==3.1.45
+      - hydra-core==1.3.2
+      - idna==3.10
+      - ihm==2.7
+      - jinja2==3.1.6
+      - joblib==1.5.1
+      - lightning-utilities==0.15.0
+      - llvmlite==0.44.0
+      - markupsafe==3.0.2
+      - mashumaro==3.14
+      - modelcif==1.2
+      - mpmath==1.3.0
+      - msgpack==1.1.1
+      - multidict==6.6.3
+      - networkx==3.4.2
+      - numba==0.61.0
+      - numpy==1.26.4
+      - nvidia-cublas-cu12==12.6.4.1
+      - nvidia-cuda-cupti-cu12==12.6.80
+      - nvidia-cuda-nvrtc-cu12==12.6.77
+      - nvidia-cuda-runtime-cu12==12.6.77
+      - nvidia-cudnn-cu12==9.5.1.17
+      - nvidia-cufft-cu12==11.3.0.4
+      - nvidia-cufile-cu12==1.11.1.6
+      - nvidia-curand-cu12==10.3.7.77
+      - nvidia-cusolver-cu12==11.7.1.2
+      - nvidia-cusparse-cu12==12.5.4.2
+      - nvidia-cusparselt-cu12==0.6.3
+      - nvidia-ml-py==12.575.51
+      - nvidia-nccl-cu12==2.26.2
+      - nvidia-nvjitlink-cu12==12.6.85
+      - nvidia-nvtx-cu12==12.6.77
+      - omegaconf==2.3.0
+      - opt-einsum==3.4.0
+      - packaging==25.0
+      - pandas==2.3.1
+      - pillow==11.3.0
+      - platformdirs==4.3.8
+      - propcache==0.3.2
+      - protobuf==5.29.5
+      - psutil==7.0.0
+      - pynvml==12.0.0
+      - python-dateutil==2.9.0.post0
+      - python-dotenv==1.1.1
+      - pytorch-lightning==2.5.0
+      - pytz==2025.2
+      - pyyaml==6.0.2
+      - rdkit==2025.3.3
+      - requests==2.32.3
+      - rootutils==1.0.7
+      - scikit-learn==1.6.1
+      - scipy==1.13.1
+      - sentry-sdk==2.34.1
+      - setproctitle==1.3.6
+      - six==1.17.0
+      - smmap==5.0.2
+      - sympy==1.14.0
+      - threadpoolctl==3.6.0
+      - torch==2.7.1
+      - torchmetrics==1.8.0
+      - tqdm==4.67.1
+      - triton==3.3.1
+      - types-requests==2.32.4.20250611
+      - typing-extensions==4.14.1
+      - tzdata==2025.2
+      - urllib3==2.5.0
+      - wandb==0.18.7
+      - yarl==1.20.1
+prefix: forks/boltz/boltz
diff --git a/environments/chai_lab_environment.yaml b/environments/chai_lab_environment.yaml
index 13a309e0..ad034fda 100644
--- a/environments/chai_lab_environment.yaml
+++ b/environments/chai_lab_environment.yaml
@@ -93,6 +93,7 @@ dependencies:
       - mpmath==1.3.0
       - msgpack==1.1.0
       - multidict==6.1.0
+      - multimethod==1.9
       - mypy==1.11.2
       - mypy-extensions==1.0.0
       - nest-asyncio==1.6.0
diff --git a/environments/flowdock_environment.yaml b/environments/flowdock_environment.yaml
index fff5886d..395de7cd 100644
--- a/environments/flowdock_environment.yaml
+++ b/environments/flowdock_environment.yaml
@@ -431,7 +431,7 @@ dependencies:
       - msgpack-numpy==0.4.8
       - numpy==1.23.5
       - git+https://github.com/amorehead/openfold.git@fe1275099639bf7e617e09ef24d6af778647dd64
-      - git+https://github.com/amorehead/posebusters.git@posebench
+      - git+https://github.com/amorehead/posebusters.git@posebench-0.7.0
       - git+https://git@github.com/zrqiao/power_spherical.git@290b1630c5f84e3bb0d61711046edcf6e47200d4
       - prody==2.4.1
       - protobuf==4.25.3
diff --git a/environments/posebench_environment.yaml b/environments/posebench_environment.yaml
index 0b4502bf..169be858 100644
--- a/environments/posebench_environment.yaml
+++ b/environments/posebench_environment.yaml
@@ -8,17 +8,22 @@ channels:
 dependencies:
   - _libgcc_mutex=0.1=conda_forge
   - _openmp_mutex=4.5=2_kmp_llvm
+  - aiohappyeyeballs=2.6.1=pyhd8ed1ab_0
   - alsa-lib=1.1.5=h516909a_1002
   - ambertools=23.3=py310h05519df_6
   - annotated-types=0.7.0=pyhd8ed1ab_0
   - antlr-python-runtime=4.9.3=pyhd8ed1ab_1
+  - aom=3.5.0=h27087fc_0
+  - argcomplete=3.6.2=pyhd8ed1ab_0
   - argon2-cffi=23.1.0=pyhd8ed1ab_0
   - argon2-cffi-bindings=21.2.0=py310h2372a71_4
+  - aria2=1.36.0=h43d1f13_4
   - arpack=3.8.0=nompi_h0baa96a_101
   - arrow=1.3.0=pyhd8ed1ab_0
   - astunparse=1.6.3=pyhd8ed1ab_0
   - async-lru=2.0.4=pyhd8ed1ab_0
   - attrs=23.2.0=pyh71513ae_0
+  - autopep8=2.3.2=pyhd8ed1ab_0
   - babel=2.14.0=pyhd8ed1ab_0
   - beautifulsoup4=4.12.3=pyha770c72_0
   - binutils=2.39=hdd6e379_1
@@ -30,6 +35,7 @@ dependencies:
   - blosc=1.21.5=hc2324a3_1
   - boost=1.82.0=h17c5347_6
   - boost-cpp=1.82.0=h44aadfe_6
+  - boto=2.49.0=pyhd8ed1ab_1
   - brotli=1.1.0=hd590300_1
   - brotli-bin=1.1.0=hd590300_1
   - brotli-python=1.1.0=py310hc6cd4ac_1
@@ -38,15 +44,18 @@ dependencies:
   - c-ares=1.28.1=hd590300_0
   - c-blosc2=2.14.4=hb4ffafa_1
   - c-compiler=1.5.0=h166bdaf_0
-  - ca-certificates=2024.12.14=hbcca054_0
+  - ca-certificates=2025.8.3=hbd8a1cb_0
   - cached-property=1.5.2=hd8ed1ab_1
   - cached_property=1.5.2=pyha770c72_1
   - cachetools=5.3.3=pyhd8ed1ab_0
   - cairo=1.18.0=h3faef2a_0
-  - certifi=2024.12.14=pyhd8ed1ab_0
+  - certifi=2025.8.3=pyhd8ed1ab_0
   - cffi=1.16.0=py310h2fee648_0
   - charset-normalizer=3.3.2=pyhd8ed1ab_0
+  - codespell=2.4.1=pyhd8ed1ab_0
   - colorama=0.4.6=pyhd8ed1ab_0
+  - crcmod=1.7=py310ha75aee5_1011
+  - cryptography=43.0.3=py310h6c63255_0
   - cuda-cudart=11.8.89=0
   - cuda-cupti=11.8.87=0
   - cuda-libraries=11.8.0=0
@@ -58,12 +67,14 @@ dependencies:
   - cxx-compiler=1.5.0=h924138e_0
   - cycler=0.12.1=pyhd8ed1ab_0
   - cython=3.0.10=py310hc6cd4ac_0
+  - dav1d=1.2.1=hd590300_0
   - debugpy=1.8.1=py310hc6cd4ac_0
   - decorator=5.1.1=pyhd8ed1ab_0
   - defusedxml=0.7.1=pyhd8ed1ab_0
   - entrypoints=0.4=pyhd8ed1ab_0
   - exceptiongroup=1.2.0=pyhd8ed1ab_2
   - expat=2.6.2=h59595ed_0
+  - fasteners=0.19=pyhd8ed1ab_1
   - ffmpeg=4.3=hf484d3e_0
   - fftw=3.3.10=nompi_hc118613_108
   - filelock=3.14.0=pyhd8ed1ab_0
@@ -76,22 +87,34 @@ dependencies:
   - fonts-conda-forge=1=0
   - fqdn=1.5.1=pyhd8ed1ab_0
   - freetype=2.12.1=h267a509_2
+  - fribidi=1.0.10=h36c2ea0_0
+  - gawk=5.3.1=hcd3d067_0
   - gcc=10.4.0=hb92f740_13
   - gcc_impl_linux-64=10.4.0=h5231bdf_19
   - gcc_linux-64=10.4.0=h9215b83_13
+  - gcs-oauth2-boto-plugin=3.3=pyhd8ed1ab_0
+  - gettext=0.22.5=he02047a_3
+  - gettext-tools=0.22.5=he02047a_3
   - giflib=5.2.2=hd590300_0
   - gmp=6.3.0=h59595ed_1
   - gmpy2=2.1.5=py310hc7909c9_1
   - gnutls=3.6.13=h85f3911_1
+  - google-apitools=0.5.32=pyhd8ed1ab_1
+  - google-auth-httplib2=0.2.0=pyhd8ed1ab_1
+  - google-reauth=0.1.1=pyhd8ed1ab_1
+  - graphite2=1.3.13=h59595ed_1003
+  - gsutil=5.35=pyhd8ed1ab_0
   - gxx=10.4.0=hb92f740_13
   - gxx_impl_linux-64=10.4.0=h5231bdf_19
   - gxx_linux-64=10.4.0=h6e491c6_13
   - h11=0.14.0=pyhd8ed1ab_0
   - h2=4.1.0=pyhd8ed1ab_0
+  - harfbuzz=9.0.0=hfac3d4d_0
   - hdf4=4.2.15=h9772cbc_5
   - hdf5=1.14.3=nompi_hdf9ad27_102
   - hpack=4.0.0=pyh9f0ad1d_0
   - httpcore=1.0.5=pyhd8ed1ab_0
+  - httplib2=0.20.4=pyhd8ed1ab_0
   - httpx=0.27.0=pyhd8ed1ab_0
   - hydra-core=1.3.2=pyhd8ed1ab_0
   - hyperframe=6.0.1=pyhd8ed1ab_0
@@ -100,7 +123,6 @@ dependencies:
   - importlib-metadata=7.1.0=pyha770c72_0
   - importlib_metadata=7.1.0=hd8ed1ab_0
   - importlib_resources=6.4.0=pyhd8ed1ab_0
-  - ipywidgets=8.1.3=pyhd8ed1ab_0
   - isoduration=20.11.0=pyhd8ed1ab_0
   - jinja2=3.1.4=pyhd8ed1ab_0
   - joblib=1.4.2=pyhd8ed1ab_1
@@ -119,7 +141,6 @@ dependencies:
   - jupyterlab=4.2.1=pyhd8ed1ab_0
   - jupyterlab_pygments=0.3.0=pyhd8ed1ab_1
   - jupyterlab_server=2.27.2=pyhd8ed1ab_0
-  - jupyterlab_widgets=3.0.11=pyhd8ed1ab_0
   - kernel-headers_linux-64=2.6.32=he073ed8_17
   - keyutils=1.6.1=h166bdaf_0
   - kiwisolver=1.4.5=py310hd41b1e2_1
@@ -129,6 +150,9 @@ dependencies:
   - ld_impl_linux-64=2.39=hcc3a1bd_1
   - lerc=3.0=h9c3ff4c_0
   - libaec=1.1.3=h59595ed_0
+  - libasprintf=0.22.5=he8f35ee_3
+  - libasprintf-devel=0.22.5=he8f35ee_3
+  - libass=0.17.1=h8fe9dca_1
   - libblas=3.9.0=16_linux64_mkl
   - libboost=1.82.0=h6fcfa73_6
   - libboost-devel=1.82.0=h00ab1b0_6
@@ -147,6 +171,7 @@ dependencies:
   - libcusolver=11.4.1.48=0
   - libcusparse=11.7.5.86=0
   - libdeflate=1.10=h7f98852_0
+  - libdrm=2.4.124=hb9d3cd8_0
   - libedit=3.1.20191231=he28a2e2_2
   - libev=4.33=hd590300_2
   - libexpat=2.6.2=h59595ed_0
@@ -154,12 +179,15 @@ dependencies:
   - libgcc=14.2.0=h77fa898_1
   - libgcc-devel_linux-64=10.4.0=hd38fd1e_19
   - libgcc-ng=14.2.0=h69a702a_1
+  - libgettextpo=0.22.5=he02047a_3
+  - libgettextpo-devel=0.22.5=he02047a_3
   - libgfortran-ng=13.2.0=h69a702a_0
   - libgfortran5=13.2.0=ha4646dd_0
   - libglib=2.80.2=hf974151_0
   - libgomp=14.2.0=h77fa898_1
   - libhwloc=2.10.0=default_h5622ce7_1001
   - libiconv=1.17=hd590300_2
+  - libidn2=2.3.7=hd590300_0
   - libjpeg-turbo=2.0.0=h9bf148f_0
   - liblapack=3.9.0=16_linux64_mkl
   - liblapacke=3.9.0=16_linux64_mkl
@@ -168,6 +196,8 @@ dependencies:
   - libnpp=11.8.0.86=0
   - libnsl=2.0.1=hd590300_0
   - libnvjpeg=11.9.0.86=0
+  - libopus=1.3.1=h7f98852_1
+  - libpciaccess=0.18=hd590300_0
   - libpng=1.6.43=h2797004_0
   - libsanitizer=10.4.0=h5246dfb_19
   - libsodium=1.0.18=h36c2ea0_1
@@ -176,8 +206,12 @@ dependencies:
   - libstdcxx=14.2.0=hc0a3c3a_1
   - libstdcxx-devel_linux-64=10.4.0=hd38fd1e_19
   - libstdcxx-ng=13.2.0=hc0a3c3a_7
+  - libtasn1=4.19.0=h166bdaf_0
   - libtiff=4.3.0=h0fcbabc_4
+  - libunistring=0.9.10=h7f98852_0
   - libuuid=2.38.1=h0b41bf4_0
+  - libva=2.18.0=h0b41bf4_0
+  - libvpx=1.13.1=h59595ed_0
   - libwebp-base=1.4.0=hd590300_0
   - libxcb=1.15=h0b41bf4_0
   - libxcrypt=4.4.36=hd590300_1
@@ -188,20 +222,25 @@ dependencies:
   - llvm-openmp=15.0.7=h0cdce71_0
   - lz4-c=1.9.4=hcb278e6_0
   - lzo=2.10=hd590300_1001
+  - markdown-it-py=3.0.0=pyhd8ed1ab_1
   - markupsafe=2.1.5=py310h2372a71_0
   - matplotlib-base=3.8.4=py310hef631a5_2
   - matplotlib-inline=0.1.7=pyhd8ed1ab_0
   - mda-xdrlib=0.2.0=pyhd8ed1ab_0
+  - mdformat=0.7.22=pyhd8ed1ab_0
   - mdtraj=1.9.9=py310h523e8d7_1
+  - mdurl=0.1.2=pyhd8ed1ab_1
   - mkl=2022.1.0=h84fe81f_915
   - mkl-devel=2022.1.0=ha770c72_916
   - mkl-include=2022.1.0=h84fe81f_915
   # - mmseqs2=17.b804f=hd6d6fdc_1  # NOTE: This package is only required for failure mode analyses
+  - monotonic=1.6=pyhd8ed1ab_0
   - mpc=1.3.1=hfe3b2da_0
   - mpfr=4.2.1=h9458935_1
   - munkres=1.1.4=pyh9f0ad1d_0
   - nbclient=0.10.0=pyhd8ed1ab_0
   - nbformat=5.10.4=pyhd8ed1ab_0
+  - nbqa=1.9.0=pyhd8ed1ab_0
   - ncurses=6.5=h59595ed_0
   - nest-asyncio=1.6.0=pyhd8ed1ab_0
   - netcdf-fortran=4.6.1=nompi_hacb5139_103
@@ -211,6 +250,7 @@ dependencies:
   - notebook-shim=0.2.4=pyhd8ed1ab_0
   - numexpr=2.7.3=py310hb5077e9_1
   - numpy=1.26.4=py310hb13e2d6_0
+  - oauth2client=4.1.3=pyhd8ed1ab_1
   - ocl-icd=2.3.2=hd590300_1
   - ocl-icd-system=1.0.0=1
   - olefile=0.47=pyhd8ed1ab_0
@@ -230,8 +270,9 @@ dependencies:
   - openjpeg=2.5.0=h7d73246_0
   - openmm=8.1.1=py310h43b6314_1
   - openmmforcefields=0.14.1=pyhd8ed1ab_0
-  - openssl=3.4.0=hb9d3cd8_0
+  - openssl=3.5.2=h26f9b46_0
   - overrides=7.7.0=pyhd8ed1ab_0
+  - p11-kit=0.24.1=hc5aa10d_0
   - packmol=20.14.4=ha36c22a_0
   - pandocfilters=1.5.0=pyhd8ed1ab_0
   - panedr=0.8.0=pyhd8ed1ab_0
@@ -248,16 +289,21 @@ dependencies:
   - pkgutil-resolve-name=1.3.10=pyhd8ed1ab_1
   - platformdirs=4.2.2=pyhd8ed1ab_0
   - prometheus_client=0.20.0=pyhd8ed1ab_0
+  - propcache=0.3.1=py310h89163eb_0
   - psutil=5.9.8=py310h2372a71_0
   - pthread-stubs=0.4=h36c2ea0_1001
   - ptyprocess=0.7.0=pyhd3deb0d_0
   - pure_eval=0.2.2=pyhd8ed1ab_0
   - py-cpuinfo=9.0.0=pyhd8ed1ab_0
+  - pyasn1=0.6.1=pyhd8ed1ab_2
+  - pyasn1-modules=0.4.2=pyhd8ed1ab_0
   - pycairo=1.26.0=py310hda9f760_0
+  - pycodestyle=2.12.1=pyhd8ed1ab_1
   - pycparser=2.22=pyhd8ed1ab_0
   - pydantic-core=2.18.3=py310he421c4c_0
   - pyedr=0.8.0=pyhd8ed1ab_0
   - pygments=2.18.0=pyhd8ed1ab_0
+  - pyopenssl=24.2.1=pyhd8ed1ab_2
   - pyparsing=3.1.1=pyhd8ed1ab_0
   - pysocks=1.7.1=pyha2e5f31_6
   - pytables=3.9.2=py310hd76cd5d_2
@@ -271,30 +317,34 @@ dependencies:
   - pytorch=2.3.0=py3.10_cuda11.8_cudnn8.7.0_0
   - pytorch-cuda=11.8=h7e8668a_5
   - pytorch-mutex=1.0=cuda
+  - pyu2f=0.1.5=pyhd8ed1ab_1
   - pyyaml=6.0.1=py310h2372a71_1
-  - rdkit=2023.09.6=py310hb79e901_1
   - readline=8.2=h8228510_1
   - reduce=4.14=py310h8ea774a_3
   - referencing=0.35.1=pyhd8ed1ab_0
   - reportlab=3.5.68=py310h94fcab3_1
   - requests=2.32.3=pyhd8ed1ab_1
+  - retry_decorator=1.1.1=pyhd8ed1ab_1
   - rfc3339-validator=0.1.4=pyhd8ed1ab_0
   - rfc3986-validator=0.1.1=pyh9f0ad1d_0
   - rpds-py=0.18.1=py310he421c4c_0
   - send2trash=1.8.3=pyh0d859eb_0
   - setuptools=70.0.0=pyhd8ed1ab_0
-  - six=1.16.0=pyh6c4a22f_0
+  - shellcheck=0.10.0=ha770c72_0
+  - six=1.17.0=pyhe01879c_1
   - smirnoff99frosst=1.1.0=pyh44b312d_0
   - snappy=1.2.0=hdb0a2a9_1
   - sniffio=1.3.1=pyhd8ed1ab_0
   - soupsieve=2.5=pyhd8ed1ab_1
   - stack_data=0.6.2=pyhd8ed1ab_0
+  - svt-av1=1.6.0=h59595ed_0
   - sysroot_linux-64=2.12=he073ed8_17
   - tbb=2021.12.0=h297d8ca_1
   - terminado=0.18.1=pyh0d859eb_0
   - tinycss2=1.3.0=pyhd8ed1ab_0
   - tinydb=4.8.0=pyhd8ed1ab_0
   - tk=8.6.13=noxft_h4845f30_101
+  - tokenize-rt=6.1.0=pyhd8ed1ab_1
   - tomli=2.0.1=pyhd8ed1ab_0
   - torchaudio=2.3.0=py310_cu118
   - torchtriton=2.3.0=py310
@@ -316,7 +366,8 @@ dependencies:
   - webencodings=0.5.1=pyhd8ed1ab_2
   - websocket-client=1.8.0=pyhd8ed1ab_0
   - wheel=0.43.0=pyhd8ed1ab_1
-  - widgetsnbextension=4.0.11=pyhd8ed1ab_0
+  - x264=1!164.3095=h166bdaf_2
+  - x265=3.5=h924138e_3
   - xmltodict=0.13.0=pyhd8ed1ab_0
   - xorg-fixesproto=5.0=h7f98852_1002
   - xorg-inputproto=2.3.2=h7f98852_1002
@@ -360,18 +411,23 @@ dependencies:
       - biopandas==0.5.1.dev0
       - biopython==1.79
       - bioservices==1.11.2
+      - biotite==1.2.0
+      - biotraj==1.2.2
       - boto3==1.28.66
       - botocore==1.31.66
       - cattrs==23.1.2
       - cfgv==3.4.0
+      - cli-exit-tools==1.2.7
       - click==8.1.7
       - cliff==4.3.0
+      - cloudpathlib==0.21.1
       - cmaes==0.10.0
       - cmd2==2.4.3
       - colorlog==6.7.0
       - comm==0.2.0
       - contextlib2==21.6.0
       - contourpy==1.1.0
+      - cramjam==2.9.1
       - datamol==0.12.4
       - deepspeed==0.9.4
       - dill==0.3.8
@@ -380,22 +436,34 @@ dependencies:
       - dm-tree==0.1.8
       - docker-pycreds==0.4.0
       - docutils==0.20.1
+      - duckdb==1.3.2
       - easydev==0.12.1
       - edgembar==0.2
       - einops==0.6.1
+      - eval-type-backport==0.2.2
       - executing==1.2.0
       - fair-esm==2.0.0
       - fastapi==0.104.0
       - fastcore==1.5.29
-      - fasteners==0.19
+      - fastparquet==2024.11.0
       - fonttools==4.42.1
       - frozenlist==1.4.0
-      - fsspec==2023.12.0
+      - fsspec==2025.7.0
       - furo==2024.5.6
+      - future==1.0.0
+      - gcsfs==2025.7.0
       - gemmi==0.6.7
       - gevent==23.9.1
       - gitdb==4.0.10
       - gitpython==3.1.32
+      - google-api-core==2.25.1
+      - google-auth==2.40.3
+      - google-auth-oauthlib==1.2.2
+      - google-cloud-core==2.4.3
+      - google-cloud-storage==3.2.0
+      - google-crc32c==1.7.1
+      - google-resumable-media==2.7.2
+      - googleapis-common-protos==1.70.0
       - greenlet==2.0.2
       - grequests==0.7.0
       - griddataformats==1.0.2
@@ -408,9 +476,13 @@ dependencies:
       - ipdb==0.13.13
       - ipykernel==6.27.1
       - ipython==8.18.0
+      - ipython-genutils==0.2.0
+      - ipywidgets==7.8.5
       - jaxtyping==0.2.21
       - jedi==0.19.0
       - jmespath==1.0.1
+      - jupyterlab-widgets==1.1.11
+      - lib-detect-testenv==2.0.8
       - lightning==2.1.3
       - lightning-cloud==0.5.61
       - lightning-utilities==0.10.0
@@ -421,15 +493,15 @@ dependencies:
       - lxml==4.9.3
       - m2r2==0.3.3.post2
       - mako==1.2.4
-      - markdown-it-py==3.0.0
       - mdahole2==0.5.0
       - mdanalysis==2.8.0
-      - mdurl==0.1.2
       - git+https://github.com/amorehead/Meeko.git@patch-1
       - mistune==0.8.4
       - ml-collections==0.1.1
+      - mmcif==0.92.0
       - mmpbsa-py==16.0
       - mmtf-python==1.1.3
+      - mols2grid==2.0.0
       - mpmath==1.2.1
       - mrcfile==1.5.0
       - msgpack==1.0.8
@@ -442,11 +514,12 @@ dependencies:
       - nglview==3.0.8
       - ninja==1.11.1
       - nodeenv==1.9.0
+      - oauthlib==3.3.1
       - git+https://github.com/amorehead/openfold.git@4ef71646ed031f69716097a9352d21778369136d
       - opt-einsum==3.3.0
       - opt-einsum-fx==0.1.4
       - optuna==2.10.1
-      - packaging==21.3
+      - packaging==25.0
       - packmol-memgen==2023.2.24
       - pandas==1.5.0
       - pandoc==2.3
@@ -458,17 +531,19 @@ dependencies:
       - pdb4amber==22.0
       - pdbeccdutils==0.8.6
       - pillow==10.4.0
+      - git+https://github.com/amorehead/plinder.git@posebench
       - plotly==5.17.0
       - plumbum==1.8.3
       - ply==3.11
       - poethepoet==0.10.0
-      - git+https://github.com/amorehead/posebusters.git@posebench
+      - git+https://github.com/amorehead/posebusters.git@posebench-0.7.0
       - git+https://github.com/amorehead/posecheck.git@posebench
       - pot==0.9.1
       - pre-commit==3.6.2
       - prettytable==3.8.0
       - git+https://github.com/amorehead/ProLIF.git@patch-2
       - prompt-toolkit==3.0.39
+      - proto-plus==1.26.1
       - protobuf==4.24.1
       - pyaml==21.10.1
       - pyarrow==18.1.0
@@ -484,16 +559,19 @@ dependencies:
       - pytraj==2.0.6
       - pytz==2022.4
       - pyzmq==25.1.1
+      - rdkit==2025.3.5
       - regex==2023.10.3
       - requests-cache==1.1.0
+      - requests-oauthlib==2.0.0
       - rich==13.7.1
       - rich-click==1.6.1
       - roma==1.4.1
       - rootutils==1.0.7
+      - rsa==4.9.1
       - s3transfer==0.7.0
       - sander==22.0
       - scikit-learn==1.1.2
-      - scipy==1.15.1
+      - scipy==1.9.1
       - seaborn==0.12.2
       - selfies==2.1.1
       - sentry-sdk==1.29.2
@@ -530,6 +608,7 @@ dependencies:
       - waterdynamics==1.2.0
       - watermark==2.4.3
       - wget==3.2
+      - widgetsnbextension==3.6.10
       - wrapt==1.15.0
       - wrapt_timeout_decorator==1.5.1
       - xarray==2023.8.0
diff --git a/environments/rfaa_environment.yaml b/environments/rfaa_environment.yaml
index 2db807c4..f7f910a2 100644
--- a/environments/rfaa_environment.yaml
+++ b/environments/rfaa_environment.yaml
@@ -469,7 +469,7 @@ dependencies:
       - pandas==2.2.2
       - pathtools==0.1.2
       - pdb4amber==22.0
-      - git+https://github.com/amorehead/posebusters.git@posebench
+      - git+https://github.com/amorehead/posebusters.git@posebench-0.7.0
       - prody==2.4.1
       - promise==2.3
       - pynvml==11.0.0
diff --git a/forks/boltz/.gitignore b/forks/boltz/.gitignore
new file mode 100644
index 00000000..3d20fc11
--- /dev/null
+++ b/forks/boltz/.gitignore
@@ -0,0 +1,166 @@
+# Byte-compiled / optimized / DLL files
+__pycache__/
+*.py[cod]
+*$py.class
+
+# C extensions
+*.so
+
+# Distribution / packaging
+.Python
+build/
+develop-eggs/
+dist/
+downloads/
+eggs/
+.eggs/
+lib/
+lib64/
+parts/
+sdist/
+var/
+wheels/
+share/python-wheels/
+*.egg-info/
+.installed.cfg
+*.egg
+MANIFEST
+
+# PyInstaller
+#  Usually these files are written by a python script from a template
+#  before PyInstaller builds the exe, so as to inject date/other infos into it.
+*.manifest
+*.spec
+
+# Installer logs
+pip-log.txt
+pip-delete-this-directory.txt
+
+# Unit test / coverage reports
+htmlcov/
+.tox/
+.nox/
+.coverage
+.coverage.*
+.cache
+nosetests.xml
+coverage.xml
+*.cover
+*.py,cover
+.hypothesis/
+.pytest_cache/
+cover/
+
+# Translations
+*.mo
+*.pot
+
+# Django stuff:
+*.log
+local_settings.py
+db.sqlite3
+db.sqlite3-journal
+
+# Flask stuff:
+instance/
+.webassets-cache
+
+# Scrapy stuff:
+.scrapy
+
+# Sphinx documentation
+docs/_build/
+
+# PyBuilder
+.pybuilder/
+target/
+
+# Jupyter Notebook
+.ipynb_checkpoints
+
+# IPython
+profile_default/
+ipython_config.py
+
+# pyenv
+#   For a library or package, you might want to ignore these files since the code is
+#   intended to run in multiple environments; otherwise, check them in:
+# .python-version
+
+# pipenv
+#   According to pypa/pipenv#598, it is recommended to include Pipfile.lock in version control.
+#   However, in case of collaboration, if having platform-specific dependencies or dependencies
+#   having no cross-platform support, pipenv may install dependencies that don't work, or not
+#   install all needed dependencies.
+#Pipfile.lock
+
+# poetry
+#   Similar to Pipfile.lock, it is generally recommended to include poetry.lock in version control.
+#   This is especially recommended for binary packages to ensure reproducibility, and is more
+#   commonly ignored for libraries.
+#   https://python-poetry.org/docs/basic-usage/#commit-your-poetrylock-file-to-version-control
+#poetry.lock
+
+# pdm
+#   Similar to Pipfile.lock, it is generally recommended to include pdm.lock in version control.
+#pdm.lock
+#   pdm stores project-wide configurations in .pdm.toml, but it is recommended to not include it
+#   in version control.
+#   https://pdm.fming.dev/latest/usage/project/#working-with-version-control
+.pdm.toml
+.pdm-python
+.pdm-build/
+
+# PEP 582; used by e.g. github.com/David-OConnor/pyflow and github.com/pdm-project/pdm
+__pypackages__/
+
+# Celery stuff
+celerybeat-schedule
+celerybeat.pid
+
+# SageMath parsed files
+*.sage.py
+
+# Environments
+.env
+.venv
+env/
+venv/
+ENV/
+env.bak/
+venv.bak/
+
+# Spyder project settings
+.spyderproject
+.spyproject
+
+# Rope project settings
+.ropeproject
+
+# mkdocs documentation
+/site
+
+# mypy
+.mypy_cache/
+.dmypy.json
+dmypy.json
+
+# Pyre type checker
+.pyre/
+
+# pytype static type analyzer
+.pytype/
+
+# Cython debug symbols
+cython_debug/
+
+# PyCharm
+#  JetBrains specific template is maintained in a separate JetBrains.gitignore that can
+#  be found at https://github.com/github/gitignore/blob/main/Global/JetBrains.gitignore
+#  and can be added to the global gitignore or merged into this file.  For a more nuclear
+#  option (not recommended) you can uncomment the following to ignore the entire idea folder.
+#.idea/
+
+# Boltz prediction outputs
+#   All result files generated from a boltz prediction call
+boltz_results_*/
\ No newline at end of file
diff --git a/forks/boltz/LICENSE b/forks/boltz/LICENSE
new file mode 100644
index 00000000..a9d65753
--- /dev/null
+++ b/forks/boltz/LICENSE
@@ -0,0 +1,21 @@
+MIT License
+
+Copyright (c) 2024 Jeremy Wohlwend, Gabriele Corso, Saro Passaro
+
+Permission is hereby granted, free of charge, to any person obtaining a copy
+of this software and associated documentation files (the "Software"), to deal
+in the Software without restriction, including without limitation the rights
+to use, copy, modify, merge, publish, distribute, sublicense, and/or sell
+copies of the Software, and to permit persons to whom the Software is
+furnished to do so, subject to the following conditions:
+
+The above copyright notice and this permission notice shall be included in all
+copies or substantial portions of the Software.
+
+THE SOFTWARE IS PROVIDED "AS IS", WITHOUT WARRANTY OF ANY KIND, EXPRESS OR
+IMPLIED, INCLUDING BUT NOT LIMITED TO THE WARRANTIES OF MERCHANTABILITY,
+FITNESS FOR A PARTICULAR PURPOSE AND NONINFRINGEMENT. IN NO EVENT SHALL THE
+AUTHORS OR COPYRIGHT HOLDERS BE LIABLE FOR ANY CLAIM, DAMAGES OR OTHER
+LIABILITY, WHETHER IN AN ACTION OF CONTRACT, TORT OR OTHERWISE, ARISING FROM,
+OUT OF OR IN CONNECTION WITH THE SOFTWARE OR THE USE OR OTHER DEALINGS IN THE
+SOFTWARE.
diff --git a/forks/boltz/README.md b/forks/boltz/README.md
new file mode 100644
index 00000000..d16a003f
--- /dev/null
+++ b/forks/boltz/README.md
@@ -0,0 +1,117 @@
+<div align="center">
+  <div>&nbsp;</div>
+  <img src="docs/boltz2_title.png" width="300"/>
+  <img src="https://model-gateway.boltz.bio/a.png?x-pxid=bce1627f-f326-4bff-8a97-45c6c3bc929d" />
+
+[Boltz-1](https://doi.org/10.1101/2024.11.19.624167) | [Boltz-2](https://doi.org/10.1101/2025.06.14.659707) |
+[Slack](https://boltz.bio/join-slack) | Commit: `ac33fe07eb8336c5046b740ffeedf1345fcb00af` <br> <br>
+</div>
+
+
+
+![](docs/boltz1_pred_figure.png)
+
+
+## Introduction
+
+Boltz is a family of models for biomolecular interaction prediction. Boltz-1 was the first fully open source model to approach AlphaFold3 accuracy. Our latest work Boltz-2 is a new biomolecular foundation model that goes beyond AlphaFold3 and Boltz-1 by jointly modeling complex structures and binding affinities, a critical component towards accurate molecular design. Boltz-2 is the first deep learning model to approach the accuracy of physics-based free-energy perturbation (FEP) methods, while running 1000x faster — making accurate in silico screening practical for early-stage drug discovery.
+
+All the code and weights are provided under MIT license, making them freely available for both academic and commercial uses. For more information about the model, see the [Boltz-1](https://doi.org/10.1101/2024.11.19.624167) and [Boltz-2](https://doi.org/10.1101/2025.06.14.659707) technical reports. To discuss updates, tools and applications join our [Slack channel](https://boltz.bio/join-slack).
+
+## Installation
+
+> Note: we recommend installing boltz in a fresh python environment
+
+Install boltz with PyPI (recommended):
+
+```
+pip install boltz[cuda] -U
+```
+
+or directly from GitHub for daily updates:
+
+```
+git clone https://github.com/jwohlwend/boltz.git
+cd boltz; pip install -e .[cuda]
+```
+
+If you are installing on CPU-only or non-CUDA GPus hardware, remove `[cuda]` from the above commands. Note that the CPU version is significantly slower than the GPU version.
+
+## Inference
+
+You can run inference using Boltz with:
+
+```
+boltz predict input_path --use_msa_server
+```
+
+`input_path` should point to a YAML file, or a directory of YAML files for batched processing, describing the biomolecules you want to model and the properties you want to predict (e.g. affinity). To see all available options: `boltz predict --help` and for more information on these input formats, see our [prediction instructions](docs/prediction.md). By default, the `boltz` command will run the latest version of the model.
+
+
+### Binding Affinity Prediction
+There are two main predictions in the affinity output: `affinity_pred_value` and `affinity_probability_binary`. They are trained on largely different datasets, with different supervisions, and should be used in different contexts. The `affinity_probability_binary` field should be used to detect binders from decoys, for example in a hit-discovery stage. It's value ranges from 0 to 1 and represents the predicted probability that the ligand is a binder. The `affinity_pred_value` aims to measure the specific affinity of different binders and how this changes with small modifications of the molecule. This should be used in ligand optimization stages such as hit-to-lead and lead-optimization. It reports a binding affinity value as `log(IC50)`, derived from an `IC50` measured in `μM`. More details on how to run affinity predictions and parse the output can be found in our [prediction instructions](docs/prediction.md).
+
+## Authentication to MSA Server
+
+When using the `--use_msa_server` option with a server that requires authentication, you can provide credentials in one of two ways. More information is available in our [prediction instructions](docs/prediction.md).
+ 
+## Evaluation
+
+⚠️ **Coming soon: updated evaluation code for Boltz-2!**
+
+To encourage reproducibility and facilitate comparison with other models, on top of the existing Boltz-1 evaluation pipeline, we will soon provide the evaluation scripts and structural predictions for Boltz-2, Boltz-1, Chai-1 and AlphaFold3 on our test benchmark dataset, and our affinity predictions on the FEP+ benchmark, CASP16 and our MF-PCBA test set.
+
+![Affinity test sets evaluations](docs/pearson_plot.png)
+![Test set evaluations](docs/plot_test_boltz2.png)
+
+
+## Training
+
+⚠️ **Coming soon: updated training code for Boltz-2!**
+
+If you're interested in retraining the model, currently for Boltz-1 but soon for Boltz-2, see our [training instructions](docs/training.md).
+
+
+## Contributing
+
+We welcome external contributions and are eager to engage with the community. Connect with us on our [Slack channel](https://boltz.bio/join-slack) to discuss advancements, share insights, and foster collaboration around Boltz-2.
+
+On recent NVIDIA GPUs, Boltz leverages the acceleration provided by [NVIDIA  cuEquivariance](https://developer.nvidia.com/cuequivariance) kernels. Boltz also runs on Tenstorrent hardware thanks to a [fork](https://github.com/moritztng/tt-boltz) by Moritz Thüning.
+
+## License
+
+Our model and code are released under MIT License, and can be freely used for both academic and commercial purposes.
+
+
+## Cite
+
+If you use this code or the models in your research, please cite the following papers:
+
+```bibtex
+@article{passaro2025boltz2,
+  author = {Passaro, Saro and Corso, Gabriele and Wohlwend, Jeremy and Reveiz, Mateo and Thaler, Stephan and Somnath, Vignesh Ram and Getz, Noah and Portnoi, Tally and Roy, Julien and Stark, Hannes and Kwabi-Addo, David and Beaini, Dominique and Jaakkola, Tommi and Barzilay, Regina},
+  title = {Boltz-2: Towards Accurate and Efficient Binding Affinity Prediction},
+  year = {2025},
+  doi = {10.1101/2025.06.14.659707},
+  journal = {bioRxiv}
+}
+
+@article{wohlwend2024boltz1,
+  author = {Wohlwend, Jeremy and Corso, Gabriele and Passaro, Saro and Getz, Noah and Reveiz, Mateo and Leidal, Ken and Swiderski, Wojtek and Atkinson, Liam and Portnoi, Tally and Chinn, Itamar and Silterra, Jacob and Jaakkola, Tommi and Barzilay, Regina},
+  title = {Boltz-1: Democratizing Biomolecular Interaction Modeling},
+  year = {2024},
+  doi = {10.1101/2024.11.19.624167},
+  journal = {bioRxiv}
+}
+```
+
+In addition if you use the automatic MSA generation, please cite:
+
+```bibtex
+@article{mirdita2022colabfold,
+  title={ColabFold: making protein folding accessible to all},
+  author={Mirdita, Milot and Sch{\"u}tze, Konstantin and Moriwaki, Yoshitaka and Heo, Lim and Ovchinnikov, Sergey and Steinegger, Martin},
+  journal={Nature methods},
+  year={2022},
+}
+```
diff --git a/forks/boltz/docs/boltz1_pred_figure.png b/forks/boltz/docs/boltz1_pred_figure.png
new file mode 100644
index 00000000..e55f26c5
Binary files /dev/null and b/forks/boltz/docs/boltz1_pred_figure.png differ
diff --git a/forks/boltz/docs/boltz2_title.png b/forks/boltz/docs/boltz2_title.png
new file mode 100644
index 00000000..d01a8dd8
Binary files /dev/null and b/forks/boltz/docs/boltz2_title.png differ
diff --git a/forks/boltz/docs/evaluation.md b/forks/boltz/docs/evaluation.md
new file mode 100644
index 00000000..ae8f063b
--- /dev/null
+++ b/forks/boltz/docs/evaluation.md
@@ -0,0 +1,73 @@
+# Evaluation
+
+To encourage reproducibility and facilitate comparison with other models, we will provide the evaluation scripts and structural predictions for Boltz-2, Boltz-1, Chai-1 and AlphaFold3 on our test benchmark dataset, and our affinity predictions on the FEP+ benchamark, CASP16 and our MF-PCBA test set.
+
+![Test set evaluations](plot_test_boltz2.png)
+![Affinity test sets evaluations](pearson_plot.png)
+
+
+## Evaluation files
+⚠️ **Coming soon updated evaluation files for Boltz-2!**
+
+
+## Evaluation setup
+⚠️ **Coming soon updated setup for Boltz-2!**
+
+
+## Evaluation script
+⚠️ **Coming soon updated evaluation scripts for Boltz-2!**
+
+# Evaluation
+
+To encourage reproducibility and facilitate comparison with other models, we provide the evaluation scripts and predictions for Boltz-1, Chai-1, and AlphaFold3 on our test benchmark dataset as well as CASP15. These datasets are created to contain biomolecules different from the training data and to benchmark the performance of these models we run them with the same input MSAs and the same number of recycling and diffusion steps.
+
+![Test set evaluations](../docs/plot_test.png)
+![CASP15 set evaluations](../docs/plot_casp.png)
+
+
+## (Old) Boltz-1 Evaluation files
+
+You can download all the MSAs, input files, output files and evaluation outputs for Boltz-1, Boltz-1x, Chai-1, and AlphaFold3 from this [Google Drive folder](https://drive.google.com/file/d/1JvHlYUMINOaqPTunI9wBYrfYniKgVmxf/view?usp=sharing). 
+
+The files are organized as follows:
+
+```
+boltz_results_final/
+├── inputs/                 # Input files for every model
+    ├── casp15/
+        ├── af3
+        ├── boltz
+        ├── boltzx
+        ├── chai
+        └── msa
+    └── test/
+├── targets/                # Target files from PDB
+    ├── casp15
+    └── test
+├── outputs/                # Output files for every model
+    ├── casp15
+    └── test
+├── evals/                  # Output of evaluation script for every
+    ├── casp15
+    └── test
+├── results_casp.csv        # Summary of evaluation results for CASP15
+└── results_test.csv        # Summary of evaluation results for test set
+```
+
+## (Old) Boltz-1 Evaluation setup
+
+We evaluate the model on two datasets:
+ - PDB test set: 541 targets after our validation cut-off date and at most 40% sequence similarity for proteins, 80% Tanimoto for ligands.
+ - CASP15: 66 difficult targets from the CASP 2022 competition. 
+
+We benchmark Boltz-1 against Chai-1 and AF3, other state-of-the-art structure prediction models, but much more closed source in terms of model code, training and data pipeline. Note that we remove overlap with our validation set, but we cannot ensure that there is no overlap with AF3 or Chai-1 validation set as those were not published. 
+
+For fair comparison we compare the models with the following setup:
+ - Same MSA’s.
+ - Same parameters: 10 recycling steps, 200 sampling steps, 5 samples.
+ - We compare our oracle and top-1 numbers among the 5 samples.
+
+
+## (Old) Boltz-1 Evaluation script
+
+We also provide the scripts we used to evaluate the models and aggregate results. The evaluations were run through [OpenStructure](https://openstructure.org/docs/2.9.0/) version 2.8.0 (it is important to use the specific version for reproducing the results). You can find these scripts at `scripts/eval/run_evals.py` and `scripts/eval/aggregate_evals.py`.
diff --git a/forks/boltz/docs/pearson_plot.png b/forks/boltz/docs/pearson_plot.png
new file mode 100644
index 00000000..7c8e8ba2
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diff --git a/forks/boltz/docs/plot_test_boltz2.png b/forks/boltz/docs/plot_test_boltz2.png
new file mode 100644
index 00000000..9fd3e70b
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diff --git a/forks/boltz/docs/prediction.md b/forks/boltz/docs/prediction.md
new file mode 100644
index 00000000..f6186f97
--- /dev/null
+++ b/forks/boltz/docs/prediction.md
@@ -0,0 +1,311 @@
+# Prediction
+
+Once you have installed `boltz`, you can start making predictions by simply running:
+
+`boltz predict <INPUT_PATH> --use_msa_server`
+
+where `<INPUT_PATH>` is a path to the input file or a directory. The input file can either be in fasta (enough for most use cases) or YAML  format (for more complex inputs). If you specify a directory, `boltz` will run predictions on each `.yaml` or `.fasta` file in the directory. Passing the `--use_msa_server` flag will auto-generate the MSA using the mmseqs2 server, otherwise you can provide a precomputed MSA. 
+
+The Boltz model includes an option to use inference time potentials that significantly improve the physical quality of the poses. If you find any physical issues with the model predictions, please let us know by opening an issue and including the YAML/FASTA file to replicate, the structure output and a description of the problem. If you want to run the Boltz model with the potentials you can do so with the `--use_potentials` flag. 
+
+Before diving into more details about the input formats, here are the key differences in what they each support:
+
+| Feature  | Fasta              | YAML    |
+| -------- |--------------------| ------- |
+| Polymers | :white_check_mark: | :white_check_mark:   |
+| Smiles   | :white_check_mark: | :white_check_mark:   |
+| CCD code | :white_check_mark: | :white_check_mark:   |
+| Custom MSA | :white_check_mark: | :white_check_mark:   |
+| Modified Residues | :x:                |  :white_check_mark: |
+| Covalent bonds | :x:                | :white_check_mark:   |
+| Pocket conditioning | :x:                | :white_check_mark:   |
+| Affinity | :x:                | :white_check_mark:   |
+
+
+## YAML format
+
+The YAML format is more flexible and allows for more complex inputs, particularly around covalent bonds. The schema of the YAML is the following:
+
+```yaml
+sequences:
+    - ENTITY_TYPE:
+        id: CHAIN_ID 
+        sequence: SEQUENCE    # only for protein, dna, rna
+        smiles: 'SMILES'        # only for ligand, exclusive with ccd
+        ccd: CCD              # only for ligand, exclusive with smiles
+        msa: MSA_PATH         # only for protein
+        modifications:
+          - position: RES_IDX   # index of residue, starting from 1
+            ccd: CCD            # CCD code of the modified residue
+        cyclic: false
+    - ENTITY_TYPE:
+        id: [CHAIN_ID, CHAIN_ID]    # multiple ids in case of multiple identical entities
+        ...
+constraints:
+    - bond:
+        atom1: [CHAIN_ID, RES_IDX, ATOM_NAME]
+        atom2: [CHAIN_ID, RES_IDX, ATOM_NAME]
+    - pocket:
+        binder: CHAIN_ID
+        contacts: [[CHAIN_ID, RES_IDX/ATOM_NAME], [CHAIN_ID, RES_IDX/ATOM_NAME]]
+        max_distance: DIST_ANGSTROM
+        force: false # if force is set to true (default is false), a potential will be used to enforce the pocket constraint
+    - contact:
+        token1: [CHAIN_ID, RES_IDX/ATOM_NAME]
+        token2: [CHAIN_ID, RES_IDX/ATOM_NAME]
+        max_distance: DIST_ANGSTROM
+        force: false # if force is set to true (default is false), a potential will be used to enforce the contact constraint
+
+templates:
+    - cif: CIF_PATH  # if only a path is provided, Boltz will find the best matchings
+    - cif: CIF_PATH
+      force: true # optional, if force is set to true (default is false), a potential will be used to enforce the template
+      threshold: DISTANCE_THRESHOLD # optional, controls the distance (in Angstroms) that the prediction can deviate from the template
+    - cif: CIF_PATH
+      chain_id: CHAIN_ID   # optional, specify which chain to find a template for
+    - cif: CIF_PATH
+      chain_id: [CHAIN_ID, CHAIN_ID]  # can be more than one
+      template_id: [TEMPLATE_CHAIN_ID, TEMPLATE_CHAIN_ID]
+properties:
+    - affinity:
+        binder: CHAIN_ID
+
+```
+
+`sequences` has one entry for every unique chain/molecule in the input. Each polymer entity as a `ENTITY_TYPE`  either `protein`, `dna` or `rna` and have a `sequence` attribute. Non-polymer entities are indicated by `ENTITY_TYPE` equal to `ligand` and have a `smiles` or `ccd` attribute. `CHAIN_ID` is the unique identifier for each chain/molecule, and it should be set as a list in case of multiple identical entities in the structure. For proteins, the `msa` key is required by default but can be omitted by passing the `--use_msa_server` flag which will auto-generate the MSA using the mmseqs2 server. If you wish to use a precomputed MSA, use the `msa` attribute with `MSA_PATH` indicating the path to the `.a3m` file containing the MSA for that protein. If you wish to explicitly run single sequence mode (which is generally advised against as it will hurt model performance), you may do so by using the special keyword `empty` for that protein (ex: `msa: empty`). For custom MSA, you may wish to indicate pairing keys to the model. You can do so by using a CSV format instead of a3m with two columns: `sequence` with the protein sequences and `key` which is a unique identifier indicating matching rows across CSV files of each protein chain.
+
+The `modifications` field is an optional field that allows you to specify modified residues in the polymer (`protein`, `dna` or`rna`). The `position` field specifies the index (starting from 1) of the residue, and `ccd` is the CCD code of the modified residue. This field is currently only supported for CCD ligands. The `cyclic` flag should be used to specify polymer chains (not ligands) that are cyclic. 
+
+`constraints` is an optional field that allows you to specify additional information about the input structure. 
+
+
+* The `bond` constraint specifies covalent bonds between two atoms (`atom1` and `atom2`). It is currently only supported for CCD ligands and canonical residues, `CHAIN_ID` refers to the id of the residue set above, `RES_IDX` is the index (starting from 1) of the residue (1 for ligands), and `ATOM_NAME` is the standardized atom name (can be verified in CIF file of that component on the RCSB website).
+
+* The `pocket` constraint specifies the residues associated with a ligand, where `binder` refers to the chain binding to the pocket (which can be a molecule, protein, DNA or RNA) and `contacts` is the list of chain and residue indices (starting from 1) associated with the pocket. The model currently only supports the specification of a single `binder` chain (and any number of `contacts` residues in other chains).
+
+`templates` is an optional field that allows you to specify structural templates for your prediction. At minimum, you must provide the path to the structural template, which must provided as a CIF file. If you wish to explicitly define which of the chains in your YAML should be templated using this CIF file, you can use the `chain_id` entry to specify them. Whether a set of ids is provided or not, Boltz will find the best matching chains from the provided template. If you wish to explicitly define the mapping yourself, you may provide the corresponding template_id. Note that only protein chains can be templated.
+
+`properties` is an optional field that allows you to specify whether you want to compute the affinity. If enabled, you must also provide the chain_id corresponding to the small molecule against which the affinity will be computed. Only one single molecule can be specified for affinity computation, and it must be a ligand chain (not a protein, DNA or RNA).
+
+As an example:
+
+```yaml
+version: 1
+sequences:
+  - protein:
+      id: [A, B]
+      sequence: MVTPEGNVSLVDESLLVGVTDEDRAVRSAHQFYERLIGLWAPAVMEAAHELGVFAALAEAPADSGELARRLDCDARAMRVLLDALYAYDVIDRIHDTNGFRYLLSAEARECLLPGTLFSLVGKFMHDINVAWPAWRNLAEVVRHGARDTSGAESPNGIAQEDYESLVGGINFWAPPIVTTLSRKLRASGRSGDATASVLDVGCGTGLYSQLLLREFPRWTATGLDVERIATLANAQALRLGVEERFATRAGDFWRGGWGTGYDLVLFANIFHLQTPASAVRLMRHAAACLAPDGLVAVVDQIVDADREPKTPQDRFALLFAASMTNTGGGDAYTFQEYEEWFTAAGLQRIETLDTPMHRILLARRATEPSAVPEGQASENLYFQ
+      msa: ./examples/msa/seq1.a3m
+  - ligand:
+      id: [C, D]
+      ccd: SAH
+  - ligand:
+      id: [E, F]
+      smiles: 'N[C@@H](Cc1ccc(O)cc1)C(=O)O'
+```
+
+
+## Fasta format
+
+The fasta format is a little simpler, and should contain entries as follows:
+
+```
+>CHAIN_ID|ENTITY_TYPE|MSA_PATH
+SEQUENCE
+```
+
+The `CHAIN_ID` is a unique identifier for each input chain. The `ENTITY_TYPE` can be one of `protein`, `dna`, `rna`, `smiles`, `ccd` (note that we support both smiles and CCD code for ligands). The `MSA_PATH` is only applicable to proteins. By default, MSA's are required, but they can be omited by passing the `--use_msa_server` flag which will auto-generate the MSA using the mmseqs2 server. If you wish to use a custom MSA, use it to set the path to the `.a3m` file containing a pre-computed MSA for this protein. If you wish to explicitly run single sequence mode (which is generally advised against as it will hurt model performance), you may do so by using the special keyword `empty` for that protein (ex: `>A|protein|empty`). For custom MSA, you may wish to indicate pairing keys to the model. You can do so by using a CSV format instead of a3m with two columns: `sequence` with the protein sequences and `key` which is a unique identifier indicating matching rows across CSV files of each protein chain.
+
+For each of these cases, the corresponding `SEQUENCE` will contain an amino acid sequence (e.g. `EFKEAFSLF`), a sequence of nucleotide bases (e.g. `ATCG`), a smiles string (e.g. `CC1=CC=CC=C1`), or a CCD code (e.g. `ATP`), depending on the entity.
+
+As an example:
+
+```yaml
+>A|protein|./examples/msa/seq1.a3m
+MVTPEGNVSLVDESLLVGVTDEDRAVRSAHQFYERLIGLWAPAVMEAAHELGVFAALAEAPADSGELARRLDCDARAMRVLLDALYAYDVIDRIHDTNGFRYLLSAEARECLLPGTLFSLVGKFMHDINVAWPAWRNLAEVVRHGARDTSGAESPNGIAQEDYESLVGGINFWAPPIVTTLSRKLRASGRSGDATASVLDVGCGTGLYSQLLLREFPRWTATGLDVERIATLANAQALRLGVEERFATRAGDFWRGGWGTGYDLVLFANIFHLQTPASAVRLMRHAAACLAPDGLVAVVDQIVDADREPKTPQDRFALLFAASMTNTGGGDAYTFQEYEEWFTAAGLQRIETLDTPMHRILLARRATEPSAVPEGQASENLYFQ
+>B|protein|./examples/msa/seq1.a3m
+MVTPEGNVSLVDESLLVGVTDEDRAVRSAHQFYERLIGLWAPAVMEAAHELGVFAALAEAPADSGELARRLDCDARAMRVLLDALYAYDVIDRIHDTNGFRYLLSAEARECLLPGTLFSLVGKFMHDINVAWPAWRNLAEVVRHGARDTSGAESPNGIAQEDYESLVGGINFWAPPIVTTLSRKLRASGRSGDATASVLDVGCGTGLYSQLLLREFPRWTATGLDVERIATLANAQALRLGVEERFATRAGDFWRGGWGTGYDLVLFANIFHLQTPASAVRLMRHAAACLAPDGLVAVVDQIVDADREPKTPQDRFALLFAASMTNTGGGDAYTFQEYEEWFTAAGLQRIETLDTPMHRILLARRATEPSAVPEGQASENLYFQ
+>C|ccd
+SAH
+>D|ccd
+SAH
+>E|smiles
+N[C@@H](Cc1ccc(O)cc1)C(=O)O
+>F|smiles
+N[C@@H](Cc1ccc(O)cc1)C(=O)O
+```
+
+
+## Options
+
+The following options are available for the `predict` command:
+
+    boltz predict input_path [OPTIONS]
+
+As an example, to predict a structure using 10 recycling steps and 25 samples (the default parameters for AlphaFold3) use:
+
+    boltz predict input_path --recycling_steps 10 --diffusion_samples 25
+
+(note however that the prediction will take significantly longer)
+
+
+| **Option**               | **Type**        | **Default**                 | **Description**                                                                                                                                                                     |
+|--------------------------|-----------------|-----------------------------|-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------|
+| `--out_dir`              | `PATH`          | `./`                        | The path where to save the predictions.                                                                                                                                             |
+| `--cache`                | `PATH`          | `~/.boltz`                  | The directory where to download the data and model. Will use environment variable `BOLTZ_CACHE` as an absolute path if set                                                          |
+| `--checkpoint`           | `PATH`          | None                        | An optional checkpoint. Uses the provided Boltz-2 model by default.                                                                                                                 |
+| `--devices`              | `INTEGER`       | `1`                         | The number of devices to use for prediction.                                                                                                                                        |
+| `--accelerator`          | `[gpu,cpu,tpu]` | `gpu`                       | The accelerator to use for prediction.                                                                                                                                              |
+| `--recycling_steps`      | `INTEGER`       | `3`                         | The number of recycling steps to use for prediction.                                                                                                                                |
+| `--sampling_steps`       | `INTEGER`       | `200`                       | The number of sampling steps to use for prediction.                                                                                                                                 |
+| `--diffusion_samples`    | `INTEGER`       | `1`                         | The number of diffusion samples to use for prediction.                                                                                                                              |
+| `--max_parallel_samples` | `INTEGER` | `5`                       | maximum number of samples to predict in parallel. |
+| `--step_scale`           | `FLOAT`         | `1.638`                     | The step size is related to the temperature at which the diffusion process samples the distribution. The lower the higher the diversity among samples (recommended between 1 and 2). |
+| `--output_format`        | `[pdb,mmcif]`   | `mmcif`                     | The output format to use for the predictions.                                                                                                                                       |
+| `--num_workers`          | `INTEGER`       | `2`                         | The number of dataloader workers to use for prediction.                                                                                                                             |
+| `--method`          | str       | None                         | The method to use for prediction.                                                                                                                             |
+| `--preprocessing-threads`          | `INTEGER`       | `multiprocessing.cpu_count()` | The number of threads to use for preprocessing.                                                                                                                             |
+| `--affinity_mw_correction`          | `FLAG`       | `False` | Whether to add the Molecular Weight correction to the affinity value head.                                                                                                                             |
+| `--sampling_steps_affinity`          | `INTEGER`       | `200` | The number of sampling steps to use for affinity prediction.                                                                                                                             |
+| `--diffusion_samples_affinity`          | `INTEGER`       | `5` | The number of diffusion samples to use for affinity prediction.                                                                                                                             |
+| `--affinity_checkpoint`          | `PATH`          | None | An optional checkpoint for affinity. Uses the provided Boltz-2 model by default.                                                                                                                             |
+| `--max_msa_seqs`          | `INTEGER`       | `8192` |The maximum number of MSA sequences to use for prediction.                                                                                                                             |
+| `--subsample_msa`          | `FLAG`       | `False` | Whether to subsample the MSA.                                                                                                                             |
+| `--num_subsampled_msa`          | `INTEGER`       | `1024` | The number of MSA sequences to subsample.                                                                                                                             |
+| `--no_kernels`          | `FLAG`       | `False` | Whether to not use trifast kernels for triangular updates..                                                                                                                             |
+| `--override`             | `FLAG`          | `False`                     | Whether to override existing predictions if found.                                                                                                                                  |
+| `--use_msa_server`       | `FLAG`          | `False`                     | Whether to use the msa server to generate msa's.                                                                                                                                    |
+| `--msa_server_url`       | str             | `https://api.colabfold.com` | MSA server url. Used only if --use_msa_server is set.                                                                                                                               |
+| `--msa_pairing_strategy` | str             | `greedy`                    | Pairing strategy to use. Used only if --use_msa_server is set. Options are 'greedy' and 'complete'                                                                                  |
+| `--use_potentials`        | `FLAG`          | `False`                     | Whether to run the original Boltz-2 model using inference time potentials.                                                                                                        |
+| `--write_full_pae`       | `FLAG`          | `False`                     | Whether to save the full PAE matrix as a file.                                                                                                                                      |
+| `--write_full_pde`       | `FLAG`          | `False`                     | Whether to save the full PDE matrix as a file.                                                                                                                                      |
+
+## Output
+
+After running the model, the generated outputs are organized into the output directory following the structure below:
+```
+out_dir/
+├── lightning_logs/                                            # Logs generated during training or evaluation
+├── predictions/                                               # Contains the model's predictions
+    ├── [input_file1]/
+        ├── [input_file1]_model_0.cif                          # The predicted structure in CIF format, with the inclusion of per token pLDDT scores
+        ├── confidence_[input_file1]_model_0.json              # The confidence scores (confidence_score, ptm, iptm, ligand_iptm, protein_iptm, complex_plddt, complex_iplddt, chains_ptm, pair_chains_iptm)
+        ├── affinity_[input_file1].json                        # The affinity scores (affinity_pred_value, affinity_probability_binary, affinity_pred_value1, affinity_probability_binary1, affinity_pred_value2, affinity_probability_binary2)
+
+        ├── pae_[input_file1]_model_0.npz                      # The predicted PAE score for every pair of tokens
+        ├── pde_[input_file1]_model_0.npz                      # The predicted PDE score for every pair of tokens
+        ├── plddt_[input_file1]_model_0.npz                    # The predicted pLDDT score for every token
+        ...
+        └── [input_file1]_model_[diffusion_samples-1].cif      # The predicted structure in CIF format
+        ...
+    └── [input_file2]/
+        ...
+└── processed/                                                 # Processed data used during execution 
+```
+The `predictions` folder contains a unique folder for each input file. The input folders contain `diffusion_samples` predictions saved in the output_format ordered by confidence score as well as additional files containing the predictions of the confidence model and affinity model. The `processed` folder contains the processed input files that are used by the model during inference.
+
+The output confidence `.json` file contains various aggregated confidence scores for specific sample. The structure of the file is as follows:
+```yaml
+{
+    "confidence_score": 0.8367,       # Aggregated score used to sort the predictions, corresponds to 0.8 * complex_plddt + 0.2 * iptm (ptm for single chains)
+    "ptm": 0.8425,                    # Predicted TM score for the complex
+    "iptm": 0.8225,                   # Predicted TM score when aggregating at the interfaces
+    "ligand_iptm": 0.0,               # ipTM but only aggregating at protein-ligand interfaces
+    "protein_iptm": 0.8225,           # ipTM but only aggregating at protein-protein interfaces
+    "complex_plddt": 0.8402,          # Average pLDDT score for the complex
+    "complex_iplddt": 0.8241,         # Average pLDDT score when upweighting interface tokens
+    "complex_pde": 0.8912,            # Average PDE score for the complex
+    "complex_ipde": 5.1650,           # Average PDE score when aggregating at interfaces  
+    "chains_ptm": {                   # Predicted TM score within each chain
+        "0": 0.8533,
+        "1": 0.8330
+    },
+    "pair_chains_iptm": {             # Predicted (interface) TM score between each pair of chains
+        "0": {
+            "0": 0.8533,
+            "1": 0.8090
+        },
+        "1": {
+            "0": 0.8225,
+            "1": 0.8330
+        }
+    }
+}
+```
+`confidence_score`, `ptm` and `plddt` scores (and their interface and individual chain analogues) have a range of [0, 1], where higher values indicate higher confidence. `pde` scores have a unit of angstroms, where lower values indicate higher confidence.
+
+The output affinity `.json` file is organized as follows:
+```yaml
+{
+    "affinity_pred_value": 0.8367,             # Predicted binding affinity from the ensemble model
+    "affinity_probability_binary": 0.8425,     # Predicted binding likelihood from the ensemble model
+    "affinity_pred_value1": 0.8225,            # Predicted binding affinity from the first model of the ensemble
+    "affinity_probability_binary1": 0.0,       # Predicted binding likelihood from the first model in the ensemble
+    "affinity_pred_value2": 0.8225,            # Predicted binding affinity from the second model of the ensemble
+    "affinity_probability_binary2": 0.8402,    # Predicted binding likelihood from the second model in the ensemble
+}
+```
+
+There are two main predictions in the affinity output: `affinity_pred_value` and `affinity_probability_binary`. They are trained on largely different datasets, with different supervisions, and should be used in different contexts. 
+
+The `affinity_probability_binary` field should be used to detect binders from decoys, for example in a hit-discovery stage. It's value ranges from 0 to 1 and represents the predicted probability that the ligand is a binder.
+
+The `affinity_pred_value` aims to measure the specific affinity of different binders and how this changes with small modifications of the molecule. This should be used in ligand optimization stages such as hit-to-lead and lead-optimization. It reports a binding affinity value as `log(IC50)`, derived from an `IC50` measured in `μM`. Lower values indicate stronger predicted binding, for instance:
+- IC50 of $10^{-9}$ M $\longrightarrow$ our model outputs $-3$ (strong binder)
+- IC50 of $10^{-6}$ M $\longrightarrow$ our model outputs $0$ (moderate binder)
+- IC50 of $10^{-4}$ M $\longrightarrow$ our model outputs $2$ (weak binder / decoy)
+
+You can convert the model's output to pIC50 in `kcal/mol` by using `y --> (6 - y) * 1.364` where `y` is the model's prediction.
+
+
+## Authentication to MSA Server
+
+When using the `--use_msa_server` option with a server that requires authentication, you can provide credentials in one of two ways:
+
+### 1. Basic Authentication
+
+- Use the CLI options `--msa_server_username` and `--msa_server_password`.
+- Or, set the environment variables:
+  - `BOLTZ_MSA_USERNAME` (for the username)
+  - `BOLTZ_MSA_PASSWORD` (for the password, recommended for security)
+
+**Example:**
+```bash
+export BOLTZ_MSA_USERNAME=myuser
+export BOLTZ_MSA_PASSWORD=mypassword
+boltz predict ... --use_msa_server
+```
+Or:
+```bash
+boltz predict ... --use_msa_server --msa_server_username myuser --msa_server_password mypassword
+```
+
+### 2. API Key Authentication
+
+- Use the CLI options `--api_key_header` (default: `X-API-Key`) and `--api_key_value` to specify the header and value for API key authentication.
+- Or, set the API key value via the environment variable `MSA_API_KEY_VALUE` (recommended for security).
+
+**Example using CLI:**
+```bash
+boltz predict ... --use_msa_server --api_key_header X-API-Key --api_key_value <your-api-key>
+```
+
+**Example using environment variable:**
+```bash
+export MSA_API_KEY_VALUE=<your-api-key>
+boltz predict ... --use_msa_server --api_key_header X-API-Key
+```
+If both the CLI option and environment variable are set, the CLI option takes precedence.
+
+> If your server expects a different header, set `--api_key_header` accordingly (e.g., `--api_key_header X-Gravitee-Api-Key`).
+
+---
+
+**Note:**  
+Only one authentication method (basic or API key) can be used at a time. If both are provided, the program will raise an error.
+
+
+## Troubleshooting
+
+ - When running on old NVIDIA GPUs, you may encounter an error related to the `cuequivariance` library. In this case, you should run the model with the `--no_kernels` flag, which will disable the use of the `cuequivariance` library and allow the model to run without it. This may result in slightly lower performance, but it will allow you to run the model on older hardware.
diff --git a/forks/boltz/docs/training.md b/forks/boltz/docs/training.md
new file mode 100644
index 00000000..2f586c28
--- /dev/null
+++ b/forks/boltz/docs/training.md
@@ -0,0 +1,263 @@
+# Training
+
+⚠️ **Coming soon updated training information for Boltz-2!**
+
+## Download the pre-processed data
+
+To run training, you will need to download a few pre-processed datasets. Note that you will need ~250G of storage for all the data. If instead you want to re-run the preprocessing pipeline or processed your own raw data for training, please see the [instructions](#processing-raw-data) at the bottom of this page.
+
+- The pre-processed RCSB (i.e PDB) structures:
+```bash
+wget https://boltz1.s3.us-east-2.amazonaws.com/rcsb_processed_targets.tar
+tar -xf rcsb_processed_targets.tar
+rm rcsb_processed_targets.tar
+```
+
+- The pre-processed RCSB (i.e PDB) MSA's:
+```bash
+wget https://boltz1.s3.us-east-2.amazonaws.com/rcsb_processed_msa.tar
+tar -xf rcsb_processed_msa.tar
+rm rcsb_processed_msa.tar
+```
+
+- The pre-processed OpenFold structures:
+```bash
+wget https://boltz1.s3.us-east-2.amazonaws.com/openfold_processed_targets.tar
+tar -xf openfold_processed_targets.tar
+rm openfold_processed_targets.tar
+```
+
+- The pre-processed OpenFold MSA's:
+```bash
+wget https://boltz1.s3.us-east-2.amazonaws.com/openfold_processed_msa.tar
+tar -xf openfold_processed_msa.tar
+rm openfold_processed_msa.tar
+```
+
+- The pre-computed symmetry files for ligands:
+```bash
+wget https://boltz1.s3.us-east-2.amazonaws.com/symmetry.pkl
+```
+
+## Modify the configuration file
+
+The training script requires a configuration file to run. This file specifies the paths to the data, the output directory, and other parameters of the data, model and training process. 
+
+We provide under `scripts/train/configs` a template configuration file analogous to the one we used for training the structure model (`structure.yaml`) and the confidence model (`confidence.yaml`).
+
+The following are the main parameters that you should modify in the configuration file to get the structure model to train:
+
+```yaml
+trainer:
+  devices: 1
+
+output: SET_PATH_HERE                 # Path to the output directory  
+resume: PATH_TO_CHECKPOINT_FILE       # Path to a checkpoint file to resume training from if any null otherwise
+
+data:
+  datasets:
+    - _target_: boltz.data.module.training.DatasetConfig
+      target_dir: PATH_TO_TARGETS_DIR       # Path to the directory containing the processed structure files
+      msa_dir: PATH_TO_MSA_DIR              # Path to the directory containing the processed MSA files
+
+  symmetries: PATH_TO_SYMMETRY_FILE      # Path to the file containing molecule the symmetry information
+  max_tokens: 512                        # Maximum number of tokens in the input sequence
+  max_atoms: 4608                        # Maximum number of atoms in the input structure
+```
+
+`max_tokens` and `max_atoms` are the maximum number of tokens and atoms in the crop. Depending on the size of the GPUs you are using (as well as the training speed desired), you may want to adjust these values. Other recommended values are 256 and 2304, or 384 and 3456 respectively.
+
+Here is an example of how to set multiple dataset sources like the PDB and OpenFold distillation dataset that we used to train the structure model:
+
+
+```yaml
+  datasets:
+    - _target_: boltz.data.module.training.DatasetConfig
+      target_dir: PATH_TO_PDB_TARGETS_DIR
+      msa_dir: PATH_TO_PDB_MSA_DIR
+      prob: 0.5
+      sampler:
+        _target_: boltz.data.sample.cluster.ClusterSampler
+      cropper:
+        _target_: boltz.data.crop.boltz.BoltzCropper
+        min_neighborhood: 0
+        max_neighborhood: 40
+      split: ./scripts/train/assets/validation_ids.txt
+    - _target_: boltz.data.module.training.DatasetConfig
+      target_dir: PATH_TO_DISTILLATION_TARGETS_DIR
+      msa_dir: PATH_TO_DISTILLATION_MSA_DIR
+      prob: 0.5
+      sampler:
+        _target_: boltz.data.sample.cluster.ClusterSampler
+      cropper:
+        _target_: boltz.data.crop.boltz.BoltzCropper
+        min_neighborhood: 0
+        max_neighborhood: 40
+```
+
+## Run the training script
+
+Before running the full training, we recommend using the debug flag. This turns off DDP (sets single device) and sets `num_workers` to 0 so everything is in a single process, as well as disabling wandb:
+
+    python scripts/train/train.py scripts/train/configs/structure.yaml debug=1
+
+Once that seems to run okay, you can kill it and launch the training run:
+
+    python scripts/train/train.py scripts/train/configs/structure.yaml
+
+We also provide a different configuration file to train the confidence model:
+
+    python scripts/train/train.py scripts/train/configs/confidence.yaml
+
+
+## Processing raw data
+
+We have already pre-processed the training data for the PDB and the OpenFold self-distillation set. However, if you'd like to replicate the processing pipeline or processed your own data for training, you can follow the instructions below.
+
+
+#### Step 1: Go to the processing folder
+
+```bash
+cd scripts/process
+```
+
+#### Step 2: Install requirements
+
+Install the few extra requirements required for processing:
+
+```bash
+pip install -r requirements.txt
+```
+
+You must also install two external libraries: `mmseqs` and `redis`. Instructions for installation are below:
+
+- `mmseqs`: https://github.com/soedinglab/mmseqs2?tab=readme-ov-file#installation
+- `redis`: https://redis.io/docs/latest/operate/oss_and_stack/install/install-redis/
+
+#### Step 3: Preprocess the CCD dictionary
+
+
+We have already done this for you, the relevant file is here:
+```bash
+wget https://boltz1.s3.us-east-2.amazonaws.com/ccd.pkl
+```
+
+Unless you wish to do it again yourself, you can skip to the next step! If you do want to recreate the file, you can do so with the following commands:
+
+```bash
+wget https://files.wwpdb.org/pub/pdb/data/monomers/components.cif
+python ccd.py --components components.cif --outdir ./ccd
+```
+
+> Note: runs in parallel by default with as many threads as cpu cores on your machine, can be changed with `--num_processes`
+
+#### Step 4: Create sequence clusters
+
+First, you must create a fasta file containing all the polymer sequences present in your data. You can use any header format you want for the sequences, it will not be used.
+
+For the PDB, this can already be downloaded here:
+```bash
+wget https://files.rcsb.org/pub/pdb/derived_data/pdb_seqres.txt.gz
+gunzip -d pdb_seqres.txt.gz
+```
+
+> Note: for the OpenFold data, since the sequences were chosen for diversity, we do not apply any clustering.
+
+When this is done, you can run the clustering script, which assigns proteins to 40% similarity clusters and rna/dna to a cluster for each unique sequence. For ligands, each CCD code is also assigned to its own cluster.
+
+```bash
+python cluster.py --ccd ccd.pkl --sequences pdb_seqres.txt --mmseqs PATH_TO_MMSEQS_EXECUTABLE --outdir ./clustering
+```
+
+> Note: you must install mmseqs (see: https://github.com/soedinglab/mmseqs2?tab=readme-ov-file#installation)
+
+#### Step 5: Create MSA's
+
+We have already computed MSA's for all sequences in the PDB at the time of training using the ColabFold `colab_search` tool. You can setup your own local colabfold using instructions provided here: https://github.com/YoshitakaMo/localcolabfold
+
+The raw MSA's for the PDB can be found here:
+```
+wget https://boltz1.s3.us-east-2.amazonaws.com/rcsb_raw_msa.tar
+tar -xf rcsb_raw_msa.tar
+rm rcsb_raw_msa.tar
+```
+> Note: this file is 130G large, and will take another 130G to extract before you can delete the original tar archive, we make sure you have enough storage on your machine.
+
+You can also download the raw OpenFold MSA's here:
+```
+wget https://boltz1.s3.us-east-2.amazonaws.com/openfold_raw_msa.tar
+tar -xf openfold_raw_msa.tar
+rm openfold_raw_msa.tar
+```
+
+> Note: this file is 88G large, and will take another 88G to extract before you can delete the original tar archive, we make sure you have enough storage on your machine.
+
+If you wish to use your own MSA's, just ensure that their file name is the hash of the query sequence, according to the following function:
+```python
+import hashlib
+
+def hash_sequence(seq: str) -> str:
+    """Hash a sequence."""
+    return hashlib.sha256(seq.encode()).hexdigest()
+```
+
+#### Step 6: Process MSA's
+
+During MSA processing, among other things, we annotate sequences using their taxonomy ID, which is important for MSA pairing during training. This happens only on MSA sequences with headers that start with the following:
+
+```
+>UniRef100_UNIREFID
+...
+```
+
+This format is the way that MSA's are provided by colabfold. If you use a different MSA pipeline, make sure your Uniref MSA's follow the above format.
+
+Next you should download our provided taxonomy database and place it in the current folder:
+
+```bash
+wget https://boltz1.s3.us-east-2.amazonaws.com/taxonomy.rdb
+```
+
+You can now process the raw MSAs. First launch a redis server. We use redis to share the large taxonomy dictionary across workers, so MSA processing can happen in parallel without blowing up the RAM usage.
+
+```bash
+redis-server --dbfilename taxonomy.rdb --port 7777
+```
+
+Please wait a few minutes for the DB to initialize. It will print `Ready to accept connections` when ready.
+
+> Note: You must have redis installed (see: https://redis.io/docs/latest/operate/oss_and_stack/install/install-redis/)
+
+In a separate shell, run the MSA processing script:
+```bash
+python msa.py --msadir YOUR_MSA_DIR --outdir YOUR_OUTPUT_DIR --redis-port 7777
+```
+
+> Important: the script looks for `.a3m` or `.a3m.gz` files in the directory, make sure to match this extension and file format.
+
+#### Step 7: Process structures
+
+Finally, we're ready to process structural data. Here we provide two different scripts for the PDB and for the OpenFold data. In general, we recommend using the `rcsb.py` script for your own data, which is expected in `mmcif` format.
+
+You can download the full RCSB using the instructions here:
+https://www.rcsb.org/docs/programmatic-access/file-download-services
+
+
+```bash
+wget https://boltz1.s3.us-east-2.amazonaws.com/ccd.rdb
+redis-server --dbfilename ccd.rdb --port 7777
+```
+> Note: You must have redis installed (see: https://redis.io/docs/latest/operate/oss_and_stack/install/install-redis/)
+
+In a separate shell, run the processing script, make sure to use the `clustering/clustering.json` file you previously created.
+```bash
+python rcsb.py --datadir PATH_TO_MMCIF_DIR --cluster clustering/clustering.json --outdir YOUR_OUTPUT_DIR --use-assembly --max-file-size 7000000 --redis-port 7777
+```
+
+> Important: the script looks for `.cif` or `cif.gz` files in the directory, make sure to match this extension and file format.
+
+> We skip a few of the very large files, you can modify this using the `--max-file-size` flag, or by removing it.
+
+#### Step 8: Ready!
+
+You're ready to start training the model on your data, make sure to modify the config to assign the paths you created in the previous two steps. If you have any questions, don't hesitate to open an issue or reach out on our community slack channel.
diff --git a/forks/boltz/examples/affinity.yaml b/forks/boltz/examples/affinity.yaml
new file mode 100644
index 00000000..abe04d32
--- /dev/null
+++ b/forks/boltz/examples/affinity.yaml
@@ -0,0 +1,11 @@
+version: 1  # Optional, defaults to 1
+sequences:
+  - protein:
+      id: A
+      sequence: MVTPEGNVSLVDESLLVGVTDEDRAVRSAHQFYERLIGLWAPAVMEAAHELGVFAALAEAPADSGELARRLDCDARAMRVLLDALYAYDVIDRIHDTNGFRYLLSAEARECLLPGTLFSLVGKFMHDINVAWPAWRNLAEVVRHGARDTSGAESPNGIAQEDYESLVGGINFWAPPIVTTLSRKLRASGRSGDATASVLDVGCGTGLYSQLLLREFPRWTATGLDVERIATLANAQALRLGVEERFATRAGDFWRGGWGTGYDLVLFANIFHLQTPASAVRLMRHAAACLAPDGLVAVVDQIVDADREPKTPQDRFALLFAASMTNTGGGDAYTFQEYEEWFTAAGLQRIETLDTPMHRILLARRATEPSAVPEGQASENLYFQ
+  - ligand:
+      id: B
+      smiles: 'N[C@@H](Cc1ccc(O)cc1)C(=O)O'
+properties:
+  - affinity:
+      binder: B
diff --git a/forks/boltz/examples/cyclic_prot.yaml b/forks/boltz/examples/cyclic_prot.yaml
new file mode 100644
index 00000000..1a099667
--- /dev/null
+++ b/forks/boltz/examples/cyclic_prot.yaml
@@ -0,0 +1,7 @@
+version: 1  # Optional, defaults to 1
+sequences:
+  - protein:
+      id: A
+      sequence: QLEDSEVEAVAKG
+      cyclic: true
+
diff --git a/forks/boltz/examples/ligand.fasta b/forks/boltz/examples/ligand.fasta
new file mode 100644
index 00000000..ea964b7c
--- /dev/null
+++ b/forks/boltz/examples/ligand.fasta
@@ -0,0 +1,12 @@
+>A|protein|./examples/msa/seq1.a3m
+MVTPEGNVSLVDESLLVGVTDEDRAVRSAHQFYERLIGLWAPAVMEAAHELGVFAALAEAPADSGELARRLDCDARAMRVLLDALYAYDVIDRIHDTNGFRYLLSAEARECLLPGTLFSLVGKFMHDINVAWPAWRNLAEVVRHGARDTSGAESPNGIAQEDYESLVGGINFWAPPIVTTLSRKLRASGRSGDATASVLDVGCGTGLYSQLLLREFPRWTATGLDVERIATLANAQALRLGVEERFATRAGDFWRGGWGTGYDLVLFANIFHLQTPASAVRLMRHAAACLAPDGLVAVVDQIVDADREPKTPQDRFALLFAASMTNTGGGDAYTFQEYEEWFTAAGLQRIETLDTPMHRILLARRATEPSAVPEGQASENLYFQ
+>B|protein|./examples/msa/seq1.a3m
+MVTPEGNVSLVDESLLVGVTDEDRAVRSAHQFYERLIGLWAPAVMEAAHELGVFAALAEAPADSGELARRLDCDARAMRVLLDALYAYDVIDRIHDTNGFRYLLSAEARECLLPGTLFSLVGKFMHDINVAWPAWRNLAEVVRHGARDTSGAESPNGIAQEDYESLVGGINFWAPPIVTTLSRKLRASGRSGDATASVLDVGCGTGLYSQLLLREFPRWTATGLDVERIATLANAQALRLGVEERFATRAGDFWRGGWGTGYDLVLFANIFHLQTPASAVRLMRHAAACLAPDGLVAVVDQIVDADREPKTPQDRFALLFAASMTNTGGGDAYTFQEYEEWFTAAGLQRIETLDTPMHRILLARRATEPSAVPEGQASENLYFQ
+>C|ccd
+SAH
+>D|ccd
+SAH
+>E|smiles
+N[C@@H](Cc1ccc(O)cc1)C(=O)O
+>F|smiles
+N[C@@H](Cc1ccc(O)cc1)C(=O)O
\ No newline at end of file
diff --git a/forks/boltz/examples/ligand.yaml b/forks/boltz/examples/ligand.yaml
new file mode 100644
index 00000000..e41e86eb
--- /dev/null
+++ b/forks/boltz/examples/ligand.yaml
@@ -0,0 +1,12 @@
+version: 1  # Optional, defaults to 1
+sequences:
+  - protein:
+      id: [A, B]
+      sequence: MVTPEGNVSLVDESLLVGVTDEDRAVRSAHQFYERLIGLWAPAVMEAAHELGVFAALAEAPADSGELARRLDCDARAMRVLLDALYAYDVIDRIHDTNGFRYLLSAEARECLLPGTLFSLVGKFMHDINVAWPAWRNLAEVVRHGARDTSGAESPNGIAQEDYESLVGGINFWAPPIVTTLSRKLRASGRSGDATASVLDVGCGTGLYSQLLLREFPRWTATGLDVERIATLANAQALRLGVEERFATRAGDFWRGGWGTGYDLVLFANIFHLQTPASAVRLMRHAAACLAPDGLVAVVDQIVDADREPKTPQDRFALLFAASMTNTGGGDAYTFQEYEEWFTAAGLQRIETLDTPMHRILLARRATEPSAVPEGQASENLYFQ
+      msa: ./examples/msa/seq1.a3m
+  - ligand:
+      id: [C, D]
+      ccd: SAH
+  - ligand:
+      id: [E, F]
+      smiles: 'N[C@@H](Cc1ccc(O)cc1)C(=O)O'
diff --git a/forks/boltz/examples/msa/seq1.a3m b/forks/boltz/examples/msa/seq1.a3m
new file mode 100644
index 00000000..55a5dce8
--- /dev/null
+++ b/forks/boltz/examples/msa/seq1.a3m
@@ -0,0 +1,498 @@
+>101
+MVTPEGNVSLVDESLLVGVTDEDRAVRSAHQFYERLIGLWAPAVMEAAHELGVFAALAEAPADSGELARRLDCDARAMRVLLDALYAYDVIDRIHDTNGFRYLLSAEARECLLPGTLFSLVGKFMHDINVAWPAWRNLAEVVRHGARDTSGAESPNGIAQEDYESLVGGINFWAPPIVTTLSRKLRASGRSGDATASVLDVGCGTGLYSQLLLREFPRWTATGLDVERIATLANAQALRLGVEERFATRAGDFWRGGWGTGYDLVLFANIFHLQTPASAVRLMRHAAACLAPDGLVAVVDQIVDADREPKTPQDRFALLFAASMTNTGGGDAYTFQEYEEWFTAAGLQRIETLDTPMHRILLARRATEPSAVPEGQASENLYFQ
+>UniRef100_A0A0D4WTP2	338	1.00	7.965E-99	2	375	384	1	374	375
+--TPEGNVSLVDESLLVGVTDEDRAVRSAHQFYERLIGLWAPAVMEAAHELGVFAALAEAPADSGELARRLDCDARAMRVLLDALYAYDVIDRIHDTNGFRYLLSAEARECLLPGTLFSLVGKFMHDINVAWPAWRNLAEVVRHGARDTSGAESPNGIAQEDYESLVGGINFWAPPIVTTLSRKLRASGRSGDATASVLDVGCGTGLYSQLLLREFPRWTATGLDVERIATLANAQALRLGVEERFATRAGDFWRGGWGTGYDLVLFANIFHLQTPASAVRLMRHAAACLAPDGLVAVVDQIVDADREPKTPQDRFALLFAASMTNTGGGDAYTFQEYEEWFTAAGLQRIETLDTPMHRILLARRATEPSAVPEGQ--------
+>UniRef100_UPI00199CC1A7	304	0.851	3.950E-87	8	371	384	1	364	369
+--------SLVDESLLAGVTDEDRTVRSAHQFYERLIGLWAPAVMEAAHELGVFVALAEEPVGSAEMARRLDCDPRAMRVLLDALYAYDVIGRIHDTNGFRYVMSPEAQECLLPGRLFSLVGKLAHDIDVAWPAWRNLASVVRHGARDTTGTDSPNGIAEEDYESLVGGINFWAPPIVAALTRKLHALGRSGESAASILDVGCGTGLYSQLLLREFPEWTATGLDVERIAALASAQSLRLGVAERFGTGVGDFWKGDWGTGYDIVLFVNIFHLQTPASAARLMRNAAASLAPDGLVAVVDQIIDADREPKTPQDRFALLFAASMTNTGGGDTYTFQEYEEWFTAAGLQRVETLDTPMHRILLARRVTETPAA------------
+>UniRef100_UPI001674A1EF	256	0.569	1.909E-70	8	367	384	30	389	395
+--------ELVDYNYLSTTTGERKTIRAAHQLYEHLISLWAPAIIETAHDLGVFARLAKGPGTVAELATDLDTDQRATRVLLGGLVAYGVLERSDDDGESRYVLPEEFRHALLPGGTFSLVGKMAHDRHVAWAAWRNLGDAVRHGTRDRSGNDRTNQISETNYEDLTFGINFWAPPIVDVLSSFLAESGWKKDQAVSVLDVGCGTGLYSQLLLERFPSWTAEGIDAPRIIPLATRQAEKIGVGARFTGTVRDFWQHGWGEIVDLILFANIFHLQTDDSVQKLMRSAADVLAPDGLICIADQIVVDEARPTTAQDRFALLFAASMLATGGGDAYALSTYDQWLAEAGLERVAVLEAPMHRLLLVGHAGR----------------
+>UniRef100_A0A229H607	251	0.571	5.884E-69	11	369	384	1	362	363
+-----------DFNFLSATTGEQKTVRAAHQIYEHLIGLWAPAVIEAAHDLGVFSWLANRPGTVEEMSAELETDQRATRVLLGGLLAYGVIERSELDGEVRYSLPSEFRQALLPGGTFSLVGKMLHDRHVAWAGWRNLGDAVRHGTRDQSGNDRTNQISEADYEDLTSGINFWAPPIVDVLSAALAETGWKKDEAVSVLDVGCGTGLYSQLLLERFPAWKAEGIDAPRIIRLATAQAERLGVGSRFTGTVRDFWKDGWGETVDLILFANIFHLQTPDSVQKLMRSAADVLAPDGLICIADQIVVDEARPVTAQDRFAMLFAASMLATGGGDAYTLSAYDQWLAEAGLERVAVLEAPMHRLLLighAGRHPLPA--------------
+>UniRef100_A0A6I4VXR1	248	0.510	7.112E-68	19	365	384	24	367	381
+-------------------TPAARQSATAHRVYEALIAMWSTGVIEAGHDLGLFERLATGPATVPELAADLGADPRATRVLCDALVVYGVLER---GDHGRFAMPADIAACLLADGLYSLAGKIFYDRTVAWDAWRGLADAVRRGPVDAHGDDQANQISDVDYEQLTGGINFWAPPIAELLAGWLRDAGWDARPGRTVLDVGCGTGIYSHLLLQAFPGATSTGLEAARIVPIADRQAGLLGVADRFTATACDFMSDPWPSGVDLALFVNIFHLQHPAAARRLLARSAAALAPDGVLCVVDHIVDREGPLDSPQDRFALLFAASMLATGGGGAHALADYDLWLAGAGLRRVALLDAPMHRVLFAARA------------------
+>UniRef100_UPI001678806F	245	0.509	6.291E-67	8	363	384	2	358	361
+--------RLVDSTKLIGDPRDSAVVRASHRVYEHLVAMFAPGLIEAAFDLGAFVALADGPAGAAELAERLDADPLGVRVLLDGLSCYEIVYRESAPEGGhRYRLADGMAECLLPGGLYSLAGRIRYDRAIGWDAWRDLAQHVRHPARDDSGAYRANQLSAEDYESVARGINFWAPPIVEALAGLLTDTGWKEETPRSMLDVGCGTGIYSQLLLQRFKELTATGLDDPRIVPIAEEQAQRLNVGARFSPVSQDFFQQPWPGGQDLVLLVNIFHLQTADGAQELMHRARQAVREDGVVAIVDHIVDDDSEPHSPHNRFFRLFSASMLVTGGGDSFSLAEYDQWLERAGLCRTALVDTPMHRILLAR--------------------
+>UniRef100_UPI0021B13CE5	245	0.569	6.291E-67	8	367	384	30	389	395
+--------SLVDYNYLSATTGERKTIRAAHQLYEHLISLWAPAIIETAHDLGVFAWLAERSGTAEQLADGLKTDRRATRVLLDGLFAYGVLERSAAGGEVRYTLPEDFRHALLPGGTFSLVGKMAHDRHVAWAAWNNLGDAVRHGTRDQSGNDRTNQISETDYEDLTSGINFWAPPIVDVLASYLAESGWKQNETASVLDVGCGTGLYSQLLLERFPSWTAEGIDAPRIIRLADRQAERLGVADRFTGTVRDFWQHGWGEIVDLILFANIFHLQTADSVQKLMRSAADVLAADGLICIADQIVVDEAHPTTAQDRFALLFAASMLATGGGDAYALSEYDQWLAEAGLERVAVLEAPMHRLLLVGHAGR----------------
+>UniRef100_A0A640S974	244	0.654	1.173E-66	9	364	384	6	359	361
+---------LVDTSLLPSATHEEKVIRTAHAFYEHLIGLWAPAIIEAAHETGIFAALADRPVTADDLAASLHADPRTTRVLLDALYAYDVIDRIRSTDSFLYVLSDAARECLLPGGVFSIAGKMVHDRRVAWSAWANLGEVVRQGTR--TGTENDNQISERDYESLVGGINFWAPPIVDVLTDELRRRGADGGTPATVLDVGCGTGLYSQLLLRAFPAWCAMGLDAERIAPLAAAQGQRLGVADRFLVRSGDFWTEDWGTGHDHLLFANIFHLLTPASGQRLMDLAARSVSATGTVVVIDQILDAEREAKTPQDRFALLFAASMANTGGGDAYTFQDYDDWFAGAGMKRVATLDAPMHRILLAQR-------------------
+>UniRef100_F2YRZ2	244	0.563	2.186E-66	27	362	384	2	338	342
+---------------------------SAHRIYEHLISLWAPGVIEAAHDLGVFAELSSGPRTSDQLAESCDSNQRAMRVLLDGLFAYDILDRIPsDSGPTVYRMPDEMRECLLPGGLFSLVGKIEYDRQLAWHSWRNLADAVRTDNRDASGDLQLNQITEHNYESLVRGINFWAPPIVAALADGFETFEWPTDRPASVLDIGCGTGLYSQLLLERFPKWRATGLEAPHIAPIAEAQAQRLGVADRFDVQVRDFWTESWGSDHDLLIFVNIFHLQTPESSLELLRKSKESLADGGLICIADHMVTDEQEAKPVQDRFAMLFAASMLATGGGDAFLLDEYDTWLAEAGLRRVAVLDTPMHRILLA---------------------
+>UniRef100_UPI000A38C1E5	242	0.540	7.592E-66	9	364	384	17	370	371
+---------LVDTSLLPADDDGARAT---HRVYEHLIGMWAPGVIEAAQDLGVFATLTDGPATAAGLAETLGTDLRATRVLLDGLHAYDIVGRERGGDGqAVYTLPASLRGVFAPDGLYSLAGKITHDRNVAWQAWRHLADNVRGGARGEHGGQQVNQISEEDYTSLARGINFWAPPVVSVLADALRERGWGDDTEAVLLDVGCGTGIYSHLLLQAFPQLTARGLDAPRITAIAAEQAERLGVSERFSPLTADFWNDDWGNGTDLALFVNIFHLQTPESAHELLLKTAKGLGEGGLIAIVDHIVDEEAGSGNVQNRFFRLFAASMLATGGGDAYTVHDYDQWLADAGLRRVALLDTPMHRVLLAGR-------------------
+>UniRef100_A0A7C3EEX2	241	0.311	1.415E-65	21	365	384	281	612	615
+---------------------EGRAAADAGRLMELAWGYAAPVVIATAVRYGLFGSIGHRGASIEELVRRTGLSERGLRILLQALVGLRLLRR----NGSRFELTPESATCLVPEQPEYRGGLFLHHVEHLLPRWLQLPEVVRTGWPVREPQCPA-----HRYAGFVESLFASNYPAAKALQRHLQLAGRK--EPFQVLDLGAGSGVWGIALAEGAPQVWVTAVDWPEVLLIARKKAAAYGVSDRFRWVEGSFFEVPLGRGYDLVVLGHVLHAEGVEGVRTLLRRSCDALRPGGLVAIQEFLPDDDRSGP----LLPLLFAVNMLVnTEAGDTYTLAELTGWLEEAGFEAVETLNVPaPSPMVLARKP------------------
+>UniRef100_UPI00167C15C9	241	0.504	1.931E-65	9	365	384	30	388	389
+---------LVDGSKLIGDPRDSAVVRASHRVYEHLIAMFAPGMIEAAFDLGVFVALADGPATPTDLAARLDADAHGLRVLLDGLYCYEIVQRVRAEDGEdLYRLVDGMAECLLPGGLYSLAGRIGYDRAIGWDVWRNLADHVKRPARGADGGYQANQLSAEDYEQVARGINFWAPPIVESLANLLaEEEGWKGEADRSMLDVGCGTGIYSQLLLQRFRGLRATGLDHPRIVPIARGQAERLGVRERFEPVERDFFTEEWNTGQDLVLLVNIFHLQTAEGSEELMRRAAQAVRQGGVVAIVDHIVDDETDDQSIQNRFFRLFAASMLVTGGGDSFSLADYDQWLDRAGLVRTALVDTPMHRILLARRP------------------
+>UniRef100_UPI001BA9CE47	241	0.559	2.636E-65	5	364	384	20	382	384
+-----GNVQpLVDTALLPAGDGQPRVVRAAHRLYEHLISLWAPGAIEAAFDLGVFDELAKGPATADELAKSLSTNAKATRVLLDGLNAYDLLVRTWDADGtVVYVLPDEVRDVLRPDGLFSLAGKIGYDRQMAWGAWRNLAETVRTGALADDGSQQHNQISASEYESLVRGINFWAPPVVHALSAQLKEHGWAGDKTAGMLDVGCGTGIYSQLLLQQFAGLTATGLDVERILPLAIAQSEQLDVADRFHPLRRDFWREDWGTGFDLVLFVNIFHLQTPEDARDLAIKANKALADGGLVAIVDqIVVEDEVQQNSTQNRFFRLFAASMMATGGGDAYTLDQYDEWLTGAGLRRVALIDTPMHRILLAGR-------------------
+>UniRef100_A0A1V2QL50	239	0.561	6.705E-65	9	365	384	18	375	376
+---------LVDTALLPGHGLQHDVVTAAHRVYEHLIAIWAPGVIEAAHDLGVFVELSAGPATAERLAERLDTEPRATRVLMDALYAYDIVERTTEaSAPPSYRLPAAMRECLLPGGMFSLVGKIAYDRRLAWRAWQDFAGAVRRGSRDGSGSDQLNQISVDEYESLVSGINFWAPPVVQVLRQGLRDLAWPCDRAVRMVDVGCGTGLYGQLLLREFPQWTAVGLDVARIAPLATSQAAELGVAARFEATVCDFWQDSWGQDVDLILLANIFHLQTPESAETLVRLAAEALAEDGMLCIVDHVVDDERTAKSAQDRFALLFAASMLATGGGDAYTLKDYDDWFVRYGLRRERILETPMHRILLVTRA------------------
+>UniRef100_A0A2M9IGJ8	239	0.552	6.705E-65	3	362	384	18	379	383
+---PELNVRpLVDTTLLPDWRGSGRVVHSAHRVYEHLISLWAPGVIEAAHDLGVFAELSAGPRTSDQLARACAANQRAMRVLMDGLYAYDIVDRVPTEDGpAVYRMPEEMRECLLPDGLFSLVGKIEYDRQLAWHSWRNLADAVRGDNRDETGGLQLNQISEHNYESLVRGINFWAPPIVEALRGGFETLEWPTDRPASVLDIGCGTGLYSQLLLRAFPRWRATGLEAPAIAPIATAQAERLGVADRFGVQVRDFWTESWGTGHDLLVFVNIFHLQTPESAQELLRKSKEALSRDGLICIADHLVTDEKDAKSVQDRFAMLFAASMLATGGGDAFLLDDYDQWLASTGLRRVAVLDTPMHRILLA---------------------
+>UniRef100_A0A0B5DK60	238	0.563	1.705E-64	27	362	384	43	379	383
+---------------------------SAHRIYEHLISLWAPGVIEAAHDLGVFAELSTGPKTSDQLATACDAEQRAMRVLMDGLYAYDIVDRIPaDAGPALYRMSEEMHECLLPGGLFSLVGKIEYDRQLAWHSWRNLADAVRRDNRDETGSLQLNQITEHNYESLVRGINFWAPPIVEALRGGFETLEWPTDRPASVLDIGCGTGLYSQLLLRAFPGWRATGLEAPNIAPIARAQAERLGVADRFDVQVRDFWTESWGSDHDLLVFVNIFHLQTPESAQELLRRSKEALSKDGLVCIADHLVTDEKDAKSIQDRFAMLFAASMLATGGGDAFLLDDYDRWLASAGLRRVAVLDTPMHRILLA---------------------
+>UniRef100_UPI00055F6ABE	235	0.547	2.803E-63	9	365	384	14	368	369
+---------LVDTELLPSPTGE---IRAAHRLYEHLIGMWATGVIEAAQDLGAFAALTVAPATASGLSELLGTDLRATRVLLDGLYAYDVVERSRGADGqAVYTLPAELHQVFAPDGLYSLAGKIGHDRNVAWHAWRNLADAVRSGARGEDGAQQLNQISESDYTSLVRGINFWAPPITSALADGLRELGWTDGEAATLLDVGCGTGIYSHLLLDEFPGLQARGLDAERIIPIATEQAARLGVADRFDPVVCDFWNDDWGTGVDLALFVNIFHLQTPESARELLLKSAKSLSEDGVIAIADHIVDEDGGVGSTQNRFFRLFAASMLATGGGDSFTVQDYDQWLADAGLRRVALIDTPMHRVLLARRA------------------
+>UniRef100_A0A3E0GTP3	234	0.521	3.825E-63	9	364	384	6	362	364
+---------LVDTGLLPADGANSDVVMAAHRVYEHLIALWAPGVIEAAHDLGVFDALGTAPARADELAEQLGTDTKATGVLLEALYAYEIVAREVADDGvVGYTLAPAMAEVLSPTGLFSLTGKIGYDRKLAWDAWRGLADAVRSGRYDASGSEQGNRISEYEYESLVTGINFWAPPIVRELGRALRELGWPTTESARMLDIGCGSGLYSHLLLQEFPGLSAVGIDVELILKIAVEQSLRLGVADRFATFDGDFTSDDLGRDFDLVLLVNIFHLQSGDSAGLLAKRVASALGDNGIVAIVDQIIDDRQGPRSTHNRFFRLFATSMLATGGGGAYTVDDYDAWLESAGLHRIALVDTPMHRVLLAKR-------------------
+>UniRef100_A0A918C4G1	234	0.536	3.825E-63	25	364	384	30	370	371
+-------------------------ARATHRVYEHLIGMWAPGVIEAAQDLGVFATLTAGPATAAGLAETLGTDLRATRVLLDGLHAYDIVQRERGGDGqAVYTLPASLHGVFAPDGLFSLAGKITHDRNVAWHAWRHLADNVRSGARSAHGGQQVNQISEEDYTALARGINFWAPPVVSVLADALRERGWGDETDALLLDVGCGTGIYSHLMLEAFPRLTARGLDAPRITAIASEQAARLGVHDRFEPLTADFWNDDWGNGTDLALFVNIFHLQTPESAHELLLKTAKGLTEGGLIAIVDHIVDEEAGGANVQNRFFRLFAASMLATGGGDAYTVQDYDQWLADAGLRRVALLDTPMHRVLLAGR-------------------
+>UniRef100_UPI0018D5B757	233	0.517	9.722E-63	9	371	384	14	375	376
+---------LVDTAALADL--DDAESRAHHHLYEHLIGLWAPGLIEACHDLGIFTALRRGPASATDVADAVGADPRAVRVLLDGLQAYGIVRRAESGDPhPVYLLPAELHQAFSSDGLYSLAGKISHDRGIAWDAWRRLADRARTDTRSDGAPPRPNQISEDDYTALVRGINFWAPPIVHRLAGALRESGWAARTAPTLLDVGCGTGIYSHLLLREFPELTAHGLDAERIIPIAERQAARLGLaPSRFRGRTGDFWNDDWGSGYDLVLFVNIFHLQTPELACALLAKAAGSLAADGVIAIADHIVD-DAEPDSPQNRFSRLFAVSMLATGGGDAFTVQEYDRWLASARLRRFRLVNTPMHRVLLARRAAGPAAA------------
+>UniRef100_A0A6G4X3C8	233	0.555	1.327E-62	22	362	384	31	372	376
+----------------------DGEVRAAHRLYEHLIGIWAPGVIEAAQDLGAFAALTEGPATAAALAETLGTDLRATRVLLDGLSAYDVVQRTRGADGqAVYTLPAELHGVFAPDGLYSLAGKIGHDRNVAWSAWRNLARNVRDGARTSDGAEQLNQISEEDYTSLVRGINFWAPPIVRPLAERLRTTGWGTGSGRTLLDVGCGTGIYSHLLLKEFPELSATGLDVGRIVPIAEAQAAQLGVADRFRCVTGDFWNDEWTGDTDLALFVNIFHLQTPESARDLLLKSAKALSDDGVIAIADHIVDEEEGEDSTQNRFFRLFAASMLATGGGDAFTVHDYDQWLSDAGLRRVGLLDTPMHRVLLA---------------------
+>UniRef100_UPI001CD37CE1	233	0.541	1.327E-62	3	362	384	18	379	383
+---PELNVRpLVDTTLLPDWRGAGKVVHSAHRVYEHLISLWAPGVIEAAHDLGVFAELSTGPKTGDQLARACAANPRAMRVLMDGLYAYDVVDRVPaEDGPAVYRMPEEMRECLLPDGLFSLVGKIEYDRQLAWHSWRNLADSVRGDNRDEAGRLQLNQITEHNYESLVRGINFWAPPIVEALRGGFETLEWPTDRPASVLDIGCGTGLYSQLLLRAFQQWRATGLEAPSIAPIAMAQAERLGVADRFDVQVRDFWTESWGSDHDLLVFVNIFHLQTPESAQELLRKSKEALSRDGLVCIADHLVTDEKDAKSVQDRFAMLFAASMLATGGGDAFLLNDYDQWLASAGLRRVAVLDTPMHRILLA---------------------
+>UniRef100_A0A2T7T4I2	233	0.530	1.327E-62	3	362	384	18	379	383
+---PEHNIRpLVDTALLSDWRGSGKVVHSAHRIYEHLISLWAPGAIEAAHDLGVFAKLSTGPMTGDQLAEACQANRRAMRVLMDGLYAYDIVDRSSTDDGpAVYRMPEEMRECLLPDGLFSLVGKIEYDRQLAWPAWRNLADAVRHDNRDEVGELQLNQINEHNYASLVRGINFWAPPVVEALRGGFETLDWPTDRPASVLDVGCGTGLYSQLLLRHFGQWRATGLEAPHIASIAEEQAERLGVAERFEVQVRDFWTESWGSGHDLLLFVNIFHLQTPESARELLHKSKQALSENGMICIADHLVTGEQDAKSIQDRFAMLFAVSMLATGGGDAFLVDEYDGWLAETGLRRLALLDTPMHRILLA---------------------
+>UniRef100_UPI001661D816	232	0.548	2.471E-62	2	361	384	7	364	369
+--TFDNHTPLVDTELLPG---RGSGVNAAHRMYEHLIGIWATGVIEAAHDLGAFTALIGAPATAGELSTRLGTDLRATRVLLDGLAAYDVVERSRAADGqAVYTLPPEMHDIFAPEGLYSLVGKIRHDRNVAWGAWRNLAGNVRTGARNSEGSQQLNQISEEDYTSLVRGINFWAPPIAATLATALREQGWTDGAGRTLLDVGCGTGIYSQLLLQEFSGLNARALDAERIIPIANAQAHRLGVAERFNPEVVDFWADDWGTGVDVALFVNIFHLQTPESARELLLRSAKALTEDGVIAIADHIVDEDSTDGNTQNRFFRLFAASMLATGGGDAFTVQDYDQWLADAGLRRVALLDTPMHRLLL----------------------
+>UniRef100_A0A7V1RGG8	231	0.309	3.371E-62	23	366	384	3	336	340
+-----------------------ELAPDPTALFELATGFWASATLLAAEEVGVFHVLTEAPRTASEAAQALGADRRALERLLDACSGLNLLVK----QGERYLLSPLAAAYLVPGAPGGLASG-IAWARDQYAAWGRLAETVRTGRPAVDPGDHLGG-DPEQARRFVLAMHERAAGIARAVVGSL-----NLDGVERLLDVGAGPGTYAVLLARRHPGLSATLLDLPPILDAARELVDACGVAERIALRPGDASSGQYgEEAFDAVLFSGVLHQMPPETIRRMLEGAFRALVPGGRVFLSDILADATHTRPV----FSALFSLQMLLTTeGGGVFSVEECRSWLEQAGFAEIEVQRLPaplPYTVVSALRPR-----------------
+>UniRef100_D7BZK8	231	0.566	6.277E-62	22	364	384	25	368	370
+----------------------DGEVRAAHRLYEHLIGIWAPGVIEAAQDLGAFAALTVGPATAAQLAEVLDTDLRATRVLLDGLYAYDVVERSRGEDGqAVYTLPAELHGVFAPDGLFSLAGKIGHDRNVAWNAWRRLAENVRSGARTAEGAQQLNQISEEDYTSLVRGINFWAPPITRSLAGALRELGWTTGRSRTLLDVGCGTGIYSHLLLREFPELTARGLDAERIIPIAARQAGQLGVAERFQGEVVDFWSEDWGSGTDLALFVNIFHLQTPESARELLLKAVKGLTEDGVIAIADHIVDEDGGEGSVQNKFFRLFAASMLATGGGDAFTVHDYDQWLADAGLRRIGLLDTPMHRVLLARR-------------------
+>UniRef100_A0A1R1S6N2	231	0.569	6.277E-62	22	364	384	25	368	370
+----------------------DGEVRAAHRLYEHLIGMWAPGVIEAAQDLGAFAALAVGPATAAQLAEILDTDLRATRVLLDGLYAYDVVQRtRGDDGQAVYTLPAELHGVFAPHGLFSLAGKIGHDRNVAWNAWRHLADNVRSGARAADGAQQLNQISEEDYTSLVRGINFWAPPITRALAGALRDLGWTTGRSANLLDVGCGTGIYSHLLLREFPELTARGLDAERIIPIAARQATQLGVAERFRGEVVDFWSEDWGSGTDLALFVNIFHLQTPESARELLLKATKGLTEDGVIAIADHIVDEDRGEGSVQNKFFRLFAASMLATGGGDAFTVHDYDQWLADAGLRRVGLLDTPMHRVLLARR-------------------
+>UniRef100_UPI00224D4A51	229	0.538	1.595E-61	9	362	384	17	369	381
+---------LVDYTKLSADGAAPSEIRAAHQVYEHLVSLWAPSIIEAAHDLGFFVELADGARTADEVAHARGTDRRATRVMLDALYAYGLVGKSCEGSvPHRYVLPDACRGALLPGGFFSLVGKMAHDRNVAWNAWSDLARTVRRGTCDESGEDLANGISETDYEDLVTGINFWAPPIVDTLANCLADSGWKAGEAVSVLDVGCGTGLYGQLLLQRFPQWRAEGIDAPRIVPLADAQAKRLGVEDRFTGTVQDIWRGGWGEGADLILLNNMIHLQTAESGRKLLRTAADSLAPDGLVCIADQVIVNDEES--PQDRFAMLFAASMLATGGGDAHSLDTCKEWFAAAGLEMVAVLDAPMHRVVIA---------------------
+>UniRef100_UPI0020BDB3A6	228	0.555	4.051E-61	9	365	384	17	371	372
+---------LVDTARLTGVEAESQA---AHHLYEHLIGLWAPGVIEAAQDLGAFSALTLGPATAVRLAEILGTDLRATRVLMDGLHAYDVVRRSHSADGqALYTLPPELHDVFSPHGLYSLVGKISHDRKLAWNAWRNLAENVRTGARDATGGERVNQISEEDYTSLVRGINFWAPPIVRTLADALRELGWTTGESARVLDVGCGTGIYSQLLLREFPALTASGLDTERITAIASRQAQELDVADRFEVVVKDFWNDDWGTDIELALFVNIFHLQTPESARELLLKSSKSLAQGGLVAIADHIVDDDDGAGSVQNKFSRLFAASMLATGGGDAYTLHDYDQWLADSELRRVALLDTPMHRVLLARRA------------------
+>UniRef100_A0A5D0QPB3	228	0.563	7.541E-61	9	362	384	7	358	362
+---------LVDRRLLPDVGAGHETVAAAHHVYEHLIALWAPGAIEAAFDLGVFAALADGPATAEALAGRLEVDQRGMRVLLDALSAYDLIDRGSSAGGVRYGLRAGLRECLLPDGLYSLAGKVRYDRMLAWTAWRNLAQAVRGDGSAVP---QHNQISTTEYESLVRGINFWAPPIVSILAGALRDRgWPAGPAAPAMLDVGCGTGLYSQLLLQQFPELTGVGFDVERIVSIARAQSERMDVGDRFQPLAIDFWQRDWGTGFDLVLFANIFHLQTPDSARELSIRASKALAGGGVVAIIDQIVDDRADADSVQDRFFRLFAASMLATGGGDAYPLSDYDEWLSVAGLRRAALVDTPMHRILLA---------------------
+>UniRef100_A0A1E7JVS4	227	0.558	1.404E-60	22	362	384	25	365	369
+----------------------DGEVRAAHRLYEHLVGIWAPGVVEAAQDLGAFAALTEGPATAAQLSERLGTDLRATRVLLDGLHAYDVLGRARGEDGqPVYSLPPEMHGVFAPGGLYSLAGKITHDRNVAWDAWRNLAENVRSGARTSGGAQQLNQISEEDYTALVRGINFWAPPITQVLAEGLRAHGWTSGADRRMIDVGCGTGIYSQLLLNEFPELRARGLDVERIVPIAQEQAKRLGVADRFRTEICDFWNDDWGNDSSLALFVNIFHLQTPESAHELLLKTSKSLAEDGVIAIADHIVDEDEDGST-QNKFSRLFAASMLATGGGDAFTVQDYDQWLADAGLRRIALLDAPMHRVLLA---------------------
+>UniRef100_UPI0018F88670	224	0.498	1.684E-59	22	364	384	12	356	364
+----------------------DAASRRAHLLYEQLVSLWTPAVIEAAHDVGLFSALSRGPATSDELAAALSVHPRGARILLDALFACDLVECDEQPGcAPIYTLPEDVKACVEPLGLFSLAGKMLYDRRFAWDAWRNFATAVREGGVdQSSKQCRQNQISPEEYRFLTRGINFFAPPIIHALGEGLAKIGWSTRRAISVLDVGCGTGIYSQLLLQRHATWRAVGMDCETMAALARAQSAELGVEDRFSCRASDLWRLPWGGDFDLILLCNMFHLQSPDGAARLMKLAGEAVSTAGIVCVIDQIRDEHRHVDTAQNRFALMFAASMLATGGGDTYTLEQYDEWLRDAGLERLIVLPAPMHRILIARR-------------------
+>UniRef100_I2Q4T4	223	0.314	3.133E-59	27	353	384	5	316	332
+---------------------------TPAALLEIAGGYWKTCALHAGVVLDVFTPLADVPLTAGELAARLGCDARALGMLLRALAAMELLSR----SGERYALTGEAREFLDARSPRYIGYAVRHH-HRLMPVWTRLPEAIRSGRSLREHM--GGDADPGDREDFLLGMFNIAMGVAPRLARTLDLSGR-----RRLLDLGGGPGTYAVHFCLAHPDMTATVFDLAGSREFAASVSERFGVADRVEFVAGDYLRDPVPGGYDVAWLSQILHAEDPAGCRTILGKAAGALSPGGLLFVHEFMLDDDAAGP----EFAALFSLNMlLGTDHGQSYPEGRIREMMEGAGLKNVRRLD------------------------------
+>UniRef100_A0A840IMV4	222	0.583	4.274E-59	44	362	384	1	314	318
+--------------------------------------------IEAAHDLGVFVELAGEPRSGAELARALDADPRAMSVLLDALCAYDLL---VEDGNARYALPAELRECLLPDGLFSLVGKIEYDRTLAWRAWRNLADTVRAGTRVEDGSDAPNQIGETEYRSLVHGINFWAPPIVNVLAGALAERGWTPRRPVSLVDVGCGSGIYSHLLLRRFPALTATGIDVRRIMPLALAQADRLGVADRFRPAVMDFWSEDWGLGYDLALFVNIFHLQTPASAEELLRRAAKSLAGGGLVAVVDQIVTGDAHS--AQNRFSRLFAASMLATGGGGAYRTEDYDRWLDGAGLTRVALLDTPMHRVLLA---------------------
+>UniRef100_UPI00210A57ED	218	0.529	9.522E-58	10	365	384	40	405	406
+----------VDRSRLAGT---DAQSSAAHRVYEHLVALWAPGVIEAAQDLGAFAALTSGPATAAELARTLDTDPRATRVLLDGLHAYDIVERAMTEDGEiRYTLPVELHDVFSPGGLYSLAGKINYDRSLAWNAWRDLAHNVRTGARDAEGGHQLNQISEEEYTSLVRGINFWAPPIVSALADALREQGWSTGDGAKVLDVGCGTGIYSQLLLREFPLLTARGLDVARITPIAIRQAKELGVADRFEPTVVDFFHDSWGGG-DLALFVNIFHLQTAESARELMLKAAKEINEDGVIAIADHIVVEDTHGAPgvsdgadaagtgsVQNRFFRLFAASMLATGGGDAYTVEEYDGWLADAGLRRIALIDTPMHRLLLAKRA------------------
+>UniRef100_A0A3C0VCK0	218	0.279	1.299E-57	33	364	384	9	323	326
+---------------------------------QMASGFMPARVLLTALELDVFTACGAGAATAEELARRTGARPAPLARLLNALAALGLLDKRGD----RYRATPPARTHLIAGRPGYL-GDIMRHRASMWERWSDLTAIVRTGR------VPPRAFTKERERRFIKGMANLGASAAPACARALR---RELAGARRLLDIGGGPAVYACELARAWPKLSVVVLDLPGPLAYARETIAAYGLARRVSVKAGDVCAArSFGRGFDVAFMSSLIHSFKPAVVAEVIRKAAGALRPGGFLAVKEFFIDPGRASPP----FTALFSINMLVAGAGDVYTRGEVEGWMRAAGVRPVRYVDLPQFSGIVVGR-------------------
+>UniRef100_A0A1F5AWX5	218	0.297	1.299E-57	28	365	384	2	329	330
+----------------------------PTRLVEMASAFYESSVLFAASDLGIFAKLAElGEADARTISAVSRLDPRGARLLLDACVALELLVKKGD----RYQNSPEAAAFLVPGAPADLSGAIRYNRD-VYGAWGKLKELVKTGKP-VERAELHLGEDPERTRTFVLAMHGRAMGIGQAVIPLLDLDGRKA-----VLDVGGGPGTYSILIARAFQQVRCTVIDLPEVARIADEIISQAGVGNRVRTLAGDYHTLPFPADQDTVVFFGVLHQEDPAAIQDLFRRAYGAMLPGGRIYVLDMMTDASH----ARPKFSALFGLNMaLTTPHGWVFSDDELKGWLKEAGLTDFNCRPLPppmPHWLATARKA------------------
+>UniRef100_G7Q8Y2	218	0.307	1.299E-57	27	353	384	5	316	332
+---------------------------TPAALLEIAGGYWKTCALHAGVVLDVFTPLGDGPLTAGELAVRLGCDARALGMLLRALAAMELLAR----SGEGYALAGEAREFLDARSPRYIGYAVRHH-HRLMPVWTRLPEAIRSGRSLREHM--GGDADPGDREDFLMGMYNIALSIAPRLAQSLDLSGR-----RRLLDLGGGPGTYAVHFCLAHPEMTATVFDLAGSREFAASVSERFGVADRVEFVAGDYLKDPVPGGHDVAWLSQILHAEDPAGCRTILGKAAGALSPGGLLFVHEFMLDDDAAGP----EFAALFSLNMlLGTDHGQSYPEGQIREMMEAAGLRDIRRLD------------------------------
+>UniRef100_A0A3C1EP29	216	0.289	6.124E-57	28	361	384	10	327	336
+----------------------------AAPIMALARGFMASRILLTAFDLDIFTALDRGPIDSVQAARRIRCDNRATDRLLNALVSLGLTRK----KGRLFSNTPLAARHLVRGRPEYLAG--LGHCVHLWDSWSTLTAAVRRGRSVLEPSVGRRGAAW--LSAFISAMHERARAQADAVVK-----GLDLGAVESVLDVGGGSGAYAMAFVRAKPGLRATVFDLPQVAPLTRRYISREGLSGRVAVRAGDYEKDPLPKGFELVLLSAIIHSNSPTANIRLLRKCRRSLNPGGRIVIQDFVMNPDRTAP----AFGAIFALNMLtATAAGDTYTESEIRSWLKQAGFGSIKRRDTPFASTLI----------------------
+>UniRef100_A0A933TFS2	216	0.306	8.351E-57	38	364	384	23	334	335
+--------------------------------------FMESRVLLTAWELGVFTALGRGARTAAQVARTARADPRAMDRLLDALVSVGLARK----SGRIFSNSPSAARYLVAGRPAYIGS--LGHMASLWESWSTLTQAVRAGRSVLKDDMPRRG--KEFFVPFIAAMHERSSLQGPSFARALP-----LAGVRRLLDVGGGSGAYSIAFARAHPALRATVFDLPQVVPLARGYIRAAGLQDRVEARVGDYDRNPLPDGYDLVFLSHILHSNSPARNRRLLRKCARSLNPGGLVVIQEFLVDEDRTGP----QFAALFALNMLVgTPAGDAYTEREIGSWLKGARLRGIRRKDTAFDSaLLIARR-------------------
+>UniRef100_A0A7V5CKK2	215	0.283	1.553E-56	27	356	384	3	316	329
+---------------------------SVDKVWETARAFQASRILLTGFELGVFATLGDNAMTSAEVASKIGADPRAADRLMDALVVLGLLTK----EEGKFRNSGEARETLVPGKPTYAGGALGHVIS-LWKSWSTLTDAVRKGTSVFKHEDEARA---EFVKPFIAAMHFNASNLAPIILKQI-----DLTGVRRVLDVGGGSGAYSIAFCKASPEITSVIFDLPDVVPLTNEYAAKAGVADRISTVTGDFNTDNLPVGFDLAFLSQILHSNSPDENERLMRKVGTALNPGGQIVVQEFVVDEDRISPPG----PVFFSLNMLVgTKAGDTYTEKEIGSWLDGAGFGEIKRIDPPG---------------------------
+>UniRef100_A0A1V4XPT3	214	0.272	2.117E-56	27	352	384	4	314	331
+---------------------------TPEAVLQLARQFMESRILLTAAELGLFSPLAKKPHTAEQLSGRLGCDTRALAILLDALAAMGLLEK----RDGAYRTPPAAAPFLCGGSPRSVIPMILH-AAHLWERWSDLTPIVRATSSSAAPASGARST--EELSAFIGAMHIAGLPLAEKIVAAIR-----PGQARNLLDVGGASGTYTIAFLRAAPGMKATLFDRPEVIPMARERLAEAGVLDRVRLEAGDFHRDELPGGHDLALLSAIIHQYSPQENRELFGKVSRALVPGGRIVIRDHIMDPDRT----QPRDGAIFAVNMLVnTRGGSTYTFEEVRAWLEGTGFANVRFL-------------------------------
+>UniRef100_UPI000A3C465B	214	0.454	2.887E-56	9	362	384	8	365	374
+---------LIDYAA-FGSTgaPEEDTVVAAHELYSTLIGLWAPAIIEAAAELGVYPLLRDEPVGSDEIAAELALDPAAVRILLDGLHACGMLRRGLTGGGvPRYRLEDRFAPLLLGTGEYHLLGKMAYDRTVAWPAWRGLAETIRSGGVAPGALPEKNQNSERDFVSLVSGINFWAPHAIESVRTALRaDLGWDLARPTSVLDVGCGTGIYSQLLLRGESTWTATGFDTPKVAEIATAQAARLGVGDRFDCEAVDFLAEDWGPPRDLVLLVNVCHLLPRHLVSELIARAAKAVRPGGCVCVVDHMhLDTKDEFDEPQDRFAALFAVSMLSTGGGDTHRVSDYRHWLTDAGLRPAVLRPTPMHRLLLA---------------------
+>UniRef100_A0A345XPI4	214	0.523	3.936E-56	9	362	384	14	359	363
+---------LVDTTLL--PAGGDGEVQAAHRVYEHLVGIWAPGVVEAAQDLGAFAVLTEGPATAAQIAERLDTDLRATRVLLDGLHAYDILGRvRGDDGQPVYSLPPELHGVFAPGGLYSLAGKITHDRKVAWNAWRNLADNVRSG------TQELNQISEEDYTSLVHGINFWAPPITQVLAKGLREHGWTSGAGRSMIDVGCGTGIYSQLLLNEFPELRARGLDVERIVPIAREQAERLGVADRFRPEICDFWNDDWGNDSSLALFVNIFHLQTAESAHELLLKTSKALAEDGVIAIADHIVDEDKDGST-QNKFSRLFAASMLATGGGDAFTVLDYDKWLADAGLRRIALLDAPMHRVLLA---------------------
+>UniRef100_A0A7C3MML6	213	0.302	7.316E-56	27	364	384	8	339	340
+---------------------------SPQQLMGLLQGFMGSAALKAGLDLELFTHIAHGADTAEKLAAVKKVPERAMRILCDALVAFGALTK----SGGHYSLPPASQAMLVKGSPAYFGAMAgIMCNPLMWNEAGRLADVVRAGHSlLDQGAEAPEHPFWEEFSRRSKQMATMGGPAVAELA----ASLFGAGEPARILDIAAGSGMYGFSALKRFPGARLVSVDWPNVLRLAEPTAKQMGLAERVEFRPGDIFKDDLGTGYDLVLAVNIYHHFGIERNTELSRRLHAATASGGRLIIVDAVPDENREH----ERFALVFALTMLiWTREGDTYTLSEYERMLKPAGYRDIELKAVPgpaPFQAIVARK-------------------
+>UniRef100_A0A4V2PBK1	212	0.452	1.360E-55	8	367	384	14	368	372
+--------SVVD----FEEIGTDRTSESAHAIYAALVAQWQPAMLETASSLGLFGALRAGPLRAEEIAAVTGTNTRAVKVLLDALVAYGWVTSIPDGENSRYSADPAVAASLSSDSIFSLTGKIGYNRGLSRSAWRTLDQSVRDGVRAADGI-GNNEITAHAYEDLVTGINFWAPPIVDKLIDWTTRTGWRREQSRKFLDIGCGSGIYSQLLLRHFSRAVAVGLDVESIGRLAVGQSVELGVDDRFRLRTANFWRDDWGTGHDAVLFANIFHLVNPAGALELLDKARDAVADDGFVFIVDNIAVGGTESDSPQDRFAALFAVSMLVTGGGSTYTLADYDQWLSTTGLERVALIDAPMHRIVVARRTEE----------------
+>UniRef100_A0A1G3USZ5	210	0.277	6.404E-55	28	364	384	3	329	331
+----------------------------PDRIIGMASAFYESCVLFTASDLGIFARLSEaGPADAQSLALTLKLDERGVRLLLDACVAMELLQK----EGSHYANTLESKAFLTPGSPGDLSGAIRYNRD-VYTAWGKLKDFVKSGRP-VESPESHLGQDPERTRTFVMAMHYRALGMGRAVIGEL-----DLSGSKTVLDVGGGPGTYSMLIAQANPDATCTVLDLPEVVAVADELIRQQALQGRVKTLSGDYRRISFPEGYDMVNFFGVLHQESPQSILLLLQKAYRALRPGGAVNVMDMMTDSTHT----KPKFSALFGVNMaLTSENGWVFSDLELKEWLKEAGFADCMVKPLPppmPHSFAAARR-------------------
+>UniRef100_UPI0018935592	208	0.407	3.014E-54	9	362	384	20	377	381
+---------VIDYGAFAPTgSDDEKTVIAAHELYTVLIGLWAPAIIEAAHDLGVYPQLSGAGVSSDQVADVLSLPGTASRILLDGLHACGIAERFRSDDGiVRYRLRERFAPLLLGGGAYHLLGKLSYDRSVAWSAWWRLPDSIRNGNPGPGESDGRNQNSEQDFVALVSGINFWAPHVVQQLrAGLAEDLGWDLSHPRSILDVGCGTGIYSQLLLRKQPEWTAVGIETPKVAHIAREQALRFAVADRFDCRETDFLEDGWDVSCDIVLLVNVVHLLPAATAAEFIERASRAVRPGGCLCVIDTILDDSKDTfDQPQDRFAAMFAVSMLATGGGDAHCVSDYRRWLHAAGLRPTAVRETPMHRVLIA---------------------
+>UniRef100_A0A950Y7R7	206	0.274	1.418E-53	32	365	384	0	321	323
+--------------------------------MQMAWSYAPPLIIEAAVRNGFFDALATKPMNASELAQATGSSERGVTAVMDALVGLALAARDRN---GRYVLTAESDTFLVSARPGSLGGFFRHISDLI-PAWLPLRDIVRTGEPARKVDSQETGAA--FFSNFVESLFPLGYPAALGVAKSL---GAPLDAPLQVLDLAAGSGVWSVAIAHTYPQARVTAVDWEGVLPVTKKVTARERVADRYEYIAGDILETDFGGGYDVATLGHILHSEGDARSQELLRKVGRSLKPGGAIVIAEFLANEERSGPP----QALIFSVNMLVnTSAGRAFTFGEIRAWLEEAGFIDARTLEIPAPSLIVARKA------------------
+>UniRef100_UPI000B2CDD0E	205	0.465	2.633E-53	28	370	384	18	361	362
+----------------------------AHQLYAALVAQWQPAMLESASALGIFDVLRSGAASSTAVAKSIGADERSVRVLLDALAAYGWVSGRDGVDGEpLYEVDESVAACLTAGSMYSLIGKIGYNRSVSGDAWRKLDRVVREGISGHDGEIENNGISAVAYEDLVTGINFWAPPIVDKITAWLRAAGWGAGEARDVLDIGCGSGVYGQLLLGDFPAATATGVDAPNILRIAAKQAAALGVGERFEARGADFWTSEWGTGRDLVIFANIFHLVNPSGAEKLLEKARESVADDGIICIVDNIQVGGAETDSPQDRFAALFAVSMMVTGGGATYRLAEYDEWLRVAELERVALLDAPMHRVILARPRREGSS-------------
+>UniRef100_A0A6G9ZAG5	205	0.447	3.588E-53	5	363	384	31	389	393
+-----GRTTLVDYEHFQRSGVGFDEICAAHKVYETLVGLWAPGVIEAADELGVFREIAKSSKTPAELAEVAGAGSHGMRILLDALCVYGLLNRDvDDSDGYKYSLKPFFGSVVTGHGSASLIGKFLYDRQLAWPAWVNFVDAVRN-SGDPDSGRQENQIPAGQYIHLTKGISFWAPPIVDVLCHRLEELGWSSSSEKHILDVGCGTGIYSHLLLRSFRGSQAIGLDVPEICRVAIESASEFGVDDRFATREVDFWSEGWPKNQDLVVIANIFQMLTPDSAKRLIDLAASSLSESGVVCIVDQIRIGKAEFDTAQDRFAAVFAASMLATGGGDTFHLNQYDDWLESSDMHRIDLLDTPMHRIILAR--------------------
+>UniRef100_A0A7V7EA79	204	0.311	6.664E-53	30	370	384	9	333	335
+------------------------------RINEISTGFKGSMILFAANDAGVF-ALLEEERSADELAAVAGWHPRAARMLLDALVALDLIGK----SEGRYRNTPIASACLVPGGKAYQGHIIKHQQNG-WDAWARLEVSLRSG---TAVERDAHERSPEELRAFILGMRDTARISARTMCDVV-----DLSTHRHMLDLGAGPATYAIVFTQRHPELRATVFDVPEVIPIAREQVAAAGLDERFAYIEGDMLADDLGSDYDLVLASNIIHMYGPVENRALMKRCYDALAPSGLLIVKDFLVDDGRSGP----AFGLLFALQMLiHTPCGDTYATSELSEWTNEAGFAEGRLIElTPQARLWLAGKPPARSA-------------
+>UniRef100_A0A7T1WXA6	203	0.299	1.686E-52	34	365	384	0	326	327
+----------------------------------MMSAYKETSVLKAGIKLGVFDELArEEPQDAESLARRLGSDPRGMRILLNALAALELIE----TDGRQYRLPPGAAELLSRDSDGYAGDMIHVIaSDYEWDALKNLDGAVRNGGTVL--DEHAETPEYSYWEDFAAFAPHVARPTARVLADALEPWARD-RESLDVLDLACGHGIYGYTVAQRFEQAAVWSLDWENVLDVAAKHAGSMGVRERTNFIAGDMFDVSFGGEYDLVLITNVLHHFSDERARELLSRAAAALRPGGKIGIVGF---TTSDAPPALDPAPHLFSVLMLVwTSEGEVHSERNYRRMFTDCGLEepSVHQVENLPFRVLLADRA------------------
+>UniRef100_A0A932TFF8	203	0.313	1.686E-52	28	365	384	10	335	336
+----------------------------PRSIMDILWSMVPIRVLTAAVKLQIFAPLEMSPQTAAEVARQVEADARGIRMLLDALVGIGFLTKAGD----HYALTPVARAHLVPGKTGYL-GDYVAGSARMAERWGGLAEAVRTGQPVM--AVDEQETAEEYFSTLVRALQVTNGPPAQRLAAHL----ASRRSAARVLDVACGSGVWGIYYALADPQARITAHDFPTLLELARQYIRNHGVEDRFEYLPGDVRTVDFGvEHYDVAILGNICHSEGEAGSRALLRQMARALRPGGTAAIIDMIPNEARTGPP----FPLLFALNMlLHTREGDTFTLAQYTAWAREAGLERVETVDIGSHsPAILATRP------------------
+>UniRef100_A0A349GW63	198	0.285	1.280E-50	38	365	384	1	318	319
+--------------------------------------FYDSCVLFTASDLGIFNHLAQHPdATAADLASACQLDLRGATLLLDGCVALDLLTKTGD----RYRNTPETACFLVPGAPGDLSKAIRYNRD-VYAAWQQLPAFVKTGKP-VERPEIHLGEDEARTRAFVHSMHGRALGIGRSVVPQLDLAGR-----TQLFDAGGGPGTYSVLIAQANPQIRCTFLDLPGIVKVANELVAAQGMADRVTSIPGDYHTTPFPDGNDVVIFFGVLHQESPASIQDLFRRAYASLVPGGSVYVLDMMTDATHT----QPRFSALFAVNMaLTTTNGWVFSDQEAIDWLTGAGFIGAACRPLPppmPHWLVTATKP------------------
+>UniRef100_A0A7K0ITR6	198	0.293	1.280E-50	28	353	384	2	312	328
+----------------------------PSELLQLSGGYWATCALHAAVKLDLFTCIAGSPATSSEVSRLTNTDHRSMTMLLNAVAAIGLLHF----DNGKYVATPFSAEYLSKNSDKYLGHIIMHHHNLM-PGWSNLDEAVKSGAAVR--SNSSRSDDAADRESFLMGMFNLACLIAPKIVPAIDLSGR-----RSLLDLGGGPGTYAIHFCLHNPELRAVIYDLPTTREFAEQTVQRFGLSDRISFSAGDIITDGIGSGYDVVWISHLLHSEGPAGAATMLDKAVRSSRPDGLVFVQEFILDDDRTAP----LFPALFSLNMlLGTQAGQSYSQQELTQMMINAGVENISRLP------------------------------
+>UniRef100_A0A8J3ZYP0	196	0.298	3.235E-50	25	365	384	0	334	335
+-------------------------MQASADIFHALLAYKKSAMLRTGIELGVFARLAERPATADEVARDLELAPRGSRLLLNALVAIDVLE----ETDGVYRLAPLAAETLDPNRDGYLGElSRILTSRWEWEAMGRLPEAVRRGGPV--IAENAEQLDYGYYEEFATHAGAVTRPTVARMTGTVHDWAAQRER-LNILDLACGHGMYGLTLAQQHPHARLWSVDSAKVLEIAQKNAARLGVADRMQTIAGDMFTLDLGGPYDLALITNVLHHHTPERATELMRRVAAVTRPGGKLVLVGITADDGPVRESPE---AHLFSLLMLVwTDNGEAHSAGSYERMLSAAGYRDMRlyRQDEIPMRVIVAERA------------------
+>UniRef100_UPI0018675D04	184	0.381	4.614E-46	28	366	384	23	356	358
+----------------------------AHRLYSALISSWETAIIEAAYNLGIFSCVASGPATLFEIAKRTACNEECLRILVDALVAYGwLFTNAMPGSDPTYHLPEEYSDVLTAvEGVNDLTGKIYYDQEIAWQYWRNLAHTVKTGSVRN-----VNGISTATYRQLVLGIRFWAPPIAAAIGKALDK-HHFLREDRLLVDIGCGSGIYSHLLLQQHHGLRAVGYDVPEIADIAHESAGKFGVSSRFRMVTGDFFESDW-AAADLYLFANIFHLFDPEKCKILLSKARAGMSDDGRVLIVDAIRASGGSPVTSQEKFAALFAVSMVASGGGNTYSLNTFDSWLAELGLYRIDYLNTPMHGVIVAGWLP-----------------
+>UniRef100_UPI001FC9146D	181	0.559	7.376E-45	111	364	384	1	254	255
+---------------------------------------------------------------------------------------------------------------FAPDGLYSLAGKITHDRNVAWQAWRHLADNVRGGARGEHGGQQVNQISEEDYTSLARGINFWAPPVVSVLADALRERGWGDDTEAVLLDVGCGTGIYSHLLLQAFPQLTARGLDAPRITAIAAEQAERLGVSERFSPLTADFWNDDWGNGTDLALFVNIFHLQTPESAHELLLKTAKGLGEGGLIAIVDHIVDEEAGSGNVQNRFFRLFAASMLATGGGDAYTVHDYDQWLADAGLRRVALLDTPMHRVLLAGR-------------------
+>UniRef100_A0A938CP11	167	0.283	3.444E-40	35	364	384	20	343	344
+-----------------------------------AFGILAAEAVLAGLRLGLIEEVAARPATARQLARKVGAKERGVRVLLDALVALGQLGK----EGEQYCLSASTQMLLsLPGVDaKSYCADALLHLSAFSDGLRQLANVVRTGRPPSADPADTE----RFLVALAGSLFPFNYPVARALCHRIR--GEFGRGPLAILDVAAGGAPWSMPFAQGNRQARVTAVDFPAVLEVARHYAQAAGVEGQYELLPGDIRKAPFGNGqFDLAILGHICHSEGPNRTPRLFRKVAQALKPGGVMLVLDFVADEHRTG-EGSGALALLFALNMLVSaTDGDTFTESQYRLWGVQAGFSGPERLELPaPYPALLFRK-------------------
+>UniRef100_A0A3M1IMN7	153	0.300	1.529E-35	138	365	384	0	218	221
+------------------------------------------------------------------------------------------------------------------------------------------PEVVRTGRPVPRDRRPA-----EEFARFVEALFAGNLPAAQALQAHL--GLRQTTAPCRVLDLGAGSGVWGIGLAEGAPQVRVTAVDWPEVLAVARRLAAEHGVAERFRWIEGDFFEVGLGNDYDLVVLGHILHSEGIERVRRLLERSHEALRPGGRVVIAEFLPADDRSGP----LQPLLFAVNMLVnTEAGDTYTLAELTAWLEEAGFEAVETLPVPaVSPLVLARKP------------------
+>UniRef100_A0A7C2IW83	139	0.282	4.702E-31	151	365	384	2	205	206
+-------------------------------------------------------------------------------------------------------------------------------------------------------PPGVEGRDPAWTEAFIAAMHRGALAAAPAMVATV-----GAAKVRRLIDLGGGSGAYSIAFARANPELRAEVLDLASVVPIAEKHIAEAGLGDRVKTRVGDLLKDEFGSGYDLALLSAICHMFSPEENRDLLRRTFRALVPGGRVVIRDFIVEPDKTAP----KWAVLFALNMLVaTRGGATYTEAEYSSWLEEAGFVSIER---PQADLIVARRP------------------
+>UniRef100_A0A1F5BUK4	139	0.309	8.616E-31	150	365	384	25	235	236
+------------------------------------------------------------------------------------------------------------------------------------------------------GLFAKLGEDSERTRTFVLAMHGRAMGIGQAVVPLLALSGRKA-----VLDVGGGPGTYSILIARAFPQITCTVLDLPEVVRIAEEIISQAGVGDRVQTLAGDYHTIAFPANQDAVIFFGVLHQEDPAAIRNLLRRAHGALRQGGSIAVLDMMTDASHT----QPKFSALFALNMaLTTPHGWVFSEDELKAWLVEAGFTDFNCRPLPspmPHWLATARKA------------------
+>UniRef100_A0A7C4C0Z0	134	0.333	2.399E-29	195	367	384	12	181	182
+---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------RRMLDVGGGSGAYSIAFARANPELHADILDLPEVLAIAKRHISEAGLEERIATVAGDLRKDKLGENYDLVLLSAICHMLSVDENQDLIRRCFDALAPGGRIVIQDFILEADKTAP----RTAALFSINMLVgTRDGASYSEPEYVDWLAGAGFSDIRRVRLPGPAGLMAGVRPR----------------
+>UniRef100_A0A7C6B4B6	133	0.295	5.934E-29	192	365	384	4	175	177
+------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------EGVRRMLDLGGGSGAYTIAFAQASPELEADILDLAPVLRIARRHIEEAGLSDRIRTRPGDLHQRSYGAGYDLVFISAICHMLDPKQNRGMLRKSYRALKPGGRVVIQDFILEADKTAP----RAAALFSLNMLVgTRAGASYSEPEYRSWLQDTGFGGISRLHLPgPTSLMIGRRP------------------
+>UniRef100_A0A2V9K3Q8	133	0.331	8.024E-29	185	356	384	8	176	187
+-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------RLVRLEPGRKHRVLDIAAGHGKFGIAFAREYPKVEIVAQDWPNVLEVARENARAAGVEDRFRTLPGSAFDVDYGSGYDLVLLTNFLHHFDPETCERLLRKARAALAPGARAATLEFVPNEDRVSPPVPATFSLMMLG---STPKGDAYTFSELERMFRNAGFARSELHALPP---------------------------
+>UniRef100_T0ZCY9	129	0.284	1.209E-27	167	357	384	20	205	215
+-----------------------------------------------------------------------------------------------------------------------------------------------------------------------RSLHVANRAPAERLAQALEIADRRPLA---VLDIGCGSGIWGIAIAESAPHARVTALDFPQILELTREYATRHGVQDRFEYLPGDLRTAALGtARFDLSILGNIVHSEGEKSSRALFRRLHRATRPGGQLAICDMVPNDERTGP----IYPLLFALNMLVnTTAGDTFTLGEYSAWLGEAGFTEVRTCEIGSH--------------------------
+>UniRef100_A0A831XJT3	127	0.308	7.352E-27	190	366	384	18	191	192
+----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------DLSGFKHLLDLGGGPGTYAIACLNAHPQIRATLFDHANVVDIAREQVEAAGVSDRVTFVVGDALKDDLGDGYDVILMSNLIHAFDENENRRVVGKCFDALASGGRLIIKDFLVENDRSGPP----FALLFALHMFvHTQGGDTYTFAQVEEWTSAAGFSEGRALPLTPHTHVWLADKP-----------------
+>UniRef100_A0A838MY84	126	0.295	1.811E-26	196	364	384	4	169	170
+----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------KILDIAAGHGIFGITLARHNPQAEVFAVDWPNVLQIARENAETAGVAARYHLLPGSAFEVEFGDGYDLVLLTNFFHHFDQPTCESLMRKVHAALKDGGRAVTLEFVPDEDRVSPPAAATFAMVM---LASTPSGDAYTFSEYEQMFRNAGFTHSVGYPAPPGHIIVSQK-------------------
+>UniRef100_A0A1V5YR16	125	0.325	3.301E-26	197	364	384	0	165	166
+-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------MLDLAGGPGTYGITFQQQHPELHVTLFDRPEVVTIAREQVSEAGLSSRFSFIGGDCICDDLGNGYDLVFLSNIIHSFGTEENAGLMRRAYDALVPGGTLIIKDFILDNDRQGPAYGLMFAL---QMLVHTTAGNTYSFEEIQRWTDAAGFRQGESISlTPQTRLWIARK-------------------
+>UniRef100_A0A9D6DY32	123	0.266	1.479E-25	137	367	384	0	224	225
+-----------------------------------------------------------------------------------------------------------------------------------------MSEVVRTGRPVAAVNREKDG--GRFFSEFVEGLFPVSYPAAQALSEVLEISQSK--EPVHVLDLGAGSGVWGIAMAQKSSHVRVTAIDFADVLPVTRRVAQRFGLEEQFHYVAGDVLEADFGGGHNIAVLGHILHSEGEKRSRTLLRKTFDALAPDGTIAIADFIVNEERTGPPP----ALIFAVNMLVnTEHGDTFSFGEIKTWLDQAGFENARpVEANGASPLILATKPGR----------------
+>UniRef100_A0A924W8C4	122	0.328	2.694E-25	195	346	384	16	164	184
+---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------GRVLDVAAGHGLFGIVIAQRNPGARMTALDWPKVLEVAKLHADRMGVGERLTTIAGDAFEVDLQGPYDLILLTNLLHHFDAQQCTTLLKRLRAALRPGGRLVTLEFIPNEDRVSPAMAATFPLVM---LATTARGDAYTFSELEHMLRAAGF-------------------------------------
+>UniRef100_A0A950V3E9	121	0.327	6.615E-25	194	355	384	3	161	173
+--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------PMKVLDVAGGHGLFGIAFAKQNPNAEVTLLDWAAVAAVGTENARKAGVEKRFKVLAGSAFDVDYGTGYDVILLTNFLHHFDPATIDKLLKKVHAALKPAGRVVTLEFIPNEDRVTPPIAAAFPMLM---LCGTPSGDAYTVSEFQKMFRAAGFSNNIFIPLP----------------------------
+>UniRef100_A0A2W2EUZ9	120	0.308	1.204E-24	197	365	384	5	173	175
+-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------VLDVACGHGLYGLTLAQRNPRANVWALDWPNVLTQVETHADQLGVRDRLHQVPGDMFQVPLGGPYDAILVTNVLHHFSEQRAGELLARLAPALKPDGKIVLVGFTLGDE---NPADDPAPHLFSILMLaWTYEGEVHSIAAYDRMLTAAGFTTGRRHDVPGlaFRVLVADKA------------------
+>UniRef100_A0A2V5V6K0	119	0.244	2.952E-24	194	364	384	8	176	178
+--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------PVRVLDVAAGSGIWGIALAQQSPLVRVTAQDWPEMIPTTKRITQKFDVADRFSYVEGDVLEANFGTDYDIATLGHILHTEGKDRSRKLLKKVFGALKPGGTVAIGEWLVNDERTEPLPSLIFAV---NMLVHSERGDTFSFNEIKRWLEETGFKKVRKLEAPgPSPLILATK-------------------
+>UniRef100_UPI00215D97BC	119	0.288	3.979E-24	130	365	384	0	224	226
+----------------------------------------------------------------------------------------------------------------------------------MVKGWLRLPEAISGGHP------EPQGPDPEFFTHLTRGLLAVNWPEATELAGQL-----KSRGYQRLLDVGAGSCLWSAALLKELPSARAWAIDFPQVLDgSAQEIVRHLHLEDRFVFLPGNYWKISWGEGYDLIILGHICHSLGPEENVTLFKKARQSLARDGELVIIEFIPDEGRCSPLFPLIFAL---NMLLHTDSGDTYTASEYQDFLARAGLKISERlyLDQGHGSQVIVARP------------------
+>UniRef100_A0A2V6IMK1	117	0.269	9.748E-24	196	364	384	15	181	183
+----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------RVLDLASGSGIWGIALAQKSPRVQVTAVDWVGMIPTTKRITQKFGVGDRFKFIGGDLLKADFGDGYDVATLGHILHSEGRDRSRKLLKKTASALKSGGIIAIGEWLVNDERTEPLN----GLMFAVNMLVnTESGDTFSFNEIKRWLDEAGFKNARTLEAPgPSPLVLATK-------------------
+>UniRef100_A0A0F5VJF9	117	0.293	9.748E-24	138	363	384	0	218	219
+------------------------------------------------------------------------------------------------------------------------------------------PGVVRMGGPRAGG--ETEVADNPHGEGIVRAIPAVSVPAADA---GVDALGIADAGEISILDVGGGSGIYSSIWLKANPAARAVQLDWEPINVIARRLVGEQGVGDRFTTLDGDFHTTDFGTGlYDIAVYSHIAHQENAHSNIEVFTRLRKALKPGGALVVADYVVDEDRGAP----AFPLLFALEMlLKSNEGGTWRRSDYRDWLIKAGFEDVSFHAAPPATMVIAR--------------------
+>UniRef100_A0A7Y2F7Z1	117	0.269	1.314E-23	210	365	384	0	151	155
+------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------ALLQKNPELTAVVVDRPEVLRVAEEMATEYGVIDRVELMPGDMFDEPLPSNADIVLLSNVLHDWDVPECQQLIYRCVESLAPAGRVVIHDVFLHDELDGPLP----IALYSAALFTLTQGRAYSQREYREWLEAAGLRTVPAVDTLIHCGIIVGQK------------------
+>UniRef100_A0A9E2XDP0	117	0.270	1.771E-23	158	361	384	0	197	202
+--------------------------------------------------------------------------------------------------------------------------------------------------------------DHPIWVKFARAMGPSRVPVAKIVASEL-----AVPSPRKVLDVAAGHGMFGIAIAQATTGAQITAIDWQAVLSVAQENAEAAGVSGRYHTLAGSAFDSDWGSGFDLVLMTNFLHQLDRDACVTLLRKARKSLVSGGRAVAVEFLPNEDRVSP----RFPAMFAFQMLgSTPQGDAYTAREFEEMGRAAGFGKViaKSLPPTPHSLIL----------------------
+>UniRef100_A0A354C2G1	114	0.267	1.426E-22	197	357	384	0	157	168
+-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------MLDVGGASGTYTIAFLRTVPDMRATLFDMPEVVEMARERLSKAGMLDRVTLVSGDFYQDEFPPGHDLAFVSAIIHQNSPAQNVDLYHKIFRSLDRGGRIVIRDHVMEPDRLHPKDGAIFAV---NMLLGTSGGGTYTYEEIKADLSQAGFTAVRLIKRGEH--------------------------
+>UniRef100_A0A2M7Z0A8	113	0.294	2.585E-22	190	361	384	11	180	194
+----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------SLKAVRSLLDLGCGPGTYALAFLAQNPTLHATVMDRPAALDVARMLAEQSSSGTRLTYQAGDFLTEHISGTYDVVWYSNVLHIYSPADNLKIFKKVKRILNPGGRLLIQDTFL---HDPTELQPLEANLFAVSMLLyTERGNTYSVRDVREWLQRAGLTRSRVLHLKEGTGDW----------------------
+>UniRef100_A0A955WEZ4	110	0.248	2.783E-21	201	366	384	0	164	166
+---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------GGGPGTYSALLAQANPELSAEVLDLPGVVAIAREIVGSMGVGDRVTCSPFDYYRDTLAGQYDAALISGVLHREQPAQVQAILANVARVVEPGGVLYISDVMLDDDRVGPV----FAAMFALNMRVLaHDGRCHSVAEQRAWLDEVGCKvtDVTHLPAPIHYTVIRAEKR-----------------
+>UniRef100_A0A931VA74	109	0.323	3.744E-21	198	364	384	0	166	167
+------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------LDIAAGSGVWSIAFAQEFRSATVTALDFPAVLKVARAYAGKFGVGHRFKYLSGDLRRLDFGkQQHDLIILGHICHSEGRANTIRLLRKSYAALRKDGQVLIADFLPNNRRTGPVMPLMFAL---NMLLNTTEGDVFSVAEYQKWLRAAGFKKIELLRsaPAPSPLILAAK-------------------
+>UniRef100_A0A2V6FEX5	108	0.250	9.108E-21	207	364	384	1	156	158
+---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------WGIVLAQKSPRVQVTAVDWAGMIPTTKRITQKFGVGDRFKFIEGDLLEADFGESYDIATLGHILHSEGEDRSRKLLKKTANALKSGGTIAIGEWLVNDERTEPLN----GLMFAVNMLVnTERGDTFSFNEIKRWLEEAGFKNVRTLEAPgPSPLVLATK-------------------
+>UniRef100_A0A7Y5FDI1	108	0.304	1.647E-20	195	354	384	21	177	189
+---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------KNMLDVGGGSAAFSMEIVKKNPSISAVVLDLPYVIPLTKKYVSGAGLSDKFNFIEGDYLTTELKDNYDLILLSAIVHINNYDQNKMLVKKCADVLNKSGMIIINDFVMNEDRT----QPRQSALFALNMLVgTENGDTYTEKEMREWFESAGLSKIERKNT-----------------------------
+>UniRef100_A0A938CHE3	107	0.308	2.976E-20	211	368	384	0	154	158
+-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------MLKRLPDATALIFDLPTVVAIARECAELAGVSDRVETRAGSYWDDELGEGFDLAIVSNILHSSGPEGCVTILQKTLRALAPGGRAVVHDFILGEDGTTPP----WAALFSLNMLNAGnEGRSYTRGELEEFAAEAGFEATEYRQCTEDTGVVVARKPVP---------------
+>UniRef100_A0A2V8H5I2	104	0.272	2.353E-19	215	364	384	0	149	151
+-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------NPQTRVTVVDLPGVVEtVTRRFVAREGLSERFAFWPGDLQQIDFGESaFDVIVLGHICHGEGAERTQELLHRAFRALRPGGQILIAEFVPDDDRNGP----LMPLLFALHMLVlTERGDTFTLGEFTEWLTTAGFVDIGTIAAPaPSPLIVATK-------------------
+>UniRef100_A0A3C1Z2Q6	104	0.270	2.353E-19	195	353	384	11	166	180
+---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------RTMLDLGGGAGTNAIAFCRVYPGLSATVFDLATTLPLTTRTVKDAGLEDRIALKSGDFNRDALGGPYDVVLMSDILHYQNLATNAALVKKIHGHLSPGGRLVIKDRFLDPSGTSPAWTAAFAVHILVN---TEQGACYRTAEAMQWMHDGGYVSVEEIE------------------------------
+>UniRef100_A0A2S9FNB9	98	0.375	1.447E-17	195	306	384	0	111	126
+---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------RSLLDIGGGHGWYSAQLCRRYPRLTATVFDLPGSAAIGREIIAGAGMADRVVHRDGDATTDDLGTGYDAVLCFNLLHHMTAEQTVHLFGRIHTALAPGGTLAVMDAFAEPGR-----------------------------------------------------------------------------
+>UniRef100_A0A7V9GF58	97	0.333	3.487E-17	197	365	384	2	169	171
+-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------VLDLGAGACPWSRALAQADAEIRVTAVELPGVAAITRRSIADHGLGDRFRVVEGDLFRAEVGTGFDLVLIAGVCRLFGPTANALLARRAAALVRPGGEVAIVDALPDADRSDGRSNALYALGLA---LRTSTGGVHHLSAYASWLYDAGLAGIElvELDRPELSLVRATRP------------------
+>UniRef100_A0A7V9QC46	96	0.280	8.394E-17	192	361	384	2	161	168
+------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------PHAREMLDLGGGPGTFARAFARR--GLHATLLDRPEVIELVAERYDLRSIPE-LSLQSGDFLDDSPAGEFDIILLANITHIYDPATNTRLIGSLVPQLRPGGVLAILDFVR--------GLSEFAPLFAITMlLNTEQGGTYALEEYTRWLEEAGLGEVRCTSIDLDRQLV----------------------
+>UniRef100_A0A7W0Q6F8	96	0.327	8.394E-17	194	366	384	39	209	639
+--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------GGSLLDIGGGAGTYTAALLDAHPAATATLVDEAAVIALARQTLARFG--DRVTYVEGDAREVALGDRHAAVLLANVLHLHPPAVCAELCAIAAAAVMPGGQVIVKDLRVDVDHAGPLE----GLMFALNMAVyTDGGDVHDTVQLRNWLATAGLVDIiehRQEAAPDGIVVIGRRPR-----------------
+>UniRef100_UPI00227925D2	93	0.336	6.492E-16	42	151	384	8	113	129
+------------------------------------------KVLHSAVALGVFGALADGPADADQVAAATGLHERMAPDFLDALAGLGLLERTGD----RYGNSPLAEAYLVPGTATYLGGFVELTNETLYGTWGRLTEALTTGPRSTSTP----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
+>UniRef100_A0A955TCB0	93	0.250	6.492E-16	215	353	384	0	135	145
+-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------HPGLSATVFDLPQTLRVTKDHVDRAGLGDRIHLQAGNFHVDAFQGSYDLALMSDILHYQDGSTNAALVKKVFACLTEGGRLIIKDRFLDPAKTSPAWTTAFAVHILVN---TECGECFTIQDSRQWMEQAGFRIVEELE------------------------------
+>UniRef100_A0A7X0B2G6	91	0.270	2.788E-15	172	299	384	59	195	245
+----------------------------------------------------------------------------------------------------------------------------------------------------------------------------WSSARGKIRAREIILDRIDWRGDERVIDIGCGRGLFTIAAARRVPRGHVIGIDIWQTEDLsgngpgaVIANAAREGVSGRVECRSADMRNIPFPdDSFDVVISSAAIHNLyDPADRARAIREIARVLAPDGRLVISD------------------------------------------------------------------------------------
+>UniRef100_A0A6I4PU19	90	0.333	8.927E-15	47	154	384	52	156	211
+-----------------------------------------------GVRAGVFARLADGPATRAELGEGLGLKPPALHDFLDALVALGLLER---RDGGRYANTAESDFYLVPGKRYYMGHYLTFVDNFMRPTWDGLAEMLRTGKPPAPQARRP-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
+>UniRef100_A0A2V6KNM4	89	0.236	1.194E-14	223	365	384	1	141	142
+-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------VDWAGMIPTTKRITRKFGVADRFQFIEGDLLEANFGNGYNIATLGHILHSEGEERSRQLLKKTFRALKSGGTIAIAEWLVNDERTEPLPSLMFAV---QMLVNTEKGDTFSFNEIKGWLEEARFKRVRKLEAPgPSPLILATKP------------------
+>UniRef100_UPI002021C978	88	0.282	3.813E-14	193	305	384	43	155	242
+-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------PPTRVLDLGGGPGVVAARMAERWPGTRVTLIDIDPVLL----TLARDGVPPSVTVLDADLGEPGWTEaagtGYDLVTAVMTVHYLRPESIRALYRHCRQAMSPGGLLVVADLIPDDN------------------------------------------------------------------------------
+>UniRef100_A0A933SQF1	87	0.295	9.097E-14	226	357	384	1	129	141
+----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------PPVLEAARQYIQRYGLEDRVGVRPGDFLTDDMGSGYDLVLLANVVHMYGAENSSALIKKSAAALASGGRIIIHGFCVDGDGTGPMEDVLFNLNIG---MLTDAGRAHPVEEITGWLERAGISRVRHFRIEGH--------------------------
+>UniRef100_A0A560H420	87	0.262	9.097E-14	172	299	384	59	195	245
+----------------------------------------------------------------------------------------------------------------------------------------------------------------------------WSSARGKIREREIILDRIDWRGDERVIDIGCGRGLFTVAAARRVPRGHVVGIDIWQVEDLsgngpgaVIANAAREGVSGRVECRSADMREIPFPdNSFDVALSSAAIHNLyEAADRARAIREIARVLAPDGRLVISD------------------------------------------------------------------------------------
+>UniRef100_A0A1Z4QIT9	86	0.264	1.215E-13	194	351	384	42	209	225
+--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------PLKVLDLGAGTGLYSGMVQAVFPNAEFTLLDLaPEMLEKAKSRFSKMGKSPKI--LIGDYVETDLGGSYDLVISALSIHHLSDVDKKRLYQQVYHVLSPGGMFVNADQVLgkTPDLEKLYRQNWLDSVIAKGISQEDLKAAQKRMEYDrmtpldiqlAWLDAAGFQDVDC--------------------------------
+>UniRef100_A0A163GAS4	86	0.238	1.623E-13	193	299	384	49	155	223
+-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------PGQRILDLGCGTGTLTVQLKQSYPESEVTGLDIDPdVLRMAEAKAAQRHLS--IKFDQGNSYELPYPDhSFDRVVTSLMFHHLTTTNKLQTLKEIFRVLKPEGELHIAD------------------------------------------------------------------------------------
+>UniRef100_UPI0021A33580	85	0.240	2.168E-13	194	299	384	50	155	223
+--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------GQRILDLGCGTGTLTVQLKQSYPESKVTGLDIDPdVLRIAEAKAAQRHLD--IKFVQGNSYELPYPDhSFDRVVTSLMFHHLTTTNKLQTLKEIFRVLKPEGELHIAD------------------------------------------------------------------------------------
+>UniRef100_A0A1F8NFU5	85	0.286	3.866E-13	188	299	384	38	150	193
+--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------LLPFEGTARIrgLDLGAGTGVLAEGILRRYPLAEVTVFDLSdNMLAAARERLRK--FENRITFLKGDFSKDEFGIGYDLILSGLSIHHLTNPHKQQLFRRIYLALNPGGVFLNRD------------------------------------------------------------------------------------
+>UniRef100_UPI0015517974	85	0.272	3.866E-13	192	299	384	45	152	218
+------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------DSGQRVLDLGCGTGTLTLLLKQVYPKAEVTGLDIDPnVLRIAEKKAVDMGMD--IVFNQGMSFELPYPDhSFDRVVTSLMFHHLTLENKLRTLKEIFRVLKPQGELHIAD------------------------------------------------------------------------------------
+>UniRef100_A0A4R4UIL7	84	0.298	5.161E-13	190	300	384	76	189	236
+----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------RLKGGERLLDLGCGRGAVLTLAARRLDEGHVTGLDqRSKGAPRARANAEREGVADRVSLVVGDLRDLPFeDGAFDVVVTDQAIHtITRPAGREQAVREALRVLRPGGLMLIADP-----------------------------------------------------------------------------------
+>UniRef100_UPI001942DF3D	84	0.285	5.161E-13	190	304	384	40	154	244
+----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------HGGAPARCLDLGGGPGVLAERMAARWPSCRVAMVDLDPVLL----TLARAGVPDTVAVIDADLGSGSWahcaGRGHDLITSVMTVHYLPPSGIRRLYRECRDALAPGGLLVVADLMPDD-------------------------------------------------------------------------------
+>UniRef100_UPI0018F5EC24	84	0.275	5.161E-13	193	304	384	47	158	264
+-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------PPRRVLDLGGGPGVLAERMARRWPSAAVSLLDLDPVLLALARSA----LPGRVSVLDGDLASAGWtalaGGGHDLITVVMTLHYLPAERARAVYAHARRCLAPGGVLIVADLMPDD-------------------------------------------------------------------------------
+>UniRef100_A0A6L4ZQ25	83	0.237	9.196E-13	213	364	384	0	151	152
+---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------KQYPEANVIALDFPGVLSVTRQYVQQLDAEAQYDYLSGDLNTLSFGKNcYDLVILGHICHSEGERRARKLIKKSAQALRDGGTLLIAEVLPNEDLSSP----LLAMLFSLNMLVfTSEGDVFPASQYQKWMAEVGLKEFEVLDkiPSPFPLLLATK-------------------
+>UniRef100_A0A941ADV1	83	0.338	9.196E-13	24	153	384	451	574	587
+------------------------PVRNVDDLMTVGHGYQRSMVLLAALRLGLFRALAGGAAVAGVLARRVGADAKKLSILLDALAALGLVEK----RGRRYRNAKPARDLLLPG-PHSKESILLHHLDG-WGEWGRLPSTIRAGRNPRAGAQG--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
+>UniRef100_A0A388RG35	82	0.292	2.185E-12	20	108	384	18	102	108
+--------------------DPARPVLTPERLLQLGMGFWPAKTLLSAVELGVFTRLADGPLDAPTLTEALGLHPRSALDFLDALVALQVLER----DDGKYRNAPDTA-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
+>UniRef100_A0A938ND12	82	0.369	2.915E-12	247	356	384	2	108	119
+-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------FLAGDLREGRFGEGYDLALVSAICHMLSPADNAALLGALRRALAPGALLVISDFILDENR----ATPSFASLFGINMLVgTGGGDSYAESDYRAWLAAAGFAEVRCLALPG---------------------------
+>UniRef100_A0A4R4NF76	81	0.298	3.888E-12	190	300	384	76	189	236
+----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------RLEGGERLLDLGCGRGAVLTLAAERLPEGHATGLDQHaREAPRASANAEREGVADRVSLVVGDLRDLPFENdAFDVVVSDQAIHAIARRQgREQAVREALRVLRPGGLILIADP-----------------------------------------------------------------------------------
+>UniRef100_A0A7W0ZUZ6	81	0.269	3.888E-12	197	298	384	44	143	272
+-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------ILDVGCGTGEITSRLAGEFPRATIVGVDiIEPHLALARTRYPE--LADRVTFREADAFELPFaAGSFDLVVCRHMLQAIPHPE--RVLAEMVRVAKPGGVLHII-------------------------------------------------------------------------------------
+>UniRef100_A0A533ZC60	79	0.313	2.185E-11	252	353	384	0	98	108
+------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------FHRDDLGGPYDAVLMSDILHYQDPDANAALVRKVHRALAPSGRLVIKDRFLDDGRTSPAWTAVFAVHILVN---TDKGRCYTMAEAVQWLKDAGFTSVDELD------------------------------
+>UniRef100_A0A968BQZ9	79	0.261	2.185E-11	195	299	384	20	124	172
+---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------GRIIDVGCGSGATNLVLAERFPRAEIVGIDLSdPLLRLAREATANTSFGDRVAFERADVQQIPYdDDSFDVAISTNMVHIV--EHPLRMLGEIERILAPDGHLFIVD------------------------------------------------------------------------------------
+>UniRef100_A0A923PGD4	78	0.308	3.880E-11	182	300	384	44	160	217
+--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------RALQQLPISPAANISILEVGCGTGHNLVALAKYFPNAYVTGIDLSEdMLAIAAKKVARFG--GRVTLEEGAFGVVPLEEKYDLIVFSYCLTMVNP-DWDKLLEVARKSLPPTGMLTVVDF-----------------------------------------------------------------------------------
+>UniRef100_A0A4R7V7R0	78	0.282	3.880E-11	198	305	384	50	165	260
+------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------LDLACGPGAISDRLLRRLPKARSVAVDVDPVL-LAIGQAALGDVAGRLRWVRADLRDQDWtdalgadgaDGTFDAVLSSTALHWLDPATLVATYRRAYRLLRPGGVLLNADYLPHPE------------------------------------------------------------------------------
+>UniRef100_A0A401FX31	78	0.261	5.170E-11	195	299	384	47	151	201
+---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------GKILDVGCGFGAVAIELAKTFPDAEITGIDLgEPLLRLGESEARKAGVADRIHLLKGDVRKTEFPtDAYDVVTNTFMLHIV--ENPIAMLNEIERVTKPEGKIMITD------------------------------------------------------------------------------------
+>UniRef100_A0A957TIY1	78	0.280	5.170E-11	193	304	384	42	153	205
+-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------PPGRALDLGCGFGRACRYLAQH--GWQCDGVDFvEQAIVTARQRAADAGVADRITFHVGSVGELDFlQPPYDLAIDVGCFHAQPEAVCVQYAKHVARLLKPGGLFLLFAHLRDE-------------------------------------------------------------------------------
+>UniRef100_UPI00030C1C4B	77	0.264	9.176E-11	192	301	384	98	214	269
+------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------DGKGKLLDIGCGSGAMSIKAAKKFPDVVVTGMDywgagWDYSKTLCESNAKIEGVAERITFQKGDAAKLDFsDGTFDAAISNFVFHEvMSQPDKFALVREALRVVKPGGYFVFEDIF----------------------------------------------------------------------------------
+>UniRef100_A0A532DC31	77	0.274	1.222E-10	241	352	384	0	109	128
+-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------MGHRLSYLPLDFIKHAIPGRYDVVWLSNVLHIYSPAENRKLLRNIARVLAPGGRLLIQEALLHDRHD---LAPLGANLFAVTMlLFTDRGNTYSVREATDWLMCSGFQRVSLL-------------------------------
+>UniRef100_A0A2W2GWE1	77	0.294	1.222E-10	196	306	384	79	186	243
+----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------RALDVGCSEGAFTRRLARAYPEAECVGVDVSAQA-VARAAAKAAGTA---RFVALDFLNDDPGGIFDLVICAEVLYYVGRGERLRLiFERFRTFMAPGGVLVLVHEWPEARR-----------------------------------------------------------------------------
+>UniRef100_A0A1J5AV34	77	0.300	1.222E-10	194	303	384	34	144	256
+--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------GGPLLELGCGTGRLAIPLAQA--GYQVTGVDLSPaMVTIARDKAARAGVTQRVTLIQGDYTDTPLGGPYRLafVVMNTFLHLLSQADQLAALRHWAAHLTAGGLLLIDVMYPD--------------------------------------------------------------------------------
+>UniRef100_A0A0F9AVU4	76	0.250	1.628E-10	240	365	384	0	122	133
+------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------GKGVKLNYKGGDFTCDSIGNSYDLILVSQIYHAYSEAASLELTKKCHDALVPGGRIAVQEFAISKDRTSPPG----GALFSVNMLVgTEGGNTYHTSHISDWLKEAGFKQVKVKTLSETVLVTARKP------------------
+>UniRef100_X1UPS3	76	0.291	2.168E-10	232	365	384	0	132	138
+----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------AEKRLTEAGLSDRVTLVAGDFYEDDLPTGPDFTFLGAIAHQNSREQNRALFVKVHAALAEDGLIVIRDVVMDPSHTSP----QAGALFAINMLVaTPAGGTYTFDEYAEDLTNAGFTDITLVhrDEFMNSLIRAKKK------------------
+>UniRef100_A0A2P9H162	76	0.291	2.886E-10	178	296	384	28	142	265
+----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------RTVAEKLAASLPAGEKFDSILEIGCGTGSLTELLRRRFPRALIYAVDVArPMIDLARERI---GECSRIHWHVADARQFRPGRDFALIISSSALHWMTP--VSETVKRLAGMLEPGGSLV---------------------------------------------------------------------------------------
+>UniRef100_UPI00035C64DE	75	0.293	3.842E-10	198	308	384	49	163	262
+------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------LDLACGPGTISARLLERFPKARCVAVDIDP-LLLAIGQGALSTMDGRLHWVDADITTDSWlqaigDEQFDVVLSATALHWLTPAQLITTYRDISAALRPGGLLLNADRLEFDERSP---------------------------------------------------------------------------
+>UniRef100_A0A960X0C7	74	0.300	9.061E-10	244	360	384	0	114	118
+----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------RVSFTGGNFFTDDLP-QADVLLFGHILHDWDLETKLMLLRKAYAALPPGGAVVVYDSIIDDER----KKNAFGLLMSLNMLIeTPGGFDYTGADCMGWMRQVGFQEccVEHLVGPDSMVI-----------------------
+>UniRef100_A0A5C7FQJ3	74	0.292	9.061E-10	196	300	384	53	155	213
+----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------RILEVGCGTGHNLVSLAERFPAAEITGIDLSqDMLSIARKKLRRFG--GRVSIVHGAFGSDSFREQFDVVLFSYCLTMVNP-GWDTLIEVATASLRDNGVLVAVDF-----------------------------------------------------------------------------------
+>UniRef100_A0A938BIS1	74	0.289	9.061E-10	193	296	384	40	142	255
+-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------PPLNVLDLGCGDGRHSLEMARR--GYTVTGLDLSeELLTRARERADDAGLT--LVFRQGDMREIPYMQAFDLVvnFFTSFGYFATDTENARVLHAIARSLRPGGRFL---------------------------------------------------------------------------------------
+>UniRef100_A0A7W7G205	73	0.317	1.604E-09	249	353	384	133	235	254
+---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------PGNFLTDtHLPDGHDVVLFSMILHDWDQATNRELLAKAYEALLPGGLVVVSELLLNAERTGPAP----AALMGLNMLVeTEGGRNYSDAEYGQRLTGAGFTEVRTVP------------------------------
+>UniRef100_UPI001CC7CCF7	73	0.245	1.604E-09	197	299	384	203	308	605
+-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------ILDIGCSVGVSTRFLADKFPEAKATGLDLSPyFLSVAQYKERERALRKNpIKWFHANGENTGLPsKSFDLVSLAFVIHECPRRAIIGLVEEAFRLLRPGGIIVLTD------------------------------------------------------------------------------------
+>UniRef100_A0A2V6APU7	73	0.281	2.135E-09	258	365	384	0	105	106
+------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------GEGYDIAILGHILHSEGEDRSRKLLKKTANALKPGGTIAIGEWLVNDERTEPLN----GLMFAVNMLVnTERGDTFSFNEIKRWLEEAGFKNARTLEAPgPSPLVLATKP------------------
+>UniRef100_A0A7Y5VEE5	72	0.301	2.840E-09	196	300	384	52	156	212
+----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------RILEVGCGTGHNLRNLALHFPNARITGLDASaDMLAIARSRTRQFPERIQLVEKPYALGEEGFREQYDLVLFSYSLTMINP-QWEELLQQACKDLKPGGFIAVVDF-----------------------------------------------------------------------------------
+>UniRef100_A0A7Y4TBV2	72	0.333	3.777E-09	190	300	384	40	151	218
+----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------DPRPSERILDVGCGTGTLAVLLKRRMPSCEIVGLDPDPqILELAREKARSAGVA--IDFRQGFARDANtlGGTGYDKVVSSLVFHQTPMAEKSVGLRSMAAAAKATGELHVADY-----------------------------------------------------------------------------------
+>UniRef100_UPI0021F385A6	72	0.321	5.024E-09	26	109	384	2	81	90
+--------------------------PGVFDVIDMMTGYQPAAALTAAARLGVFDVLADAPLPADAVAARLGTEPRATRALLDALTGLGLL----GTDDGGYTAAPVARR----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
+>UniRef100_A0A3C0ICS3	72	0.299	5.024E-09	196	300	384	53	156	215
+----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------SILDVGCGTGVNSAKMARLFPNAHITALDVSEdMLAQAAKRLKPFG--DKVSLVHQPYEKNPAhSERYDLIHFSYALTMINP-QWQDLLEQAQADLKPGGVIVVADF-----------------------------------------------------------------------------------
+>UniRef100_A0A2V5J6W1	71	0.245	6.681E-09	247	362	384	1	114	116
+-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------FIEGDLLKADFGEGHDIATLGHILHSEGEERSRKLLKKTANAVKSGGTIAIGEWLVNDERTEPLN----GLMFAVNMLVnTENGDTFSFNQIKRWLAEAGFKNARTLEAPgPSPLVLA---------------------
+>UniRef100_A0A2T5C4D6	70	0.271	1.181E-08	245	351	384	17	120	136
+-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------IKTYTGDYTKDDLPEGFDLVFLSAIIHSNPLETNQQLIKKCFKALNNKGQIIIQDWIMNDERTEPTTGAIFAI---NMLVGTDGGDCFTEQEVSDMLTTAGFKQIQR--------------------------------
+>UniRef100_UPI001F4F924D	70	0.305	1.181E-08	70	154	384	4	85	140
+----------------------------------------------------------------------LGLKPPALHDFLDALVALGLLER---RDGGRYANTAESDFYLVPGKRYYMGHYLTFVDNFMRPTWDGLAEMLRTGKPPAPQARRP-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
+>UniRef100_A0A7C6B0U6	70	0.312	1.570E-08	31	142	384	8	114	116
+-------------------------------VLELTDGFRVAAVVGAAAELGVFEAIPEQGITADELASRLACSIRGIQVLCDALAGLSLLEK----RDGTYFLPPKLRPVLRESGAETVIPMLQHRMNMM-RGWANLPWTVK-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
+>UniRef100_A0A7L5YJU2	70	0.288	1.570E-08	244	366	384	1	121	123
+----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------RVTVQEGDFQREGFGRGYHVALVFGVLNGEPPEGRPALIRKVYDCLEPGGKVVLRDFALDDDRAGQPE----AAIFAPDAAGDGVRGLDTRGDWTNWLTAAGFAPPQTlaLPDGVGTLTIAHKPT-----------------
+>UniRef100_A0A0F9D6E6	70	0.288	1.570E-08	205	364	384	3	151	155
+-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------GTYSKELLKK--EFEVTLLDTQGLTEMAKDHLKDTS----VKILAGDFNERLPNEKFDVILLSNITHIYKPEKNEALLSRVEKHLSPGGLIAIVDLIRSKSKG--------AAMFGVNMLvHTAGGGTWTLPQYEKWLHHAGLRLISVKDLKDADqkLLLAER-------------------
+>UniRef100_A0A928TDB3	70	0.287	1.570E-08	194	300	384	45	143	201
+--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------PHRILEVGCGTGHNLQLLRRQFPDADITGIDLSaDMLRVAREKVPGVSLIQRAY--------DAPAGSFDLIVCSYALSMFNP-GWDRAIATAAQDLVPGGIIAVVDF-----------------------------------------------------------------------------------
+>UniRef100_A0A535YYI5	70	0.297	2.088E-08	257	364	384	2	109	113
+-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------LGGPYDLVVMSHVLHHFDEGRCVELLRRAAAATRDDGRIVIQDFVATGDEHG---RDVAAGLFSVIMLVwTRQGEAHPLARLERMLAAAGYGPPEVHPLPqlPTTVLVAGR-------------------
+>UniRef100_A0A552ZP34	70	0.283	2.088E-08	174	297	384	19	148	218
+------------------------------------------------------------------------------------------------------------------------------------------------------------------------------PWVIDEPQPAVIALAEAGHISGRVLDVGCGTGEHTIYLTRA--GYDVLGVDgAPTAVDIARRNAAQRGVAAR--FAVGDAFELDAfeldaieggAQGYDTVLDSALFHVFDDADRVRYVRSLGRVTRPGGVVLV--------------------------------------------------------------------------------------
+>UniRef100_UPI00068E7623	70	0.274	2.088E-08	196	299	384	89	201	246
+----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------KVLDVGCGRGLLTILAARKVPLGDVTGVDIwsqeelsENSKEAAVENARLEQVSERIQFEDGDVRALGFrSHSFDKIVSSLCLHaIASRNDRNQAIANLIKLLKPGGEIAILD------------------------------------------------------------------------------------
+>UniRef100_A0A518C5C2	69	0.213	2.775E-08	188	297	384	115	250	293
+--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------GRSKDESVRILDMGTGSGIIAVTIAKQAPQANVLATDVSEkAIVVAKQNAEKHGVSERVEFAAGDLFQAvPSGSSFDVIVSNppyiaqserplmdaHVIEHEPhgalfaDEEgtsvLRRILEEAASFLKPGGWLLL--------------------------------------------------------------------------------------
+>UniRef100_A0A124DZA2	69	0.323	3.688E-08	197	297	384	42	139	209
+-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------VLDIGCGAGEHTILLARL--GYDVLGMDFaPRAIEQARANAAARGVDAR--FEVGDALRLAGTSTYRTVIDSALFHIFDDADRAAYVRSLHGVCRPGGLVYV--------------------------------------------------------------------------------------
+>UniRef100_UPI00232F94DE	68	0.283	4.901E-08	198	298	384	8	105	188
+------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------LDVGCGDGTLARLLASR--SGRVTGIDLSaEMVESARDQSKE---VENVRFLEADFLEAGgrelPPGHYDLITMVAVAHHLGTE---RALARSAELLAPGGRLAVI-------------------------------------------------------------------------------------
+>UniRef100_UPI000513702D	68	0.317	4.901E-08	195	297	384	40	139	209
+---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------GRVLDIGCGTGEHTILLTRL--GYDVLGVDgAPTAVEQARRNAAAHGVDARFEVR--DALDLGTTPTFDTVVDSALFHVFDADDRARYVRSLRGVTRPGALVAV--------------------------------------------------------------------------------------
+>UniRef100_A0A7C4TB43	68	0.315	6.512E-08	199	271	384	1	73	77
+-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------DLGGSHGLHSIRFCRRYPNLSATVFDLPQALEVARETIAAEEMGDRVAVQGGDFLADDVGTSYDVAFLFNILH----------------------------------------------------------------------------------------------------------------
+>UniRef100_UPI001CEC1545	68	0.273	8.652E-08	198	298	384	27	124	207
+------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------LDVGCGDGTLARLLAAR--AWRVTGIDLSaEMIESAREQSEE---VENARFMEADFFEASggelPLGHYDLITMVAVAHHLGTE---RALARSAELLAPGGRLVVI-------------------------------------------------------------------------------------
+>UniRef100_UPI000C7EEDCD	68	0.310	8.652E-08	196	297	384	41	139	209
+----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------KVLDVGCGAGEHTIMLTRL--GYDVLGIDFaPHAVAQARENAAAKGVDAR--FEVADALRLGTEPGYQTVVDSALFHIFDDADRARYVRSLHTACRPGGVVHV--------------------------------------------------------------------------------------
+>UniRef100_UPI001FDABEAA	68	0.321	8.652E-08	191	295	384	76	184	224
+-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------PADARRVVDLGCGTGVLAVTAARTLPEASVLALDVSRAAVLsATATAAANGVGDRVEVRRGHLLAGVPDADVDLVLCNPPFHRGNSRDSAvafEMLADAARALRPGGEL----------------------------------------------------------------------------------------
+>UniRef100_A0A7W1S605	68	0.279	8.652E-08	197	299	384	114	224	250
+-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------VLDVGCGSGVLLFACLKESPTAKGTGIDIydpysfGGTAGVFWKNADVEGLKERVALQQVDARTMPFaGQRFDVIVSSLAMHHVgNAAEQEKATREMVRTLKPSGKIAICD------------------------------------------------------------------------------------
+>UniRef100_A9HJ62	68	0.323	8.652E-08	194	297	384	47	148	474
+--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------PARILELGCGTGFLSAHLRRLFPDAILTVTDLaPEMVERARARLTPLGGDVRYAVVDAE-DPASVGTGFDLICSSLSMQWFTDPAA--TLDRLAARLAPGGMMAL--------------------------------------------------------------------------------------
+>UniRef100_UPI000B2ED3AD	67	0.317	1.149E-07	195	297	384	40	138	208
+---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------GTVLDVGCGAGEHTILLTRL--GYDVLGVDYaPSAVEQARRNAEATGVDAR--FDVADAMDLG-EAGYDTIVDSALFHIFDETDRPRYVRSLHAACRPGGLVHV--------------------------------------------------------------------------------------
+>UniRef100_UPI001E2F3222	67	0.336	1.527E-07	195	297	384	40	139	209
+---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------GKVLDVGCGTGEHTMLLTRL--GYDVLGIDFSPhAVAQATDNAARRGIDAR--FAVADAMQLGNGPRYDTILDSALFHIFDDADRPRYVASLHAACAPGGTVHV--------------------------------------------------------------------------------------
+>UniRef100_UPI0021B59A1B	67	0.305	1.527E-07	195	297	384	40	143	213
+---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------GRVLDVGCGAGEHTILLTRL--GYDVLGIDFaPHAIEQARENATSKGVDAR--FDVADALALGSSElaepGYETIVDSALFHIFDDADRPRYVRSLHAACRPGGLVHV--------------------------------------------------------------------------------------
+>UniRef100_UPI00083A0E7F	66	0.307	2.028E-07	190	305	384	40	156	220
+----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------DPQPGERILDVGCGTGSLAILLKSREPRCEVVGLDPDaEALVIARSKVIRLGLEIGFAQGFAREARDVCGTGFDKVVSSLLFHQVLPVEKRAGIKAMAAAARAAGEIHIADYAEQPD------------------------------------------------------------------------------
+>UniRef100_A0A951AB46	66	0.283	2.028E-07	174	297	384	97	242	283
+------------------------------------------------------------------------------------------------------------------------------------------------------------------------------RPETEELVELLKAETGKWKPG-SILDVGTGSGVIALSLAKEFPEAKVFAVDVSEdSLVLARANGARLGLNERVQFQQGDLLE-GLGERFDLVvanlpyismsdrhlLSREVLHdpevslfagDHGDELIRKLIEQTPARLEPDGLLAL--------------------------------------------------------------------------------------
+>UniRef100_A0A9C9N7Y1	66	0.292	2.694E-07	195	303	384	35	145	256
+---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------GRILDVACGTGMHAIELARR--GYEVTGSDLSaGMIERARVNAAQAGVKARFEAVSfGELAAALDGATFDALLClgNSLPHVLTNADLAAALFDFAACLRPGGLLLIQNRNFD--------------------------------------------------------------------------------
+>UniRef100_A0A957GH47	66	0.252	3.577E-07	258	365	384	0	107	111
+------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------GAGYDLALVFGVLNGEPPEGRPALIHKVFAALNPGGQIVLRDAVLDSDRAGPSEAALFAL---QMLLATESGGLDTRADWAKWLGKAGFLPPKEIELPgpvGSTLTIARKP------------------
+>UniRef100_A0A7V6DNW2	66	0.269	3.577E-07	193	301	384	47	161	266
+-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------GPAKVLDVGCGDGYATLNVARKLPEFTFAGIDYSaNMIRLAKERLAGLPsLTRRLTFKVGDVLDLGAACGetiFDAVISDRCLiNLADKADQEHAIKEIARHVAPGGYYLAVENF----------------------------------------------------------------------------------
+>UniRef100_A0A651H3F6	66	0.244	3.577E-07	193	297	384	112	242	284
+-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------PPVRILDLGTGGGALALALARRFPEAEVTGLDTSaEALDLAEENAVRNGLADRVRWIRSDWFAgLGQTAGFNLVVANppylteeewataepEVKDHDPRvalvaaddgcAELLRILQEAPARLAPGGRLYL--------------------------------------------------------------------------------------
+>UniRef100_A0A510TTZ0	65	0.285	6.308E-07	195	296	384	39	139	252
+---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------GTLLDLGCGSGDFAVQMAQA--GWTVTGLDLsPEMLTLAEARAEQAGVD--VTWVQGDMRRLTGLGTFDAVTSFDdsLCYLPDLTAVQETLLAAAGVLVPGGYFF---------------------------------------------------------------------------------------
+>UniRef100_A0A937NK55	65	0.330	6.308E-07	196	298	384	36	139	260
+----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------RVLDAACGTGMHAIALAQQ--GYVAVGADLSaGMIQRAQDNAMAAGVDARFEVAGLGKLSARVGTGFDAVLClgNSLPHLLTPADLAAALADFAACLRPGGLLLIQ-------------------------------------------------------------------------------------
+>UniRef100_A0A3C1M550	64	0.244	8.374E-07	265	350	384	1	84	118
+-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------WYSNVLHIYSAEENQALFRRLYSALSPGGRLIIQDVFLHD--REGLYPEEASLFAVSMLLVTPAGNTYSFSETAEWLRAAGFVRIR---------------------------------
+>UniRef100_A0A497AHF1	64	0.285	8.374E-07	196	303	384	36	145	262
+----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------RVLDAACGTGMHAIALAQQ--GYEVTGTDLSaGMIERARVNADAANVDVRFEAAGfGELARRFAPGSFDALLClgNSLPHLLTSADLAAALADFAACLRPGGLLLIQNRNFD--------------------------------------------------------------------------------
+>UniRef100_UPI000489D375	64	0.317	1.112E-06	196	296	384	38	138	246
+----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------RVLDLGCGAGDLLLAVRRYRPRASLTGIDISPlniQAAVARAKADPYGLES-VTFEAADYLRAQF-ETFGVILAESVLHLIADDH-DGLAAKLAADLAPGGLLI---------------------------------------------------------------------------------------
+>UniRef100_A0A931W3L4	64	0.269	1.476E-06	182	267	384	153	241	347
+--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------RSYAFACLDGKPPLKILDLGTGSGAIAVSLAKELPQARVCAVDISaAAIEVARLNARRHGVEERMEFFCGDLFEPvaEEREGFDLIVAN--------------------------------------------------------------------------------------------------------------------
+>UniRef100_UPI000C7DCED2	63	0.320	1.959E-06	196	297	384	41	139	209
+----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------KVLDIGCGTGEHTILLTRL--GYDVVGIDFsSNAIEQARANAADNGVDAR--FQVADAMNLAPDATYQTILDSALFHIFDQADRVRYVHSLHGALRRDGLVHV--------------------------------------------------------------------------------------
+>UniRef100_A0A960RG96	63	0.257	1.959E-06	194	296	384	89	216	261
+--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------PLRIVDVGTGTGCIALALALSFPDAVVTGIDASEaALSLARENGLRLGLHDRIHWRHGDGLTGLSPGTVEVVVSNPPYISSDDyralpahirdyepqmalesgpsglEMLVRLCREASALLSPGGMLY---------------------------------------------------------------------------------------
+>UniRef100_A0A518AML2	63	0.280	2.600E-06	192	264	384	127	201	300
+------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------DAPLRVLDIGTGSGIVAICLAKHLPKSQVTAVDLSPqAIEVAKRNAAKHKVDDRVAFVKGDAYqALPADAKYDFI-----------------------------------------------------------------------------------------------------------------------
+>UniRef100_UPI0021BC03F5	63	0.313	3.450E-06	230	315	384	1	86	106
+--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------ELSRHNAENAGLSDGYQTIAGSAFDVDWGTGYDLVLLPNFLHYFDLPTCAQLLSKIVASLAEDGRIVAVDFVPNEDGVSPPFPEAF--------------------------------------------------------------------
+>UniRef100_UPI002111CB12	63	0.298	3.450E-06	196	296	384	16	116	224
+----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------RILDLGCGAGDLLLALRRDRPRAILTGVDISPlniQAAVTRAKADPNGHGD-LRFEASDYLQARFD-GFDVILAESVLHLI-VGDHDRLAAKLATDLAPGGVII---------------------------------------------------------------------------------------
+>UniRef100_UPI000314BD16	62	0.319	4.578E-06	192	285	384	42	134	207
+------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------PPFGTALDLGCGTGRHAIELARR--GWQVTGVDIvPKAIRLATRRARAAGVDAR--FLKGDITALPaeVGTGYRLILDFGAFHGLTDPERHTMGRQV--------------------------------------------------------------------------------------------------
+>UniRef100_A0A1F8RJ87	62	0.278	4.578E-06	193	303	384	33	145	256
+-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------GAQRVLDAACGTGWHAIALAQR--GFDVAGGDLSaSMVARATANAREAEVTAEFRQAGfGDLASAFGRDSFDAVLClgNSLPHVLDPAHLTRTLEDFAACLRPGGMLIVQNRNFD--------------------------------------------------------------------------------
+>UniRef100_A0A8S9DR76	62	0.245	4.578E-06	194	303	384	39	150	257
+--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------PKKVLDSACGTGMHALALAKL--GFEVVGADFSgEMIAKARSNSVEIGLKARFEVIGfGSLAKNLGAGQFDAVLClgNSLPHLHTQNEVDETLKDFASCLRPGGLLLIQNRNFD--------------------------------------------------------------------------------
+>UniRef100_A0A7Y9JCX3	62	0.308	6.074E-06	192	296	384	51	149	210
+------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------EPPASVLDAGCGTGRIAVRLAER--GFDVVGLDVDaAMLEVARDEAPD------LDWRHADLASFDLGRRFDVVlLAGNIVPLLEPGTLPAVAERLAAHVAPGGRVV---------------------------------------------------------------------------------------
+>UniRef100_A0A357HZI5	62	0.259	6.074E-06	189	267	384	107	187	279
+---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------RIETAPQRILDLGTGSGALALALATQYPEAQVVAVDQStAALELARENASALELNERIQFLAGSWWTPVMSESpFDLIVSN--------------------------------------------------------------------------------------------------------------------
+>UniRef100_A0A2D7ZK05	61	0.250	1.069E-05	196	297	384	116	242	289
+----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------SILDLGVGSGAILLAILAERPNAKGLGVDVSEVaLAVARDNAAHLGLAGRCALLRGDWADGLSDAGFDIVtanppyIASEVIETLEPEvrvheprlaldggadgldAYRRLAPEILRVLKPGGRFAV--------------------------------------------------------------------------------------
+>UniRef100_A0A1G6ZTE5	61	0.339	1.418E-05	192	296	384	46	144	207
+------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------DPPARVLDAGCGTGRIAVRLTEL--GYDVVGVDVD-ASMLAVARAEAPGLD----WREADLATLDLGETFDLVlLAGNIVPLLEPGTLAAVAERLAAHTAPGGRVV---------------------------------------------------------------------------------------
+>UniRef100_A0A944PRW7	60	0.292	2.495E-05	198	298	384	25	122	216
+------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------LDVGCGEGALVRTLARQVEA--VTGVDCStEMVRLARER--SLGV-PNVTFAEADFLDGSHGlltqGGYDFISAVAVIHHV---RFAEAIRAMVRLLAPGGRLVIV-------------------------------------------------------------------------------------
+>UniRef100_UPI00094622D5	60	0.286	2.495E-05	193	303	384	36	148	255
+-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------GGFRVLDSACGTGMHTIELARR--GYAAAGADLSaKMIERARENAVSAGVAARFETAGfGQLQAAFGSEAFDVLLClgNSLPHVLSAAELAAALEDFAACLRPGGLLLVQNRNFD--------------------------------------------------------------------------------
+>UniRef100_A0A7W1SHZ7	59	0.329	3.310E-05	47	123	384	37	113	175
+-----------------------------------------------GDELGYYRALAEhGPTTPPELAERTGTDEHYAREWLNAQAAGSYV--TYDADSGRYTLPPEQAIALTDEtSPAFVVGLF--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
+>UniRef100_A0A8I0C7G1	59	0.250	3.310E-05	196	297	384	116	242	289
+----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------SMLDLGVGSGAIILAILAERPNAKGLGIDVSeEALAVARDNAAHLGLGGRVALLRGDWTAGLSDESFDLVtanppyIATDVIETLEPEvrvheprlaldggpdgldAYRRLAPEILRVLKPGGLFFV--------------------------------------------------------------------------------------
+>UniRef100_A0A3M1L038	59	0.298	3.310E-05	193	267	384	118	194	290
+-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------GARRILDVGTGCGAVAVALAVELPGAEIVATDVSEaVLEVAPANAERHGVSDRIEFRCGSLLEPlAAGERFDLIVSN--------------------------------------------------------------------------------------------------------------------
+>UniRef100_A0A413QXR5	58	0.250	7.717E-05	192	276	384	114	205	286
+------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------DSQAHILDIGTGSGAILLSVLHERPQCRGLGVDISqQALDVARKNGERLGLSDRVSWKISDLLASVPPAAYDWVVSNppyltaDDMHHLQPE-----------------------------------------------------------------------------------------------------------
+>UniRef100_UPI001F5CAA19	58	0.252	7.717E-05	197	297	384	117	242	289
+-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------VLDLGVGSGAILLAILAERPAAKGLGVDVSeEALAVARENAANLGLGGRVALLRGDWTAGLSDDSFDLVVSNppyiatDVIETLEPEvgvheprlaldggldglDAYRILaPEILRVLKPGGTFAV--------------------------------------------------------------------------------------
+>UniRef100_UPI0020C9A714	58	0.244	7.717E-05	196	297	384	116	242	289
+----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------SILDLGVGSGAIILSILAERPAAKGLGVDVSaEALAVARENAANLGMASRLALLRGDWTSGLGDASFDVVVSNppyiatDVLETLEPEvkdheprvaldggpdgldHYRRLAPEILRVLKPGGMFAV--------------------------------------------------------------------------------------
+>UniRef100_A0A6I3C5F3	57	0.275	1.357E-04	194	296	384	51	156	212
+--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------PGRVLDAGCGTGRVARELARR--GVAVVGVDVDAvMLATARAKAPELQWIEH-DLASLDLARDptvnPPSSSFDVaVLAGNVMIFVTPGTEAAVLTRLASHVSPGGYVI---------------------------------------------------------------------------------------
+>UniRef100_A0A1V1PS24	57	0.333	1.357E-04	191	267	384	107	183	279
+-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------PDDAARILDLGVGSGAILLAALRERPNAVGVGVDLSEaALEIAQANAEALGLRERVRLVQGD-WGAGLAEAFDVVVSN--------------------------------------------------------------------------------------------------------------------
+>UniRef100_B4RGB7	57	0.248	1.357E-04	194	297	384	114	242	287
+--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------PWSVLDLGVGSGAILLAILAERPAAKGLGIDASeEALAVARDNAAALGLAGRTALLRGDWTAGLGDSAFDLVVSnppyiaSDVLETLEPEvkdyeprlaleggadglDAYRILaPEIVRVLKPGGRFAV--------------------------------------------------------------------------------------
+>UniRef100_A0A1F9AMF8	57	0.325	1.357E-04	176	251	384	108	187	305
+--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------LVEECLRLLRELSARQGPSAgrlRVLDLGTGCGTIALALAHAFPEAHYLATDLSaEALTLARENAERLGLSRRVTFRQGD------------------------------------------------------------------------------------------------------------------------------------
+>UniRef100_A0A2P2E901	57	0.333	1.357E-04	194	267	384	146	219	315
+--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------PNRILDLGVGSGAILLALLAERPSWTGVGVDQSeEALELARENAALHGLSARLDLRQGD-WHHGIDERFDIVVSN--------------------------------------------------------------------------------------------------------------------
+>UniRef100_UPI001653A8F6	57	0.250	1.798E-04	196	297	384	115	241	291
+----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------TMLDLGVGSGAILLAVLAERPAAKGLGVDVSeEALAVARENAANLGLADRAAFLRGDWTAGLGDESFDLVVSnppyirSAEIETLDPEvrdheprlaldggpdglDAYRLLaPEIMRVLKPGGVFAV--------------------------------------------------------------------------------------
+>UniRef100_A0A2V9FTA7	57	0.313	2.384E-04	265	364	384	1	99	100
+-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------LLTNIFHRFDMATSEKLMRRVHAALKAGGKAITLEFVPNEDRITPPMAAAFSLTM---LAGTDSGDAYTFSQYEKMFRNAGFARTTEHAVPesPQQLLLLEK-------------------
+>UniRef100_UPI0022A7AF9B	57	0.307	2.384E-04	185	285	384	6	105	173
+-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------REQARAQAPWGAALDLGCGTGVHAVELARR--GWQVTGVDIvRKAIRRATKRARAAGVD--VRFLEGDITALPaqVGTGYRLILDFGAFHGLTDPERHALGRQV--------------------------------------------------------------------------------------------------
+>UniRef100_A0A348NQJ2	57	0.198	2.384E-04	194	297	384	112	242	282
+--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------PKMILDLGTGSGALALAFANKYPEASVDAVDVSaEALSLAQENALALGLDNRVTFHEGSWWCPLGLGKqhYDLIVSNppyltneemttaepEVVDHEPHSalvsgadglgDMRLIFKDAASHMKPGGLLAL--------------------------------------------------------------------------------------
+>UniRef100_A0A1F4Q3A2	57	0.308	2.384E-04	192	267	384	113	193	291
+------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------PQPPVILDLCTGTGAVAVALARELPAARIIATDISrRALRMARTNAERHGVADRVTFLRGDLWRAldghAPANGVDLVVSN--------------------------------------------------------------------------------------------------------------------
+>UniRef100_A0A2T4Z4G2	57	0.338	2.384E-04	192	255	384	118	182	303
+------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------DRPLQVADLGCGSGAVAVTLAAERPHWQVIAVDLSPhALALARRNAEIHGVAERIQFRRGDWLQP--------------------------------------------------------------------------------------------------------------------------------
+>UniRef100_UPI0021F9D48E	56	0.267	3.160E-04	199	267	384	117	187	284
+-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------DLGTGSGILAVTLCVLFPGATGVAVDISPaALEVAKSNAQRHGVSGRIEFQHSDFTEQKFdPESFELVVSN--------------------------------------------------------------------------------------------------------------------
+>UniRef100_A0A7X7AW76	56	0.298	4.188E-04	196	297	384	69	168	283
+----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------RVLDLACGPGLYTSRLARLGH--TCVGIDYSPaSIAHAEAEAEREDLACRYRLE--DLRSADYGSGFGLAmLLFGEFNAFRPVDARRILNTAHAALSEGGILLL--------------------------------------------------------------------------------------
+>UniRef100_A0A9E0MQ12	56	0.317	4.188E-04	184	267	384	107	191	289
+----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------LDAVGGDRAAARRGLDLCTGSGVLAITLAHELPGLTMIATDVSaPAAAIARANAQRNRVEDRVEVRVGDRFAPVAGERFDVIVAN--------------------------------------------------------------------------------------------------------------------
+>UniRef100_A0A7X9FKT3	55	0.297	5.550E-04	180	252	384	103	175	286
+------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------LIDMVREFFPE-DGRERFADLGTGSGCLAVTLAVRFPGWSGVAVDASPaALAVARENAARHGVSERIEFVPGDF-----------------------------------------------------------------------------------------------------------------------------------
+>UniRef100_UPI001CD91C63	55	0.322	5.550E-04	176	267	384	104	194	288
+--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------LVDTLLPALREAV-SQKGSARILDLGTGTGAICLALLKECPDATGIGSDISaGALETAAKNASRNGLETRFEIRQSDWFE-KISGSFDIIVSN--------------------------------------------------------------------------------------------------------------------
+>UniRef100_L0NLB7	55	0.315	7.356E-04	193	267	384	116	190	289
+-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------GEARILDLGTGTGAIVLALLKECPQATGVGTDLSEaALQTARENAARLGLAGRFETIRSNWLE-EVTGRFDIVVSN--------------------------------------------------------------------------------------------------------------------
+>UniRef100_A0A2T0LHZ5	55	0.316	7.356E-04	192	267	384	123	201	302
+------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------DRPLSVCDVGTGSGALAVTLAAERPRWSVWATDISPaALEVARDNARRNGVEGRIRFVRGEWLNPlrHRGVRVDVVVSN--------------------------------------------------------------------------------------------------------------------
+>UniRef100_A0A4P6H758	55	0.287	9.748E-04	184	267	384	107	192	290
+----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------LPLLAEIGERKGRchVLDLGTGTGAIALALLAATPQARAVGVDISEdALTTAARNARDLGLSERFSAVRSDWFE-AISGRFDVIVSN--------------------------------------------------------------------------------------------------------------------
+>UniRef100_A0A371XFG7	55	0.315	9.748E-04	196	267	384	121	192	294
+----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------RILDLGTGTGAIALALLHEAPKAEAVGVDISdDALETANENARRLGLGNRFSTVKSSWFE-KIEGRFDVIVSN--------------------------------------------------------------------------------------------------------------------
+>UniRef100_UPI001FE0A581	54	0.293	1.292E-03	192	295	384	84	190	230
+------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------DRPAEVLDLGCGNGVIAASVARRFGEAvRVAATDVSWlASDSARLTAAASGVE--VAVSQADGLESVADASLDLILTNPPFHRGTARDsapTLRMLAEAARVLRPGGQL----------------------------------------------------------------------------------------
+>UniRef100_A0A929D867	54	0.290	1.292E-03	193	303	384	33	161	269
+-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------EAHRVLDAACGTGMHSVALAQQ--GYAMTGTDLNaGMVERARANATAAGpVLSRAEGVDVQFEVAGFGElartltpalslpgrgsSFDAVLClgNSLPHLLTPASLAAALADFAACLRPGGLLLIQNRNFD--------------------------------------------------------------------------------
+>UniRef100_A0A546XUT9	54	0.329	1.292E-03	190	267	384	117	194	288
+----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------SQKGSARVLDLGTGTGAICLALLKECPGATGIGSDISaDALETAAKNASRNGLETRFEIRQSDWFE-KISGRFDIIVSN--------------------------------------------------------------------------------------------------------------------
+>UniRef100_A0A546XBX9	54	0.303	1.711E-03	190	267	384	117	194	288
+----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------SHKGSARILDLGTGTGAICLALLKECPDATGIGSDIStGALETAAKNASRNGLETRFEIMQSDWFE-KISGRFDIIVSN--------------------------------------------------------------------------------------------------------------------
+>UniRef100_A0A7X0SNC9	53	0.315	2.267E-03	184	255	384	114	186	304
+----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------LLEAERWQGAELTALDVGTGSGALAVTLAAERPAWRVVASDLSPdALEVARGNARANGVEPRIAFVQGDLLEP--------------------------------------------------------------------------------------------------------------------------------
+>UniRef100_UPI0004786EF2	53	0.304	2.267E-03	188	255	384	119	187	306
+--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------GWGGGGALTALDVGTGSGALAVTLAAERPAWRVVASDLSPdALEVARGNARANGVAERVTFVRGDLLEP--------------------------------------------------------------------------------------------------------------------------------
+>UniRef100_A0A6N7IC32	53	0.301	3.004E-03	193	264	384	32	101	124
+-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------PPGQALDVGCGEGADALWLARR--GWQVTAVDISRVA-LQRAATTGTSLAGRVAWTCADLTATPPPaGAFDLV-----------------------------------------------------------------------------------------------------------------------
+>UniRef100_A0A9D7HE84	53	0.324	3.004E-03	192	267	384	113	188	283
+------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------DAPHRILDLGTGSGAIMLALLKERPNATGVAIDISeEALAVVRANAEQLGVAERLQAGQGN-WAEHIDERFDLVVSN--------------------------------------------------------------------------------------------------------------------
+>UniRef100_A0A7V8DQQ7	53	0.303	3.004E-03	190	267	384	108	185	283
+----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------SPESAQTVLDLGTGTGAILLALLAERPNWTGLGIDIsSEALDLARENAKMHSLSERAHFQIGN-WAENITEKFNIVTSN--------------------------------------------------------------------------------------------------------------------
+>UniRef100_A0A5B8B2L1	53	0.295	3.004E-03	174	267	384	95	191	286
+------------------------------------------------------------------------------------------------------------------------------------------------------------------------------RPDTETLVEAVLPFVRRavqGKGACSILDLGTGTGAIALALLSAAPQAVATGVDISaDALATAARNAADLGLDGRFRTLQSDWFE-KISGRYDAIVSN--------------------------------------------------------------------------------------------------------------------
+>UniRef100_UPI000F83F048	53	0.313	3.004E-03	188	267	384	118	200	298
+--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------LWPDTAALDVLDIGTGSGAIALTLAAERPRWRVTTVDLSPtALAIARENAQRLQVEYRVRFLEGDLAQPllAAGEQVDLLVSN--------------------------------------------------------------------------------------------------------------------
+>UniRef100_A0A0D8KML8	53	0.328	3.980E-03	193	267	384	121	195	289
+-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------GSASVLDLGTGTGAICLALLKECPEATGIGSDISaDALETAAKNAARNGLASRFETVRSDWFK-KISGSFDIIVSN--------------------------------------------------------------------------------------------------------------------
+>UniRef100_A0A7C2EBL1	53	0.302	3.980E-03	197	267	384	145	220	320
+-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------ILDLCTGTGAIAIALARELPAARLIATDISrRALRIARTNAEAHGVADRVRFLRGDLWRAlygvMPGRQADLIVSN--------------------------------------------------------------------------------------------------------------------
+>UniRef100_A0A0B1TB99	52	0.310	5.272E-03	198	280	384	3	89	118
+------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------LDVGCGKGVHSALLANKFPKSNFTGIDvvMDAIQLANQQRKENGDSYENLKFEQMNgaKLDDNWSDKYDLVTIFFAAHDQTRPDLVR-------------------------------------------------------------------------------------------------------
+>UniRef100_UPI00227CA78F	52	0.369	5.272E-03	196	267	384	130	201	299
+----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------RVIDLGTGTGAIGLTLLCELPQAEGTGTDISqDALATARRNAQRLGVSDRFRTICGNWF-DAVEGEYDLVVSN--------------------------------------------------------------------------------------------------------------------
+>UniRef100_UPI00230011E8	52	0.293	5.272E-03	196	298	384	272	380	417
+----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------SIVDLGCGNGTISSYVPLKFKEFVGTMIatDSSRDAVAAtAETAKRNGVDSRVDVIRDDAMSTFAPASQDLILLNPPFHVgntVDPQIAPKLFRASARVLTQGGELWCV-------------------------------------------------------------------------------------
+>UniRef100_A0A257JKW7	52	0.320	6.983E-03	194	267	384	117	190	286
+--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------PNRVLDLGVGSGTILLALLAERKSWTGVGIDLSqDALALATENAAHVDLTDRVEFRLGD-WHQGLDERFDIVVSN--------------------------------------------------------------------------------------------------------------------
+>UniRef100_A0A257HLL7	52	0.320	6.983E-03	194	267	384	117	190	286
+--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------PNRVLDLGTGSGAILLALLAERKSWSGVGIDRSeEALALAADNAALHGLSDRVDLRLGD-WHQGLDEQFDIVVSN--------------------------------------------------------------------------------------------------------------------
+>UniRef100_A0A0N1A6W0	52	0.342	6.983E-03	196	267	384	122	193	290
+----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------SILDLGTGTGAIALALLHECGQAQAVGVDISEdALSTAARNAERLGLASRFETRAGPWF-VRVPERFDIIVSN--------------------------------------------------------------------------------------------------------------------
+>UniRef100_A0A8D5UIE1	52	0.285	6.983E-03	194	255	384	118	180	297
+--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------PIRVVDIGTGSGAIAVTLACERPHWEVWAIDLsPEALATAQTNAEIHGVRNRIVWRQGDLLEP--------------------------------------------------------------------------------------------------------------------------------
+>UniRef100_H0UAL5	52	0.292	6.983E-03	189	267	384	120	201	299
+---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------WSAEQPLSVVDFGTGSGAITLTLAAEKPNWQLTTVDISlDAIAIAKQNAGRLDVEKRVRFIQGDLVEPilETGERVDIIVSN--------------------------------------------------------------------------------------------------------------------
+>UniRef100_A0A4Q4CP92	51	0.307	9.249E-03	277	353	384	2	75	88
+-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------QKVALLRRAHAALPEGGALIVYDGMIDDDR----RENAFGLLMSLNMLIeTPGGFDYTGADCRGWMLQAGFREARVQP------------------------------
+>UniRef100_UPI001AE806D2	51	0.302	9.249E-03	193	267	384	116	190	287
+-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------GEARLLDLGTGTGAIILALLKESPETQGIGSDISEdALKTAAENAARLGLSERFEAIRSDWFE-NISGRFDIIVSN--------------------------------------------------------------------------------------------------------------------
+>UniRef100_UPI001FF66CFB	51	0.263	9.249E-03	193	276	384	116	205	287
+-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------GSARILDLGTGTGAIVLALLKESPQAQGIGSDISEdALQTASRNAARLGMSERFQAIRSDWF-DAISGRFDIIvsnppyICSGVIPALDPE-----------------------------------------------------------------------------------------------------------
+>UniRef100_A0A1I2LK27	51	0.320	9.249E-03	193	267	384	120	197	297
+-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------RPLSVCDVGTGSGALAVTLAAERPRWVVFATDIsSAALAVARENARRNGVEERIRFLRGKWLEPlrQGGDRVDVVVSN--------------------------------------------------------------------------------------------------------------------
+>UniRef100_UPI00115A3FED	51	0.315	1.225E-02	196	267	384	119	190	289
+----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------RILDLGTGTGAILLALLKECPEATGLGADISaDALQTAQANAAALGLQDRFEAVRSDWF-QNIGQRFDMIVSN--------------------------------------------------------------------------------------------------------------------
+>UniRef100_A0A502III3	51	0.292	1.225E-02	189	267	384	120	201	299
+---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------WDTEQTLSVVDFGTGSGAITLTLAAEKPNWQLTTVDISlDAIAIATKNAERLGVRDRVRFLQGDLVEPMLiaGERVDILISN--------------------------------------------------------------------------------------------------------------------
+>UniRef100_A0A938SZY6	51	0.316	1.225E-02	197	255	384	128	187	299
+-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------IVDIGTGSGCIAVALARALPTAVVYATDRSaGALQMARANAARQGVEDRIRFFAGDLFEP--------------------------------------------------------------------------------------------------------------------------------
+>UniRef100_A0A7C4LCS8	51	0.329	1.225E-02	180	267	384	119	209	302
+------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------VDEALKFLASTERAEAKVLDVGTGSGCIAVTLAVRRPRAAVTALDIaEDALDVARLNAERHGVAGRVAFFRSDLLEGlrLLRPGFDLVCAN--------------------------------------------------------------------------------------------------------------------
+>UniRef100_A0A920LUD8	51	0.315	1.622E-02	196	267	384	46	117	197
+----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------SCLDLGTGSGCLLLSLLSALPKTSGIGVDLaPLAVSQARANAAQLGLADRAQFICSDWFE-GVEGSFDLVLAN--------------------------------------------------------------------------------------------------------------------
+>UniRef100_A0A949NMS4	51	0.301	1.622E-02	196	267	384	109	180	278
+----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------RIVDLGIGTGAIGLALLAECPEAQCLGVDVSaEAVAIALENARSLGLSARYSAVTGDWLS-GIEARFDLIVSN--------------------------------------------------------------------------------------------------------------------
+>UniRef100_UPI000A19732A	51	0.333	1.622E-02	194	267	384	117	190	286
+--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------PNRVLDLGTGSGAILLALLSERKSWTGVGIDRSeEALALAAENAALHGLSERVELRLGN-WHQGVDEEFDIVVSN--------------------------------------------------------------------------------------------------------------------
+>UniRef100_A0A7U4XWP3	51	0.333	1.622E-02	194	267	384	117	190	286
+--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------PNRVLDLGVGSGTILLALLAERKSWTGVGIDRSeEALSLAGENASLHGLTDRVDLRLGD-WHQGLDEQFDIVVSN--------------------------------------------------------------------------------------------------------------------
+>UniRef100_A0A068SLK7	51	0.302	1.622E-02	193	267	384	116	190	287
+-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------GSARILDLGTGTGAIVLALLKESPQAQGIGSDISEdALQTALRNAARLGMSERFQAIRSDWF-DAISGRFDIIVSN--------------------------------------------------------------------------------------------------------------------
\ No newline at end of file
diff --git a/forks/boltz/examples/msa/seq2.a3m b/forks/boltz/examples/msa/seq2.a3m
new file mode 100644
index 00000000..ecaacc88
--- /dev/null
+++ b/forks/boltz/examples/msa/seq2.a3m
@@ -0,0 +1,168 @@
+>101
+SDQLEDSEVEAVAKGLEEXYANGVTEDNFKNYVKNNFAQQEISSVEEELNVNISDASTVVQARFNWNALGSCVANKIKDEFFAXISISAIVKAAQKKAWKELAVTVLRFAKANGLKTNAIIVAGQLALWAVQCGLS
+>UniRef100_A0A8S0JH07	200	0.549	9.920E-56	4	134	136	45	171	173
+----EQKQIDDVANVLEQMFRNGVNEKNFTEYVYKNFSQKDIAFAENELETNINNPY----DRVPWDEMGGCIAGKIRDEFFAMINVSLIVKYAQKKAWSELAKVVLRFVKANGLKTNIYIIAGQLAIWAVQCGM-
+>UniRef100_UPI00110EAFB6	199	0.977	2.558E-55	0	135	136	34	169	170
+SDQLEDSEVEAVAKGLEEMYTNGVTEDNFKNYVKNNFAQQEISSVEEELNVNISDASTVVQARFNWNALGSCVANKIKDEFFAMISISAIVKAAQKKAWKELAVTVLRFAKANGLKTNAIIVAGQLALWAVQCGLS
+>UniRef100_UPI001CF7A1DD	185	0.539	1.616E-50	9	134	136	1	122	124
+---------DDVANVLDQMFRNGVNEKNFTEYVYKNFSQKDIALAENKLETNINN----LYDRVPWDEMGGCIARKIREEFFAMTNVSLIVKYAQKKAWLELAKVVLRFVKANGLKTNTYIIAGQLAIWAVQCGL-
+>UniRef100_A0A455TWS1	177	0.686	8.943E-48	1	134	136	35	168	170
+-EQIKNSEVDTVAQGLEQMFSNGVSEENFKNYVNANFSSEEITKSEKELDVNLSNTSSPIQARVNWNGLGQCMANKIKDEFFAMINVGAIVAAAQKKAWKELAMTVLIFAKANGLKTNALIVAGQLAVWAVQCGL-
+>UniRef100_UPI0012B3E02F	177	0.466	8.943E-48	4	134	136	44	176	179
+----EQRQIDEVAAVLEKMFADGVTEENLKQYAQANYSEEELIIADNELNTNLSQIQDEnaIMYKVDWGALGNCMANKIKDELLAMISVGTIIKYAQKKAWKELAKIVIKYVAKAGVKTNAALIAGQLAIWGLQCGI-
+>UniRef100_A0A5Q2SBQ8	172	0.476	5.426E-46	9	134	136	1	128	131
+---------DEVAAVLEKMFADGVTEENLKQYAQANYSEEELIIADNELNTNLSQIQDEnaIMYKVDWGALGNCMANKIKDELLAMISVGTIIKYAQKKAWKELAKIVIKYVAKAGVKTNAALIAGQLAIWGLQCGI-
+>UniRef100_A0A7U9RNI7	166	0.503	6.190E-44	5	134	136	43	181	185
+-----DPEVAVVAQELEKIFANGVSQENLNKYVLKNFSNKELTVAEKELDVNYNpfslqskndNNSLHSVSVYGWNNLGQCMYNKIKDEFFEMVNIGVIVKYAKKKAWKELAKVVIRFAKGAGVRTNAAIVAAQLAVWAVQCGM-
+>UniRef100_UPI00062A1226	162	0.286	1.456E-42	10	134	136	55	183	186
+----------AVAKELEKMFVDGDIENLNIDYLIAKYGKDEIQATERFIGISENEsrifPTEHRIVQRDLADIGNCMLGKLGEEIRSMVNVNTIVAYIDKKLWLEAAKAIVAKVAAQGIKRNAAVMATVLAWYAVQCGL-
+>UniRef100_UPI0013568C51	162	0.445	2.738E-42	9	134	136	1	128	131
+---------DKFAAVLEKMFAKGVTEENFKQYAQANYSEEELMIADREMNTNLSqiQDDDVIMYKMDWNALGSYMANKIKDELLAMISIGTIITYAKRKAWKELATIVIKYVAKAWVRTNVAFIAGQLAIWGLQCGI-
+>UniRef100_UPI001FD87A89	159	0.533	1.821E-41	4	134	136	39	171	173
+----EDKEIELVANELEAMFSNGVTENNLKNYVNENYDSRDISTAEKELNTSLkkTNYNYLLRSKFSWNKFGNCMVNEIKDEFFAMINVATIVKYAKKKSWKKLAGVVLKFAKANGLKTNVAIIAGQLAVWAIKCGI-
+>UniRef100_UPI001A0EA69D	158	0.598	4.696E-41	3	134	136	44	173	175
+---ISSQEVDQVAQALELMFDNNVSTSNFKKYVNNNFSDSEIAIAELELESRISN--SRSEFRVAWNEMGGCIAGKIRDEFFAMISVGTIVKYAQKKAWKELALVVLKFVKANGLKTNAIIVAGQLALWAVQCGL-
+>UniRef100_UPI000DA36189	158	0.617	6.440E-41	7	134	136	48	173	175
+-------EVDQVAQALELMFDNNVSTSNFKKYVNNNFSDSEIAIAELELESRISN--SRSEFRVAWNEMGGCIAGKIRDEFFAMISVGTIVKYAQKKAWKELALVVLKFVKANGLKTNAIIVAGQLALWAVQCGL-
+>UniRef100_E1LSW0	157	0.518	1.211E-40	19	126	136	1	104	106
+-------------------FRNGVNEKNFTEYVYKNFSQKDIALAENELETNINNPY----DRVPWDEMGGCIAGKIREDFFAMTNVSLIVKYAQKRAWLELAKVVLRFVKANRLKTNIYIIAGQLA---------
+>UniRef100_A0A556UDB4	155	0.471	5.872E-40	0	134	136	34	173	177
+SDSVQSQDVDTVATELQKMFAHGVSQENLNKYAKENFSKQELQAASRELDVNYLANtssttYSPFISMFSWNSMGKCMYNKIKDELFAMVNVGVIVKYAKKKAWKELAKVVIRVAKGAGVKTNAILVAGQLAVWAVACGM-
+>UniRef100_A0A081PZB4	133	0.444	2.802E-32	4	93	136	75	160	161
+----EQKQIDDVANVLEQMFRNGVNEKNFTEYVYKNFSQKDIALSENELETNINNPY----DRVPWDEMGGCIAGKIRDEFFAMINVSLIVKYA------------------------------------------
+>UniRef100_K0Z545	115	0.231	4.125E-26	37	132	136	144	251	263
+-------------------------------------SSEQLALIVNSLNGAADNPYVDAQSDRSWGSFGSCVVTGVLGFSPFQIDYNLLGKYIYEKSWKKVADLLKRYAKKEIAKKSGNIVLKQiikstpagfaawLGVYAVGC---
+>UniRef100_UPI000D25C0E4	108	0.213	1.654E-23	23	132	136	90	210	222
+-----------------------VNEKLAAEYGFGR-SSEQLALIVNSLNGTSENPYVDAQSVRSWGSFGSCVVTGVLGFSPFQIDYNLLGKYIYEKSWNKVAGLLKRYAKKEIANKGGNIVLKQiikstpagfaawLGVYAVGC---
+>UniRef100_UPI001C8F0653	107	0.493	3.107E-23	57	129	136	23	95	100
+---------------------------------------------------------DVIMYKMDWNALGSYMANKIKDELLAMISIGTIITYAKRKAWKELATIVIKYVAKAWVRTNVAFIAGQLAIWG------
+>UniRef100_UPI000D52D7A3	103	0.210	5.309E-22	17	132	136	87	210	222
+-----------------KFFVD---EKLAAEYGFGR-SSEQLALIVNSLNGTSEHPHIDAQSVRSWGSFGSCVVTGVLGFSPFQIDYNLLGKYIYEKAWNKVAGLLKRYAKKEIAKKGGNIVLKQiikstpvgfaawLGVYAVGC---
+>UniRef100_A0A133S201	103	0.386	7.277E-22	19	93	136	1	71	72
+-------------------FRNGVNEKNFTECVYKNFSQKDIALAENKLETNINN----LYDRVPWDEMGGCIARKIREEFFAMTNVSLTVRYA------------------------------------------
+>UniRef100_UPI000B18BA61	97	0.666	8.234E-20	72	134	136	0	62	66
+------------------------------------------------------------------------MYNKIKDEFFAMVNIEVIVKYAKKKAWKELAKVVIRFAKGAGVRTNAAIVTAQLAVWAVQCGM-
+>UniRef100_UPI00207479F9	93	0.244	1.924E-18	1	132	136	16	154	158
+-EQIQDSqnQVDKVAKEFEDLFTNGiqINENSYainSDYLVQNYSSEEISGIVSLIEESSLINNTSTRSKRDIGSFLVCMKDKAVGDLKDMFNVGKFLVFIKTKAWKQAAEFAVKWLAKNGVKRNAVATAALLGWYGVQC---
+>UniRef100_A0A2N8LAA9	93	0.259	1.924E-18	3	132	136	36	170	174
+---ISQSEVDAVAIEFEKLFSNGIIisGNNYSinyDYLNNNYTSEEIQAFINLMASSELSPISSGRRKRSISSFVVCMKDKAVSDIADMFKVSAFVSFVQRKAWKEAAKFAVSWLAKNGIKRNVAATAALLSWYGIQC---
+>UniRef100_UPI001FF59259	88	0.233	8.429E-17	5	132	136	30	162	166
+-----QTEIESVASEFEQLFTKGIIisGNNYTfnhDYLTNNYTSDEIQAFIHLMDSTDLSPTFSKRRKRSIGSFAVCMKDKAVSDIADMFKVGAFVSFIQRKAWKEAAKFAVSWLAKNGIKRNVAATAALLSWYGIQC---
+>UniRef100_UPI000407185C	87	0.745	2.168E-16	84	134	136	1	51	53
+------------------------------------------------------------------------------------TNVSLIVKYAQKKAWSELAKVVLRFVKANGLKTNIYIIAGQLAIWAVQCGL-
+>UniRef100_UPI00135BC820	83	0.255	3.685E-15	5	132	136	38	170	174
+-----QAEVDAVAVELENLFTngiliNGDSYTLNIDYLYKNYTPEEVDSFIALMKSSNLSSNTINRKKRSVNSFLVCMKDKAVADIADMFKVGAFVSFIQRKAWREAAQFAVSWLARNGIKRNVAATAALLSWYGVQC---
+>UniRef100_A0A2N6UQ44	79	0.181	1.173E-13	3	132	136	47	200	206
+---ITEAEIDAFSQDVADKFVilmrdgiiyDGSSFRSNDDVLSAAGFANEADLIEElvdSLNKGANNRYTSVYTDRSLSSFGKCVVTGVLGFSPFQIDYNLLGKYIKEKAWNKVADLLQKYAKKEIEKKAGSVVLKQiikstpagfaawLGVYAVGC---
+>UniRef100_UPI001C0EBA32	79	0.168	1.607E-13	3	132	136	48	201	213
+---ITEAEIDAFSQEVADKFVilmrdgiiyDGSSFRSNDDVLSAmGFSNEAdlIKELVDSLNNGANNRYANVYTERSLSSFGKCVVTGVLGFSPFQIDYNLLGKYIKEKAWNKVADLLQKYAKKEIKKKAGSVVLKQiikstpagfaawLGVYAVGC---
+>UniRef100_UPI001C0F1009	78	0.162	4.127E-13	3	132	136	47	200	212
+---ITEAEIDAFSQEVADKFVilmrdgiiyDGSSFRSNDDVLSAmGFSNEAdlIKELVDSLNNGANNRYANVYTERSLSSFGKCVVTGVLGFSPFQIDYNLLGKYIKEKAWNKVADLLQKYAKKEIKKKAGSVLLKQiikstpagfaawLGVYAVGC---
+>UniRef100_UPI000214F415	66	0.346	2.716E-09	5	53	136	24	72	93
+-----DPEVAIAAQELEKIFVDVVSQKNLNRYALKNFSNKELTVAEKELDVNYN----------------------------------------------------------------------------------
+>UniRef100_UPI0012EE93E6	58	0.238	2.655E-06	62	124	136	108	170	202
+--------------------------------------------------------------DRSWASFGECVVTGILGFSIFGIDYNLLGQYIKQKAWGAAAALLKKEAEKELKKQGAKIALKQ-----------
+>UniRef100_UPI0011BE0601	57	0.141	6.774E-06	3	96	136	48	153	158
+---ITEAEIDAFSQEVADKFVilmrdgiiyDGSSFRSNDDVLSAmGFSNgaDLIKELVDSLNNGANNRYANVYTERSWSSFGKCVVTGVLGFSPFQIDYNLLGKYIKEK---------------------------------------
+>UniRef100_UPI000370F184	55	0.201	2.359E-05	29	132	136	98	206	211
+-----------------------------KEVLISNLGYDEASATAESLGLTIDELVSDRTVpntngDRGVGEFLSCMKGHATDDLKSIFNVNAVSYYIGKEKYFEAALAAGKHLAKQGIRRNAYGLIGILAWYGVRC---
+>UniRef100_A0A0G3H5S3	55	0.206	3.222E-05	4	132	136	51	180	185
+----QEEQVEALA-ELLKEMDEAGSEAEVQQLFVERFGQDNLEDAAAQLGTNTSEVFreSDEVVEEGFGEFLQCIKGKATNDIKKALDVNVVAAFIGQKDYAKAAWAIVKHLAKQGIKRNAFAIAGMLAWWAWQC---
+>UniRef100_UPI000F652D05	50	0.250	9.887E-04	63	134	136	111	182	185
+---------------------------------------------------------------RDTGEFLSCMKGKASDDLKSIFDVNAIAVLIGQEKYGEAAVAAVKYLAKQGIKRNAAGIAGVLLFYAAKCSI-
+>UniRef100_UPI00125CB70C	46	0.225	2.995E-02	53	132	136	97	176	181
+-----------------------------------------------------NELTTDTTSFRGAPQFLSCMKSKVSNDLKSIFNINAIASLIGQQKYYEAAVKAVQYLAKQGIKRNVAGIAGALAFYGAKC---
+>UniRef100_UPI0009761044	44	0.285	1.404E-01	67	132	136	108	174	176
+-------------------------------------------------------------------SFWSCMKNQLLDmigyQTFQALLRGGIQGLIQRKAWKAAAKLLIRYL---GDGIGVGFIAAQLAWYAIRC---
+>UniRef100_V9W2Y6	44	0.311	1.911E-01	72	132	136	0	56	60
+------------------------------------------------------------------------MKDKLMQEFEELVNIGTLGVLIAEKKWTELAWTLIKK----GVKRNPWVLAGWLAWQAAKC---
+>UniRef100_UPI001F1C6CF6	43	0.252	3.541E-01	70	132	136	53	115	120
+----------------------------------------------------------------------SCMEGKVEDDVKEIFHVNAIAVLIGQEKYFEAAEEAVAYLAKQGVKRNAAAIASVLAFYGARC---
+>UniRef100_UPI001F2B8987	43	0.252	3.541E-01	70	132	136	116	178	183
+----------------------------------------------------------------------SCMEGKVEDDVKEIFHVNAIAVLIGQEKYFEAAEEAVAYLAKQGVKRNAAAIASVLAFYGARC---
+>UniRef100_A0A2S0WEI1	42	0.228	4.819E-01	63	132	136	52	121	129
+---------------------------------------------------------------RSVGEFLTCMRSEVTDDLKSIFDINAIAALIGREKYWEAAVEAVKFLAKQGIKRNVAGLAATLAFYGGKC---
+>UniRef100_A0A9D1RZL8	39	0.238	5.627E+00	66	132	136	112	178	183
+------------------------------------------------------------------GEFLSCIKGKVDAEVKAIFDVNAIAVLIGQENYFKAAKKAVDFLARQGIRKNAVGIAAVLAYHGARC---
+>101
+SDQLEDSEVEAVAKGLEEXYANGVTEDNFKNYVKNNFAQQEISSVEEELNVNISDASTVVQARFNWNALGSCVANKIKDEFFAXISISAIVKAAQKKAWKELAVTVLRFAKANGLKTNAIIVAGQLALWAVQCGLS
+>U6S4W9	158	0.985	3.319E-41	0	135	136	55	190	191
+SDQLEDSEVEAVAKGLEEMYANGVTEDNFKNYVKNNFAQQEISSVEEELNVNISDASTVVQARFNWNALGSCVANKIKDEFFAMISISAIVKAAQKKAWKELAVTVLRFAKANGLKTNAIIVAGQLALWAVQCGLS
+>uvig_117295_3	158	0.985	3.319E-41	0	135	136	55	190	191
+SDQLEDSEVEAVAKGLEEMYANGVTEDNFKNYVKNNFAQQEISSVEEELNVNISDASTVVQARFNWNALGSCVANKIKDEFFAMISISAIVKAAQKKAWKELAVTVLRFAKANGLKTNAIIVAGQLALWAVQCGLS
+>A0A1C0USB4	156	0.557	1.610E-40	4	134	136	45	171	173
+----EQKQIDDVANVLEQMFRNGVNEKNFTEYVYKNFSQKDIALAENELETNINNPYD----RVPWDEMGGCIAGKIRDEFFAMINVSLIVKYAQKKAWSELAKVVLRFVKANGLKTNIYIIAGQLAIWAVQCGL-
+>MGYP000967978327	156	0.557	1.610E-40	4	134	136	45	171	173
+----EQKQIDDVANVLEQMFRNGVNEKNFTEYVYKNFSQKDIALAENELETNINNPYD----RVPWDEMGGCIAGKIRDEFFAMINVSLIVKYAQKKAWSELAKVVLRFVKANGLKTNIYIIAGQLAIWAVQCGL-
+>R2N7C7	143	0.686	7.398E-36	1	134	136	35	168	170
+-EQIKNSEVDTVAQGLEQMFSNGVSEENFKNYVNANFSSEEITKSEKELDVNLSNTSSPIQARVNWNGLGQCMANKIKDEFFAMINVGAIVAAAQKKAWKELAMTVLIFAKANGLKTNALIVAGQLAVWAVQCGL-
+>A0A2A5L654	137	0.286	1.156E-33	10	134	136	55	183	186
+----------AVAKELEKMFVDGDIENLNIDYLIAKYGKDEIQATERFIGISENEsrifPTEHRIVQRDLADIGNCMLGKLGEEIRSMVNVNTIVAYIDKKLWLEAAKAIVAKVAAQGIKRNAAVMATVLAWYAVQCGL-
+>3300014513.a:Ga0169742_10090_9	137	0.286	1.156E-33	10	134	136	55	183	187
+----------AVAKELEKMFVDGDIENLNIDYLIAKYGKDEIQATERFIGISENEsrifPTEHRIVQRDLADIGNCMLGKLGEEIRSMVNVNTIVAYIDKKLWLEAAKAIVAKVAAQGIKRNAAVMATVLAWYAVQCGL-
+>A0A256LDH3	134	0.503	1.053E-32	5	134	136	43	181	185
+-----DPEVAVVAQELEKIFANGVSQENLNRYVLKNFSNKELTVAEKELDVNYN--PFSLQSKNDnnslhsvsvygWNNLGQCMYNKIKDEFFAMVNIGVIVKYAKKKAWKELAKVVIRFAKGAGVRTNAAIVAAQLAVWAVQCGM-
+>Q6DRR6	128	0.466	8.748E-31	4	134	136	44	176	179
+----EQRQIDEVAAVLEKMFADGVTEENLKQYAQANYSEEELIIADNELNTNLSQIQDenAIMYKVDWGALGNCMANKIKDELLAMISVGTIIKYAQKKAWKELAKIVIKYVAKAGVKTNAALIAGQLAIWGLQCGI-
+>MGYP000869820508	128	0.237	1.199E-30	4	133	136	55	192	196
+----EEQQVEEVAKLLEKM-DKAPSREEAQRVLEDNFSQEELNGVAEELDIssdevltgaDAKDVGDAAATEEGFKDFYRCIKSKAGKDLRSALNVNAVMAAFGQKDYLKAAREIVKYLLKNGLKRNVFALAVTLGWYALQCS--
+>MGYP000215453753	126	0.222	5.813E-30	4	132	136	51	184	188
+----EKQQVEQLAKVLEKV-DNAPNREEAERIMVENFGEEGLEEAAKEIGVDPNNplgegsPTRSARGEVNEEGFVECMAGKVGDEIKGLLNINGVALALGQKDYPKMAAEIVKYLAKQGIKRNVGALALLLAWYGAQC---
+>A0A0T8EFX5	116	0.504	2.127E-26	19	127	136	1	105	106
+-------------------FRNGVNEKNFTEYVYKNFSQKDIALAENELETNINNPYD----RVPWDEMGGCIVGKIREDFFAMTNVSLIVKYAQKRAWLELAKVVLRFVKANRLKTNIYIIAGQLAF--------
+>MGYP000013645973	116	0.244	2.127E-26	1	132	136	16	154	158
+-EQIQDSqnQVDKVAKEFEDLFTNGiqINENSYainSDYLVQNYSSEEISGIVSLIEEISLINNTYTRSKRDIGSFLVCMKDKAVGDLKDMFNVGKFLVFIKTKAWKQAAEFAVKWLAKNGVKRNAVATAALLGWYGVQC---
+>MGYP000875481199	113	0.232	1.936E-25	4	132	136	52	192	197
+----EEQQVEEIAKFLEQV-DKAPSEKDAHRILEERFSQEELNGAAEELGVSPEEmfadggaqdgaklPEDPANNEESFGSFMRCIAGKAGNDLKSVIYSKDVLRAISKKQYKKAALAIVRHLAKQGIKRNIVVLGIQLGWYAFQC---
+>MGYP000964187490	103	0.221	5.146E-22	5	103	136	30	133	134
+-----QTEIESVASEFEQLFTKGIIisGNNYTfnhDYLTNNYTSDEIQAFIHLMDSTDLSPTFSKRRKRSIGSFAVCMKDKAVSDIADMFKVGAFVSFVQRKAWKEAAK--------------------------------
+>A0A0K0G7I1	94	0.202	7.246E-19	0	132	136	10	172	176
+SDDVEGAELAKLEQDLEFLFEEATTEEGDKYVLdeekaKDYFGEEnlpEIKILIKLINeeevteeefLNagiVPKHESYEEAKaevRDQNdnlvsnySWLGCMKTKIIAGTGLGFFGKGIDKLIEDKNWKKLSKEIIKIVGKNAVRGGAVGLAASLAVWSTMC---
+>W7RBR4	91	0.250	1.235E-17	61	132	136	114	185	189
+-------------------------------------------------------------SQFHTASWWGCLKEKIIDFTGLGFIGGGLEKMLKKKLWKKAATEIIKIVGKNAIRGGVLGLAGSLAWFSVRC---
+>MGYP001084790427	85	0.971	1.389E-15	67	135	136	9	77	78
+-------------------------------------------------------------------SLGSCVANKIKDEFFAMISISAIVKAAQKKAWKELAVTVLRFAKANGLKTNAIIVAGQLALWAVQCGLS
+>MGYP001008199351	84	0.710	1.903E-15	66	134	136	15	83	85
+------------------------------------------------------------------DEMGGCIAGKIRDEFFAMINVSLIVKYAQKKAWSELAKVVLRFVKANGLKTNIYIIAGQLAIWAVQCGL-
+>MGYP001068281740	75	0.984	3.611E-12	0	63	136	34	97	115
+SDQLEDSEVEAVAKGLEEMYANGVTEDNFKNYVKNNFAQQEISSVEEELNVNISDASTVVQARF------------------------------------------------------------------------
+>MGYP000904613324	74	0.242	4.944E-12	67	132	136	14	79	83
+-------------------------------------------------------------------SWTSCIKEKIMIATGIGFITGGMNKLIEEKAWKKLSLEIAKIVGKNAIKGGVVGLTASLAVWSIVC---
+>MGYP000968663296	70	0.396	1.143E-10	4	56	136	64	116	117
+----EQKQIDDVANVLEQMFRNGVNEKNFTEYVYKNFSQKDIALAENKLETNINNLY-------------------------------------------------------------------------------
+>A0A133S201	70	0.378	2.141E-10	19	92	136	1	70	72
+-------------------FRNGVNEKNFTECVYKNFSQKDIALAENKLETNINNLYD----RVPWDEMGGCIARKIREEFFAMTNVSLTVRY-------------------------------------------
+>MGYP001149482190	69	0.678	4.009E-10	79	134	136	22	77	81
+-------------------------------------------------------------------------------EFFAMVNIGLIVKYAKKKAWKELAKVVIRFAKGAGVRTNAAIVAAQLAVWAVQCGM-
+>A0A0Q9UUB0	68	0.270	1.027E-09	38	132	136	83	175	203
+--------------------------------------QQEIESSSCELaETTVINPIQPLAAKKSWKS---CMVASLKDHFGVALIevamTGGLWAYLQKKAYKEAAKLLIKI----GIGGNAIGLAATLTWYGTRC---
+>A0A192YJB0	67	0.271	1.406E-09	67	132	136	117	183	185
+-------------------------------------------------------------------SFWSCMKNQLLDmisyQTFQALLRGGIQGLIQRKAWKAAAKLLIRYLG-DGI--GVGFIAAQLSWYAIRC---
+>MGYP000655452331	66	0.928	2.632E-09	80	135	136	7	62	63
+--------------------------------------------------------------------------------IRDRISISAIVKAAQKKAWKELAVTVLRFAKANGLKTNAIIVAGQLALWAVQCGLS
+>R8G7N7	62	0.238	8.256E-08	8	132	136	43	187	190
+--------VEKLAEDLEFIMEKAAIRNsNDKVIdfdfdkLENRFGKlQEFKILKNEINndklnkheinqkqcTNISN-YNSLQAK-SWNGWKSCMVDALKDHFGVKIieiaFEGGLWGYLEKKAYKEAAKLLVKI----AVGSNVLGVTSFLVYYGAKC---
+>UniRef100_A0A1X7GMK4	61	0.216	1.544E-07	7	132	136	38	178	206
+-------QVDELAEDLEFLMEEAaiyDSENNVVgfhfDKLEDRFGeveelkmlQQEIESSSCELvetTTTETNSVQPLAAKKTWK---GCMIDSLKDHFGVAIIevamTGGLWAYLEQKAYKEAAKLLIKI----GVGGNVIGLAAFLTYYSAKC---
+>A0A1X7GMK4	61	0.216	1.544E-07	7	132	136	38	178	206
+-------QVDELAEDLEFLMEEAaiyDSENNVVgfhfDKLEDRFGeveelkmlQQEIESSSCELvetTTTETNSVQPLAAKKTWK---GCMIDSLKDHFGVAIIevamTGGLWAYLEQKAYKEAAKLLIKI----GVGGNVIGLAAFLTYYSAKC---
+>MGYP001088613770	60	0.318	3.946E-07	5	70	136	29	92	98
+-----DPEVAVAAQELEKIFVDAVSQKNLNRYALKNFSNKELTVAEKELDVNYN--PFSLQSKNDNNSLHS-----------------------------------------------------------------
+>A0A1L6ZGN2	59	0.239	7.374E-07	66	132	136	107	173	182
+------------------------------------------------------------------GTWGDCMIDSLKDHFGVAMIevalTGGLWSYLEKKAYKEAAKLLLKI----GIGGNVIGLVAFLTWYSAKC---
+>A0A1J9VKJ1	55	0.252	1.674E-05	62	132	136	108	176	182
+--------------------------------------------------------------KRS--AWTDCMVDAIKDHFGVAAVTaaleGGLWAYLEKKAYKEAAKLLVKF----AIGSNAVGLAGTLVYYGGKC---
+>F7SG70	55	0.318	3.123E-05	5	70	136	24	87	93
+-----DPEVAIAAQELEKIFVDVVSQKNLNRYALKNFSNKELTVAEKELDVNYN--PFSLQLKNDNNSLHS-----------------------------------------------------------------
+>A0A0V8JI20	51	0.273	5.147E-04	64	132	136	107	175	181
+----------------------------------------------------------------SNEAWKSCMIGAIKDHFGVAMVTaaleGGLWAYLEKKAYKEAAKLLVKF----AVGSNAVGLAGTLIYYGGVC---
+>MGYP000101651737	46	0.236	2.903E-02	15	69	136	9	58	59
+---------------LEQEFLISLI-KDKPETVYKNFSKKDIALAENKLEININNLYD----RVPWDEMG------------------------------------------------------------------
+>A0A270AIV9	44	0.276	9.993E-02	86	132	136	1	43	71
+--------------------------------------------------------------------------------------TGGLWANLEKKAYKEAAKLLVKI----GIGGNAIDLASFLTWYSARC---
+>MGYP001000650989	44	0.276	1.853E-01	86	132	136	18	60	67
+--------------------------------------------------------------------------------------TGGLWGYLKKKAYKEAAKLLVKI----GVGTNAATLAATLIYYGGKC---
+>MGYP001053269802	44	0.216	1.853E-01	68	133	136	0	82	88
+--------------------------------------------------------------------FGKCILNKMdlgeLKNLAKIIFKPATVRYLKSHAWKKASammvNAIVQYAPKKvaslAVKKFANLTLpgvgwASVAWWGAQCG--
+>MGYP000578092484	42	0.315	8.644E-01	63	132	136	95	167	172
+---------------------------------------------------------------RSPYDFGKCI---LKDYFGVYIDlvqgklWDSFVGYLQSEAWTEAAKIILKIIGKSASKANLIATAGQLALAAFNC---
diff --git a/forks/boltz/examples/multimer.yaml b/forks/boltz/examples/multimer.yaml
new file mode 100644
index 00000000..c314c48b
--- /dev/null
+++ b/forks/boltz/examples/multimer.yaml
@@ -0,0 +1,8 @@
+version: 1  # Optional, defaults to 1
+sequences:
+  - protein:
+      id: A
+      sequence: MAHHHHHHVAVDAVSFTLLQDQLQSVLDTLSEREAGVVRLRFGLTDGQPRTLDEIGQVYGVTRERIRQIESKTMSKLRHPSRSQVLRDYLDGSSGSGTPEERLLRAIFGEKA
+  - protein:
+      id: B
+      sequence: MRYAFAAEATTCNAFWRNVDMTVTALYEVPLGVCTQDPDRWTTTPDDEAKTLCRACPRRWLCARDAVESAGAEGLWAGVVIPESGRARAFALGQLRSLAERNGYPVRDHRVSAQSA
diff --git a/forks/boltz/examples/pocket.yaml b/forks/boltz/examples/pocket.yaml
new file mode 100644
index 00000000..96936237
--- /dev/null
+++ b/forks/boltz/examples/pocket.yaml
@@ -0,0 +1,12 @@
+sequences:
+  - protein:
+      id: [A1]
+      sequence: MYNMRRLSLSPTFSMGFHLLVTVSLLFSHVDHVIAETEMEGEGNETGECTGSYYCKKGVILPIWEPQDPSFGDKIARATVYFVAMVYMFLGVSIIADRFMSSIEVITSQEKEITIKKPNGETTKTTVRIWNETVSNLTLMALGSSAPEILLSVIEVCGHNFTAGDLGPSTIVGSAAFNMFIIIALCVYVVPDGETRKIKHLRVFFVTAAWSIFAYTWLYIILSVISPGVVEVWEGLLTFFFFPICVVFAWVADRRLLFYKYVYKRYRAGKQRGMIIEHEGDRPSSKTEIEMDGKVVNSHVENFLDGALVLEVDERDQDDEEARREMARILKELKQKHPDKEIEQLIELANYQVLSQQQKSRAFYRIQATRLMTGAGNILKRHAADQARKAVSMHEVNTEVTENDPVSKIFFEQGTYQCLENCGTVALTIIRRGGDLTNTVFVDFRTEDGTANAGSDYEFTEGTVVFKPGDTQKEIRVGIIDDDIFEEDENFLVHLSNVKVSSEASEDGILEANHVSTLACLGSPSTATVTIFDDDHAGIFTFEEPVTHVSESIGIMEVKVLRTSGARGNVIVPYKTIEGTARGGGEDFEDTCGELEFQNDEIVKIITIRIFDREEYEKECSFSLVLEEPKWIRRGMKGGFTITDEYDDKQPLTSKEEEERRIAEMGRPILGEHTKLEVIIEESYEFKSTVDKLIKKTNLALVVGTNSWREQFIEAITVSAGEDDDDDECGEEKLPSCFDYVMHFLTVFWKVLFAFVPPTEYWNGWACFIVSILMIGLLTAFIGDLASHFGCTIGLKDSVTAVVFVALGTSVPDTFASKVAATQDQYADASIGNVTGSNAVNVFLGIGVAWSIAAIYHAANGEQFKVSPGTLAFSVTLFTIFAFINVGVLLYRRRPEIGGELGGPRTAKLLTSCLFVLLWLLYIFFSSLEAYCHIKGF
+  - ligand:
+      ccd: EKY
+      id: [B1]
+constraints:
+  - pocket:
+      binder: B1
+      contacts: [ [ A1, 829 ], [ A1, 138 ] ]
+
diff --git a/forks/boltz/examples/prot.fasta b/forks/boltz/examples/prot.fasta
new file mode 100644
index 00000000..92a26192
--- /dev/null
+++ b/forks/boltz/examples/prot.fasta
@@ -0,0 +1,2 @@
+>A|protein|./examples/msa/seq2.a3m
+QLEDSEVEAVAKGLEEMYANGVTEDNFKNYVKNNFAQQEISSVEEELNVNISDSCVANKIKDEFFAMISISAIVKAAQKKAWKELAVTVLRFAKANGLKTNAIIVAGQLALWAVQCG
\ No newline at end of file
diff --git a/forks/boltz/examples/prot.yaml b/forks/boltz/examples/prot.yaml
new file mode 100644
index 00000000..20ae735e
--- /dev/null
+++ b/forks/boltz/examples/prot.yaml
@@ -0,0 +1,6 @@
+version: 1  # Optional, defaults to 1
+sequences:
+  - protein:
+      id: A
+      sequence: QLEDSEVEAVAKGLEEMYANGVTEDNFKNYVKNNFAQQEISSVEEELNVNISDSCVANKIKDEFFAMISISAIVKAAQKKAWKELAVTVLRFAKANGLKTNAIIVAGQLALWAVQCG
+
diff --git a/forks/boltz/examples/prot_custom_msa.yaml b/forks/boltz/examples/prot_custom_msa.yaml
new file mode 100644
index 00000000..5cde5ad2
--- /dev/null
+++ b/forks/boltz/examples/prot_custom_msa.yaml
@@ -0,0 +1,7 @@
+version: 1  # Optional, defaults to 1
+sequences:
+  - protein:
+      id: A
+      sequence: QLEDSEVEAVAKGLEEMYANGVTEDNFKNYVKNNFAQQEISSVEEELNVNISDSCVANKIKDEFFAMISISAIVKAAQKKAWKELAVTVLRFAKANGLKTNAIIVAGQLALWAVQCG
+      msa: ./examples/msa/seq2.a3m
+
diff --git a/forks/boltz/examples/prot_no_msa.yaml b/forks/boltz/examples/prot_no_msa.yaml
new file mode 100644
index 00000000..f9889b91
--- /dev/null
+++ b/forks/boltz/examples/prot_no_msa.yaml
@@ -0,0 +1,6 @@
+version: 1  # Optional, defaults to 1
+sequences:
+  - protein:
+      id: A
+      sequence: QLEDSEVEAVAKGLEEMYANGVTEDNFKNYVKNNFAQQEISSVEEELNVNISDSCVANKIKDEFFAMISISAIVKAAQKKAWKELAVTVLRFAKANGLKTNAIIVAGQLALWAVQCG
+      msa: empty
diff --git a/forks/boltz/pyproject.toml b/forks/boltz/pyproject.toml
new file mode 100644
index 00000000..9e22f29e
--- /dev/null
+++ b/forks/boltz/pyproject.toml
@@ -0,0 +1,94 @@
+[build-system]
+requires = ["setuptools >= 61.0"]
+build-backend = "setuptools.build_meta"
+
+[project]
+name = "boltz"
+version = "2.2.0"
+requires-python = ">=3.10,<3.13"
+description = "Boltz"
+readme = "README.md"
+dependencies = [
+    "torch>=2.2",
+    "numpy>=1.26,<2.0",
+    "hydra-core==1.3.2",
+    "pytorch-lightning==2.5.0",
+    "rdkit>=2024.3.2",
+    "dm-tree==0.1.8",
+    "requests==2.32.3",
+    "pandas>=2.2.2",
+    "types-requests",
+    "einops==0.8.0",
+    "einx==0.3.0",
+    "fairscale==0.4.13",
+    "mashumaro==3.14",
+    "modelcif==1.2",
+    "wandb==0.18.7",
+    "click==8.1.7",
+    "pyyaml==6.0.2",
+    "biopython==1.84",
+    "scipy==1.13.1",
+    "numba==0.61.0",
+    "gemmi==0.6.5",
+    "scikit-learn==1.6.1",
+    "chembl_structure_pipeline==1.2.2",
+]
+
+[project.scripts]
+boltz = "boltz.main:cli"
+
+[project.optional-dependencies]
+lint = ["ruff"]
+test = ["pytest", "requests"]
+cuda = [
+    "cuequivariance_ops_cu12>=0.5.0",
+    "cuequivariance_ops_torch_cu12>=0.5.0",
+    "cuequivariance_torch>=0.5.0",
+]
+
+[tool.ruff]
+src = ["src"]
+extend-exclude = ["conf.py"]
+target-version = "py39"
+lint.select = ["ALL"]
+lint.ignore = [
+    "COM812",  # Conflicts with the formatter
+    "ISC001",  # Conflicts with the formatter
+    "ANN101",  # "missing-type-self"
+    "RET504",  # Unnecessary assignment to `x` before `return` statementRuff
+    "S101",    # Use of `assert` detected
+    "D100",    # Missing docstring in public module
+    "D104",    # Missing docstring in public package
+    "PT001",   # https://github.com/astral-sh/ruff/issues/8796#issuecomment-1825907715
+    "PT004",   # https://github.com/astral-sh/ruff/issues/8796#issuecomment-1825907715
+    "PT005",   # https://github.com/astral-sh/ruff/issues/8796#issuecomment-1825907715
+    "PT023",   # https://github.com/astral-sh/ruff/issues/8796#issuecomment-1825907715
+    "FBT001",
+    "FBT002",
+    "PLR0913", # Too many arguments to init (> 5)
+]
+
+[tool.ruff.lint.per-file-ignores]
+"**/__init__.py" = [
+    "F401", # Imported but unused
+    "F403", # Wildcard imports
+]
+"docs/**" = [
+    "INP001", # Requires __init__.py but folder is not a package.
+]
+"scripts/**" = [
+    "INP001", # Requires __init__.py but folder is not a package.
+]
+
+[tool.ruff.lint.pyupgrade]
+# Preserve types, even if a file imports `from __future__ import annotations`(https://github.com/astral-sh/ruff/issues/5434)
+keep-runtime-typing = true
+
+[tool.ruff.lint.pydocstyle]
+convention = "numpy"
+
+[tool.pytest.ini_options]
+markers = [
+    "slow: marks tests as slow (deselect with '-m \"not slow\"')",
+    "regression",
+]
diff --git a/forks/boltz/scripts/eval/aggregate_evals.py b/forks/boltz/scripts/eval/aggregate_evals.py
new file mode 100644
index 00000000..81ea980c
--- /dev/null
+++ b/forks/boltz/scripts/eval/aggregate_evals.py
@@ -0,0 +1,753 @@
+import json
+from pathlib import Path
+
+import matplotlib.pyplot as plt
+import numpy as np
+import pandas as pd
+from tqdm import tqdm
+
+METRICS = ["lddt", "bb_lddt", "tm_score", "rmsd"]
+
+
+def compute_af3_metrics(preds, evals, name):
+    metrics = {}
+
+    top_model = None
+    top_confidence = -1000
+    for model_id in range(5):
+        # Load confidence file
+        confidence_file = (
+            Path(preds) / f"seed-1_sample-{model_id}" / "summary_confidences.json"
+        )
+        with confidence_file.open("r") as f:
+            confidence_data = json.load(f)
+            confidence = confidence_data["ranking_score"]
+            if confidence > top_confidence:
+                top_model = model_id
+                top_confidence = confidence
+
+        # Load eval file
+        eval_file = Path(evals) / f"{name}_model_{model_id}.json"
+        with eval_file.open("r") as f:
+            eval_data = json.load(f)
+            for metric_name in METRICS:
+                if metric_name in eval_data:
+                    metrics.setdefault(metric_name, []).append(eval_data[metric_name])
+
+            if "dockq" in eval_data and eval_data["dockq"] is not None:
+                metrics.setdefault("dockq_>0.23", []).append(
+                    np.mean(
+                        [float(v > 0.23) for v in eval_data["dockq"] if v is not None]
+                    )
+                )
+                metrics.setdefault("dockq_>0.49", []).append(
+                    np.mean(
+                        [float(v > 0.49) for v in eval_data["dockq"] if v is not None]
+                    )
+                )
+                metrics.setdefault("len_dockq_", []).append(
+                    len([v for v in eval_data["dockq"] if v is not None])
+                )
+
+        eval_file = Path(evals) / f"{name}_model_{model_id}_ligand.json"
+        with eval_file.open("r") as f:
+            eval_data = json.load(f)
+            if "lddt_pli" in eval_data:
+                lddt_plis = [
+                    x["score"] for x in eval_data["lddt_pli"]["assigned_scores"]
+                ]
+                for _ in eval_data["lddt_pli"][
+                    "model_ligand_unassigned_reason"
+                ].items():
+                    lddt_plis.append(0)
+                if not lddt_plis:
+                    continue
+                lddt_pli = np.mean([x for x in lddt_plis])
+                metrics.setdefault("lddt_pli", []).append(lddt_pli)
+                metrics.setdefault("len_lddt_pli", []).append(len(lddt_plis))
+
+            if "rmsd" in eval_data:
+                rmsds = [x["score"] for x in eval_data["rmsd"]["assigned_scores"]]
+                for _ in eval_data["rmsd"]["model_ligand_unassigned_reason"].items():
+                    rmsds.append(100)
+                if not rmsds:
+                    continue
+                rmsd2 = np.mean([x < 2.0 for x in rmsds])
+                rmsd5 = np.mean([x < 5.0 for x in rmsds])
+                metrics.setdefault("rmsd<2", []).append(rmsd2)
+                metrics.setdefault("rmsd<5", []).append(rmsd5)
+                metrics.setdefault("len_rmsd", []).append(len(rmsds))
+
+    # Get oracle
+    oracle = {k: min(v) if k == "rmsd" else max(v) for k, v in metrics.items()}
+    avg = {k: sum(v) / len(v) for k, v in metrics.items()}
+    top1 = {k: v[top_model] for k, v in metrics.items()}
+
+    results = {}
+    for metric_name in metrics:
+        if metric_name.startswith("len_"):
+            continue
+        if metric_name == "lddt_pli":
+            l = metrics["len_lddt_pli"][0]
+        elif metric_name == "rmsd<2" or metric_name == "rmsd<5":
+            l = metrics["len_rmsd"][0]
+        elif metric_name == "dockq_>0.23" or metric_name == "dockq_>0.49":
+            l = metrics["len_dockq_"][0]
+        else:
+            l = 1
+        results[metric_name] = {
+            "oracle": oracle[metric_name],
+            "average": avg[metric_name],
+            "top1": top1[metric_name],
+            "len": l,
+        }
+
+    return results
+
+
+def compute_chai_metrics(preds, evals, name):
+    metrics = {}
+
+    top_model = None
+    top_confidence = 0
+    for model_id in range(5):
+        # Load confidence file
+        confidence_file = Path(preds) / f"scores.model_idx_{model_id}.npz"
+        confidence_data = np.load(confidence_file)
+        confidence = confidence_data["aggregate_score"].item()
+        if confidence > top_confidence:
+            top_model = model_id
+            top_confidence = confidence
+
+        # Load eval file
+        eval_file = Path(evals) / f"{name}_model_{model_id}.json"
+        with eval_file.open("r") as f:
+            eval_data = json.load(f)
+            for metric_name in METRICS:
+                if metric_name in eval_data:
+                    metrics.setdefault(metric_name, []).append(eval_data[metric_name])
+
+            if "dockq" in eval_data and eval_data["dockq"] is not None:
+                metrics.setdefault("dockq_>0.23", []).append(
+                    np.mean(
+                        [float(v > 0.23) for v in eval_data["dockq"] if v is not None]
+                    )
+                )
+                metrics.setdefault("dockq_>0.49", []).append(
+                    np.mean(
+                        [float(v > 0.49) for v in eval_data["dockq"] if v is not None]
+                    )
+                )
+                metrics.setdefault("len_dockq_", []).append(
+                    len([v for v in eval_data["dockq"] if v is not None])
+                )
+
+        eval_file = Path(evals) / f"{name}_model_{model_id}_ligand.json"
+        with eval_file.open("r") as f:
+            eval_data = json.load(f)
+            if "lddt_pli" in eval_data:
+                lddt_plis = [
+                    x["score"] for x in eval_data["lddt_pli"]["assigned_scores"]
+                ]
+                for _ in eval_data["lddt_pli"][
+                    "model_ligand_unassigned_reason"
+                ].items():
+                    lddt_plis.append(0)
+                if not lddt_plis:
+                    continue
+                lddt_pli = np.mean([x for x in lddt_plis])
+                metrics.setdefault("lddt_pli", []).append(lddt_pli)
+                metrics.setdefault("len_lddt_pli", []).append(len(lddt_plis))
+
+            if "rmsd" in eval_data:
+                rmsds = [x["score"] for x in eval_data["rmsd"]["assigned_scores"]]
+                for _ in eval_data["rmsd"]["model_ligand_unassigned_reason"].items():
+                    rmsds.append(100)
+                if not rmsds:
+                    continue
+                rmsd2 = np.mean([x < 2.0 for x in rmsds])
+                rmsd5 = np.mean([x < 5.0 for x in rmsds])
+                metrics.setdefault("rmsd<2", []).append(rmsd2)
+                metrics.setdefault("rmsd<5", []).append(rmsd5)
+                metrics.setdefault("len_rmsd", []).append(len(rmsds))
+
+    # Get oracle
+    oracle = {k: min(v) if k == "rmsd" else max(v) for k, v in metrics.items()}
+    avg = {k: sum(v) / len(v) for k, v in metrics.items()}
+    top1 = {k: v[top_model] for k, v in metrics.items()}
+
+    results = {}
+    for metric_name in metrics:
+        if metric_name.startswith("len_"):
+            continue
+        if metric_name == "lddt_pli":
+            l = metrics["len_lddt_pli"][0]
+        elif metric_name == "rmsd<2" or metric_name == "rmsd<5":
+            l = metrics["len_rmsd"][0]
+        elif metric_name == "dockq_>0.23" or metric_name == "dockq_>0.49":
+            l = metrics["len_dockq_"][0]
+        else:
+            l = 1
+        results[metric_name] = {
+            "oracle": oracle[metric_name],
+            "average": avg[metric_name],
+            "top1": top1[metric_name],
+            "len": l,
+        }
+
+    return results
+
+
+def compute_boltz_metrics(preds, evals, name):
+    metrics = {}
+
+    top_model = None
+    top_confidence = 0
+    for model_id in range(5):
+        # Load confidence file
+        confidence_file = (
+            Path(preds) / f"confidence_{Path(preds).name}_model_{model_id}.json"
+        )
+        with confidence_file.open("r") as f:
+            confidence_data = json.load(f)
+            confidence = confidence_data["confidence_score"]
+            if confidence > top_confidence:
+                top_model = model_id
+                top_confidence = confidence
+
+        # Load eval file
+        eval_file = Path(evals) / f"{name}_model_{model_id}.json"
+        with eval_file.open("r") as f:
+            eval_data = json.load(f)
+            for metric_name in METRICS:
+                if metric_name in eval_data:
+                    metrics.setdefault(metric_name, []).append(eval_data[metric_name])
+
+            if "dockq" in eval_data and eval_data["dockq"] is not None:
+                metrics.setdefault("dockq_>0.23", []).append(
+                    np.mean(
+                        [float(v > 0.23) for v in eval_data["dockq"] if v is not None]
+                    )
+                )
+                metrics.setdefault("dockq_>0.49", []).append(
+                    np.mean(
+                        [float(v > 0.49) for v in eval_data["dockq"] if v is not None]
+                    )
+                )
+                metrics.setdefault("len_dockq_", []).append(
+                    len([v for v in eval_data["dockq"] if v is not None])
+                )
+
+        eval_file = Path(evals) / f"{name}_model_{model_id}_ligand.json"
+        with eval_file.open("r") as f:
+            eval_data = json.load(f)
+            if "lddt_pli" in eval_data:
+                lddt_plis = [
+                    x["score"] for x in eval_data["lddt_pli"]["assigned_scores"]
+                ]
+                for _ in eval_data["lddt_pli"][
+                    "model_ligand_unassigned_reason"
+                ].items():
+                    lddt_plis.append(0)
+                if not lddt_plis:
+                    continue
+                lddt_pli = np.mean([x for x in lddt_plis])
+                metrics.setdefault("lddt_pli", []).append(lddt_pli)
+                metrics.setdefault("len_lddt_pli", []).append(len(lddt_plis))
+
+            if "rmsd" in eval_data:
+                rmsds = [x["score"] for x in eval_data["rmsd"]["assigned_scores"]]
+                for _ in eval_data["rmsd"]["model_ligand_unassigned_reason"].items():
+                    rmsds.append(100)
+                if not rmsds:
+                    continue
+                rmsd2 = np.mean([x < 2.0 for x in rmsds])
+                rmsd5 = np.mean([x < 5.0 for x in rmsds])
+                metrics.setdefault("rmsd<2", []).append(rmsd2)
+                metrics.setdefault("rmsd<5", []).append(rmsd5)
+                metrics.setdefault("len_rmsd", []).append(len(rmsds))
+
+    # Get oracle
+    oracle = {k: min(v) if k == "rmsd" else max(v) for k, v in metrics.items()}
+    avg = {k: sum(v) / len(v) for k, v in metrics.items()}
+    top1 = {k: v[top_model] for k, v in metrics.items()}
+
+    results = {}
+    for metric_name in metrics:
+        if metric_name.startswith("len_"):
+            continue
+        if metric_name == "lddt_pli":
+            l = metrics["len_lddt_pli"][0]
+        elif metric_name == "rmsd<2" or metric_name == "rmsd<5":
+            l = metrics["len_rmsd"][0]
+        elif metric_name == "dockq_>0.23" or metric_name == "dockq_>0.49":
+            l = metrics["len_dockq_"][0]
+        else:
+            l = 1
+        results[metric_name] = {
+            "oracle": oracle[metric_name],
+            "average": avg[metric_name],
+            "top1": top1[metric_name],
+            "len": l,
+        }
+
+    return results
+
+
+def eval_models(
+    chai_preds,
+    chai_evals,
+    af3_preds,
+    af3_evals,
+    boltz_preds,
+    boltz_evals,
+    boltz_preds_x,
+    boltz_evals_x,
+):
+    # Load preds and make sure we have predictions for all models
+    chai_preds_names = {
+        x.name.lower(): x
+        for x in Path(chai_preds).iterdir()
+        if not x.name.lower().startswith(".")
+    }
+    af3_preds_names = {
+        x.name.lower(): x
+        for x in Path(af3_preds).iterdir()
+        if not x.name.lower().startswith(".")
+    }
+    boltz_preds_names = {
+        x.name.lower(): x
+        for x in Path(boltz_preds).iterdir()
+        if not x.name.lower().startswith(".")
+    }
+    boltz_preds_names_x = {
+        x.name.lower(): x
+        for x in Path(boltz_preds_x).iterdir()
+        if not x.name.lower().startswith(".")
+    }
+
+    print("Chai preds", len(chai_preds_names))
+    print("Af3 preds", len(af3_preds_names))
+    print("Boltz preds", len(boltz_preds_names))
+    print("Boltzx preds", len(boltz_preds_names_x))
+
+    common = (
+        set(chai_preds_names.keys())
+        & set(af3_preds_names.keys())
+        & set(boltz_preds_names.keys())
+        & set(boltz_preds_names_x.keys())
+    )
+
+    # Remove examples in the validation set
+    keys_to_remove = ["t1133", "h1134", "r1134s1", "t1134s2", "t1121", "t1123", "t1159"]
+    for key in keys_to_remove:
+        if key in common:
+            common.remove(key)
+    print("Common", len(common))
+
+    # Create a dataframe with the following schema:
+    # tool, name, metric, oracle, average, top1
+    results = []
+    for name in tqdm(common):
+        try:
+            af3_results = compute_af3_metrics(
+                af3_preds_names[name],
+                af3_evals,
+                name,
+            )
+
+        except Exception as e:
+            import traceback
+
+            traceback.print_exc()
+            print(f"Error evaluating AF3 {name}: {e}")
+            continue
+        try:
+            chai_results = compute_chai_metrics(
+                chai_preds_names[name],
+                chai_evals,
+                name,
+            )
+        except Exception as e:
+            import traceback
+
+            traceback.print_exc()
+            print(f"Error evaluating Chai {name}: {e}")
+            continue
+        try:
+            boltz_results = compute_boltz_metrics(
+                boltz_preds_names[name],
+                boltz_evals,
+                name,
+            )
+        except Exception as e:
+            import traceback
+
+            traceback.print_exc()
+            print(f"Error evaluating Boltz {name}: {e}")
+            continue
+
+        try:
+            boltz_results_x = compute_boltz_metrics(
+                boltz_preds_names_x[name],
+                boltz_evals_x,
+                name,
+            )
+        except Exception as e:
+            import traceback
+
+            traceback.print_exc()
+            print(f"Error evaluating Boltzx {name}: {e}")
+            continue
+
+        for metric_name in af3_results:
+            if metric_name in chai_results and metric_name in boltz_results:
+                if (
+                    (
+                        af3_results[metric_name]["len"]
+                        == chai_results[metric_name]["len"]
+                    )
+                    and (
+                        af3_results[metric_name]["len"]
+                        == boltz_results[metric_name]["len"]
+                    )
+                    and (
+                        af3_results[metric_name]["len"]
+                        == boltz_results_x[metric_name]["len"]
+                    )
+                ):
+                    results.append(
+                        {
+                            "tool": "AF3 oracle",
+                            "target": name,
+                            "metric": metric_name,
+                            "value": af3_results[metric_name]["oracle"],
+                        }
+                    )
+                    results.append(
+                        {
+                            "tool": "AF3 top-1",
+                            "target": name,
+                            "metric": metric_name,
+                            "value": af3_results[metric_name]["top1"],
+                        }
+                    )
+                    results.append(
+                        {
+                            "tool": "Chai-1 oracle",
+                            "target": name,
+                            "metric": metric_name,
+                            "value": chai_results[metric_name]["oracle"],
+                        }
+                    )
+                    results.append(
+                        {
+                            "tool": "Chai-1 top-1",
+                            "target": name,
+                            "metric": metric_name,
+                            "value": chai_results[metric_name]["top1"],
+                        }
+                    )
+                    results.append(
+                        {
+                            "tool": "Boltz-1 oracle",
+                            "target": name,
+                            "metric": metric_name,
+                            "value": boltz_results[metric_name]["oracle"],
+                        }
+                    )
+                    results.append(
+                        {
+                            "tool": "Boltz-1 top-1",
+                            "target": name,
+                            "metric": metric_name,
+                            "value": boltz_results[metric_name]["top1"],
+                        }
+                    )
+                    results.append(
+                        {
+                            "tool": "Boltz-1x oracle",
+                            "target": name,
+                            "metric": metric_name,
+                            "value": boltz_results_x[metric_name]["oracle"],
+                        }
+                    )
+                    results.append(
+                        {
+                            "tool": "Boltz-1x top-1",
+                            "target": name,
+                            "metric": metric_name,
+                            "value": boltz_results_x[metric_name]["top1"],
+                        }
+                    )
+                else:
+                    print(
+                        "Different lengths",
+                        name,
+                        metric_name,
+                        af3_results[metric_name]["len"],
+                        chai_results[metric_name]["len"],
+                        boltz_results[metric_name]["len"],
+                        boltz_results_x[metric_name]["len"],
+                    )
+            else:
+                print(
+                    "Missing metric",
+                    name,
+                    metric_name,
+                    metric_name in chai_results,
+                    metric_name in boltz_results,
+                    metric_name in boltz_results_x,
+                )
+
+    # Write the results to a file, ensure we only keep the target & metrics where we have all tools
+    df = pd.DataFrame(results)
+    return df
+
+
+def eval_validity_checks(df):
+    # Filter the dataframe to only include the targets in the validity checks
+    name_mapping = {
+        "af3": "AF3 top-1",
+        "chai": "Chai-1 top-1",
+        "boltz1": "Boltz-1 top-1",
+        "boltz1x": "Boltz-1x top-1",
+    }
+    top1 = df[df["model_idx"] == 0]
+    top1 = top1[["tool", "pdb_id", "valid"]]
+    top1["tool"] = top1["tool"].apply(lambda x: name_mapping[x])
+    top1 = top1.rename(columns={"tool": "tool", "pdb_id": "target", "valid": "value"})
+    top1["metric"] = "physical validity"
+    top1["target"] = top1["target"].apply(lambda x: x.lower())
+    top1 = top1[["tool", "target", "metric", "value"]]
+
+    name_mapping = {
+        "af3": "AF3 oracle",
+        "chai": "Chai-1 oracle",
+        "boltz1": "Boltz-1 oracle",
+        "boltz1x": "Boltz-1x oracle",
+    }
+    oracle = df[["tool", "model_idx", "pdb_id", "valid"]]
+    oracle = oracle.groupby(["tool", "pdb_id"])["valid"].max().reset_index()
+    oracle = oracle.rename(
+        columns={"tool": "tool", "pdb_id": "target", "valid": "value"}
+    )
+    oracle["tool"] = oracle["tool"].apply(lambda x: name_mapping[x])
+    oracle["metric"] = "physical validity"
+    oracle = oracle[["tool", "target", "metric", "value"]]
+    oracle["target"] = oracle["target"].apply(lambda x: x.lower())
+    out = pd.concat([top1, oracle])
+    return out
+
+
+def bootstrap_ci(series, n_boot=1000, alpha=0.05):
+    """
+    Compute 95% bootstrap confidence intervals for the mean of 'series'.
+    """
+    n = len(series)
+    boot_means = []
+    # Perform bootstrap resampling
+    for _ in range(n_boot):
+        sample = series.sample(n, replace=True)
+        boot_means.append(sample.mean())
+
+    boot_means = np.array(boot_means)
+    mean_val = np.mean(series)
+    lower = np.percentile(boot_means, 100 * alpha / 2)
+    upper = np.percentile(boot_means, 100 * (1 - alpha / 2))
+    return mean_val, lower, upper
+
+
+def plot_data(desired_tools, desired_metrics, df, dataset, filename):
+    filtered_df = df[
+        df["tool"].isin(desired_tools) & df["metric"].isin(desired_metrics)
+    ]
+
+    # Apply bootstrap to each (tool, metric) group
+    boot_stats = filtered_df.groupby(["tool", "metric"])["value"].apply(bootstrap_ci)
+
+    # boot_stats is a Series of tuples (mean, lower, upper). Convert to DataFrame:
+    boot_stats = boot_stats.apply(pd.Series)
+    boot_stats.columns = ["mean", "lower", "upper"]
+
+    # Unstack to get a DataFrame suitable for plotting
+    plot_data = boot_stats["mean"].unstack("tool")
+    plot_data = plot_data.reindex(desired_metrics)
+
+    lower_data = boot_stats["lower"].unstack("tool")
+    lower_data = lower_data.reindex(desired_metrics)
+
+    upper_data = boot_stats["upper"].unstack("tool")
+    upper_data = upper_data.reindex(desired_metrics)
+
+    # If you need a specific order of tools:
+    tool_order = [
+        "AF3 oracle",
+        "AF3 top-1",
+        "Chai-1 oracle",
+        "Chai-1 top-1",
+        "Boltz-1 oracle",
+        "Boltz-1 top-1",
+        "Boltz-1x oracle",
+        "Boltz-1x top-1",
+    ]
+    plot_data = plot_data[tool_order]
+    lower_data = lower_data[tool_order]
+    upper_data = upper_data[tool_order]
+
+    # Rename metrics
+    renaming = {
+        "lddt_pli": "Mean LDDT-PLI",
+        "rmsd<2": "L-RMSD < 2A",
+        "lddt": "Mean LDDT",
+        "dockq_>0.23": "DockQ > 0.23",
+        "physical validity": "Physical Validity",
+    }
+    plot_data = plot_data.rename(index=renaming)
+    lower_data = lower_data.rename(index=renaming)
+    upper_data = upper_data.rename(index=renaming)
+    mean_vals = plot_data.values
+
+    # Colors
+    tool_colors = [
+        "#994C00",  # AF3 oracle
+        "#FFB55A",  # AF3 top-1
+        "#931652",  # Chai-1 oracle
+        "#FC8AD9",  # Chai-1 top-1
+        "#188F52",  # Boltz-1 oracle
+        "#86E935",  # Boltz-1 top-1
+        "#004D80",  # Boltz-1x oracle
+        "#55C2FF",  # Boltz-1x top-1
+    ]
+
+    fig, ax = plt.subplots(figsize=(10, 5))
+
+    x = np.arange(len(plot_data.index))
+    bar_spacing = 0.015
+    total_width = 0.7
+    # Adjust width to account for the spacing
+    width = (total_width - (len(tool_order) - 1) * bar_spacing) / len(tool_order)
+
+    for i, tool in enumerate(tool_order):
+        # Each subsequent bar moves over by width + bar_spacing
+        offsets = x - (total_width - width) / 2 + i * (width + bar_spacing)
+        # Extract the means and errors for this tool
+        tool_means = plot_data[tool].values
+        tool_yerr_lower = mean_vals[:, i] - lower_data.values[:, i]
+        tool_yerr_upper = upper_data.values[:, i] - mean_vals[:, i]
+        # Construct yerr array specifically for this tool
+        tool_yerr = np.vstack([tool_yerr_lower, tool_yerr_upper])
+
+        ax.bar(
+            offsets,
+            tool_means,
+            width=width,
+            color=tool_colors[i],
+            label=tool,
+            yerr=tool_yerr,
+            capsize=2,
+            error_kw={"elinewidth": 0.75},
+        )
+
+    ax.set_xticks(x)
+    ax.set_xticklabels(plot_data.index, rotation=0)
+    ax.set_ylabel("Value")
+    ax.set_title(f"Performances on {dataset} with 95% CI (Bootstrap)")
+
+    plt.tight_layout()
+    ax.legend(loc="lower center", bbox_to_anchor=(0.5, 0.85), ncols=4, frameon=False)
+
+    plt.savefig(filename)
+    plt.show()
+
+
+def main():
+    eval_folder = "../../boltz_results_final/"
+    output_folder = "../../boltz_results_final/"
+
+    # Eval the test set
+    chai_preds = eval_folder + "outputs/test/chai"
+    chai_evals = eval_folder + "evals/test/chai"
+
+    af3_preds = eval_folder + "outputs/test/af3"
+    af3_evals = eval_folder + "evals/test/af3"
+
+    boltz_preds = eval_folder + "outputs/test/boltz/predictions"
+    boltz_evals = eval_folder + "evals/test/boltz"
+
+    boltz_preds_x = eval_folder + "outputs/test/boltzx/predictions"
+    boltz_evals_x = eval_folder + "evals/test/boltzx"
+
+    validity_checks = eval_folder + "physical_checks_test.csv"
+
+    df_validity_checks = pd.read_csv(validity_checks)
+    df_validity_checks = eval_validity_checks(df_validity_checks)
+
+    df = eval_models(
+        chai_preds,
+        chai_evals,
+        af3_preds,
+        af3_evals,
+        boltz_preds,
+        boltz_evals,
+        boltz_preds_x,
+        boltz_evals_x,
+    )
+
+    df = pd.concat([df, df_validity_checks]).reset_index(drop=True)
+    df.to_csv(output_folder + "results_test.csv", index=False)
+
+    desired_tools = [
+        "AF3 oracle",
+        "AF3 top-1",
+        "Chai-1 oracle",
+        "Chai-1 top-1",
+        "Boltz-1 oracle",
+        "Boltz-1 top-1",
+        "Boltz-1x oracle",
+        "Boltz-1x top-1",
+    ]
+    desired_metrics = ["lddt", "dockq_>0.23", "lddt_pli", "rmsd<2", "physical validity"]
+    plot_data(
+        desired_tools, desired_metrics, df, "PDB Test", output_folder + "plot_test.pdf"
+    )
+
+    # Eval CASP
+    chai_preds = eval_folder + "outputs/casp15/chai"
+    chai_evals = eval_folder + "evals/casp15/chai"
+
+    af3_preds = eval_folder + "outputs/casp15/af3"
+    af3_evals = eval_folder + "evals/casp15/af3"
+
+    boltz_preds = eval_folder + "outputs/casp15/boltz/predictions"
+    boltz_evals = eval_folder + "evals/casp15/boltz"
+
+    boltz_preds_x = eval_folder + "outputs/casp15/boltzx/predictions"
+    boltz_evals_x = eval_folder + "evals/casp15/boltzx"
+
+    validity_checks = eval_folder + "physical_checks_casp.csv"
+
+    df_validity_checks = pd.read_csv(validity_checks)
+    df_validity_checks = eval_validity_checks(df_validity_checks)
+
+    df = eval_models(
+        chai_preds,
+        chai_evals,
+        af3_preds,
+        af3_evals,
+        boltz_preds,
+        boltz_evals,
+        boltz_preds_x,
+        boltz_evals_x,
+    )
+
+    df = pd.concat([df, df_validity_checks]).reset_index(drop=True)
+    df.to_csv(output_folder + "results_casp.csv", index=False)
+
+    plot_data(
+        desired_tools, desired_metrics, df, "CASP15", output_folder + "plot_casp.pdf"
+    )
+
+
+if __name__ == "__main__":
+    main()
diff --git a/forks/boltz/scripts/eval/physcialsim_metrics.py b/forks/boltz/scripts/eval/physcialsim_metrics.py
new file mode 100644
index 00000000..8a6f7c7d
--- /dev/null
+++ b/forks/boltz/scripts/eval/physcialsim_metrics.py
@@ -0,0 +1,304 @@
+import os
+import pickle
+
+import numpy as np
+import torch
+from pathlib import Path
+from tqdm import tqdm
+import pandas as pd
+from boltz.data.mol import load_molecules
+from boltz.data import const
+from boltz.data.parse.mmcif_with_constraints import parse_mmcif
+from multiprocessing import Pool
+
+
+def compute_torsion_angles(coords, torsion_index):
+    r_ij = coords[..., torsion_index[0], :] - coords[..., torsion_index[1], :]
+    r_kj = coords[..., torsion_index[2], :] - coords[..., torsion_index[1], :]
+    r_kl = coords[..., torsion_index[2], :] - coords[..., torsion_index[3], :]
+    n_ijk = np.cross(r_ij, r_kj, axis=-1)
+    n_jkl = np.cross(r_kj, r_kl, axis=-1)
+    r_kj_norm = np.linalg.norm(r_kj, axis=-1)
+    n_ijk_norm = np.linalg.norm(n_ijk, axis=-1)
+    n_jkl_norm = np.linalg.norm(n_jkl, axis=-1)
+    sign_phi = np.sign(
+        r_kj[..., None, :] @ np.cross(n_ijk, n_jkl, axis=-1)[..., None]
+    ).squeeze(axis=(-1, -2))
+    phi = sign_phi * np.arccos(
+        np.clip(
+            (n_ijk[..., None, :] @ n_jkl[..., None]).squeeze(axis=(-1, -2))
+            / (n_ijk_norm * n_jkl_norm),
+            -1 + 1e-8,
+            1 - 1e-8,
+        )
+    )
+    return phi
+
+
+def check_ligand_distance_geometry(
+    structure, constraints, bond_buffer=0.25, angle_buffer=0.25, clash_buffer=0.2
+):
+    coords = structure.coords["coords"]
+    rdkit_bounds_constraints = constraints.rdkit_bounds_constraints
+    pair_index = rdkit_bounds_constraints["atom_idxs"].copy().astype(np.int64).T
+    bond_mask = rdkit_bounds_constraints["is_bond"].copy().astype(bool)
+    angle_mask = rdkit_bounds_constraints["is_angle"].copy().astype(bool)
+    upper_bounds = rdkit_bounds_constraints["upper_bound"].copy().astype(np.float32)
+    lower_bounds = rdkit_bounds_constraints["lower_bound"].copy().astype(np.float32)
+    dists = np.linalg.norm(coords[pair_index[0]] - coords[pair_index[1]], axis=-1)
+    bond_length_violations = (
+        dists[bond_mask] <= lower_bounds[bond_mask] * (1.0 - bond_buffer)
+    ) + (dists[bond_mask] >= upper_bounds[bond_mask] * (1.0 + bond_buffer))
+    bond_angle_violations = (
+        dists[angle_mask] <= lower_bounds[angle_mask] * (1.0 - angle_buffer)
+    ) + (dists[angle_mask] >= upper_bounds[angle_mask] * (1.0 + angle_buffer))
+    internal_clash_violations = dists[~bond_mask * ~angle_mask] <= lower_bounds[
+        ~bond_mask * ~angle_mask
+    ] * (1.0 - clash_buffer)
+    num_ligands = sum(
+        [
+            int(const.chain_types[chain["mol_type"]] == "NONPOLYMER")
+            for chain in structure.chains
+        ]
+    )
+    return {
+        "num_ligands": num_ligands,
+        "num_bond_length_violations": bond_length_violations.sum(),
+        "num_bonds": bond_mask.sum(),
+        "num_bond_angle_violations": bond_angle_violations.sum(),
+        "num_angles": angle_mask.sum(),
+        "num_internal_clash_violations": internal_clash_violations.sum(),
+        "num_non_neighbors": (~bond_mask * ~angle_mask).sum(),
+    }
+
+
+def check_ligand_stereochemistry(structure, constraints):
+    coords = structure.coords["coords"]
+    chiral_atom_constraints = constraints.chiral_atom_constraints
+    stereo_bond_constraints = constraints.stereo_bond_constraints
+
+    chiral_atom_index = chiral_atom_constraints["atom_idxs"].T
+    true_chiral_atom_orientations = chiral_atom_constraints["is_r"]
+    chiral_atom_ref_mask = chiral_atom_constraints["is_reference"]
+    chiral_atom_index = chiral_atom_index[:, chiral_atom_ref_mask]
+    true_chiral_atom_orientations = true_chiral_atom_orientations[chiral_atom_ref_mask]
+    pred_chiral_atom_orientations = (
+        compute_torsion_angles(coords, chiral_atom_index) > 0
+    )
+    chiral_atom_violations = (
+        pred_chiral_atom_orientations != true_chiral_atom_orientations
+    )
+
+    stereo_bond_index = stereo_bond_constraints["atom_idxs"].T
+    true_stereo_bond_orientations = stereo_bond_constraints["is_e"]
+    stereo_bond_ref_mask = stereo_bond_constraints["is_reference"]
+    stereo_bond_index = stereo_bond_index[:, stereo_bond_ref_mask]
+    true_stereo_bond_orientations = true_stereo_bond_orientations[stereo_bond_ref_mask]
+    pred_stereo_bond_orientations = (
+        np.abs(compute_torsion_angles(coords, stereo_bond_index)) > np.pi / 2
+    )
+    stereo_bond_violations = (
+        pred_stereo_bond_orientations != true_stereo_bond_orientations
+    )
+
+    return {
+        "num_chiral_atom_violations": chiral_atom_violations.sum(),
+        "num_chiral_atoms": chiral_atom_index.shape[1],
+        "num_stereo_bond_violations": stereo_bond_violations.sum(),
+        "num_stereo_bonds": stereo_bond_index.shape[1],
+    }
+
+
+def check_ligand_flatness(structure, constraints, buffer=0.25):
+    coords = structure.coords["coords"]
+
+    planar_ring_5_index = constraints.planar_ring_5_constraints["atom_idxs"]
+    ring_5_coords = coords[planar_ring_5_index, :]
+    centered_ring_5_coords = ring_5_coords - ring_5_coords.mean(axis=-2, keepdims=True)
+    ring_5_vecs = np.linalg.svd(centered_ring_5_coords)[2][..., -1, :, None]
+    ring_5_dists = np.abs((centered_ring_5_coords @ ring_5_vecs).squeeze(axis=-1))
+    ring_5_violations = np.all(ring_5_dists <= buffer, axis=-1)
+
+    planar_ring_6_index = constraints.planar_ring_6_constraints["atom_idxs"]
+    ring_6_coords = coords[planar_ring_6_index, :]
+    centered_ring_6_coords = ring_6_coords - ring_6_coords.mean(axis=-2, keepdims=True)
+    ring_6_vecs = np.linalg.svd(centered_ring_6_coords)[2][..., -1, :, None]
+    ring_6_dists = np.abs((centered_ring_6_coords @ ring_6_vecs)).squeeze(axis=-1)
+    ring_6_violations = np.any(ring_6_dists >= buffer, axis=-1)
+
+    planar_bond_index = constraints.planar_bond_constraints["atom_idxs"]
+    bond_coords = coords[planar_bond_index, :]
+    centered_bond_coords = bond_coords - bond_coords.mean(axis=-2, keepdims=True)
+    bond_vecs = np.linalg.svd(centered_bond_coords)[2][..., -1, :, None]
+    bond_dists = np.abs((centered_bond_coords @ bond_vecs)).squeeze(axis=-1)
+    bond_violations = np.any(bond_dists >= buffer, axis=-1)
+
+    return {
+        "num_planar_5_ring_violations": ring_5_violations.sum(),
+        "num_planar_5_rings": ring_5_violations.shape[0],
+        "num_planar_6_ring_violations": ring_6_violations.sum(),
+        "num_planar_6_rings": ring_6_violations.shape[0],
+        "num_planar_double_bond_violations": bond_violations.sum(),
+        "num_planar_double_bonds": bond_violations.shape[0],
+    }
+
+
+def check_steric_clash(structure, molecules, buffer=0.25):
+    result = {}
+    for type_i in const.chain_types:
+        out_type_i = type_i.lower()
+        out_type_i = out_type_i if out_type_i != "nonpolymer" else "ligand"
+        result[f"num_chain_pairs_sym_{out_type_i}"] = 0
+        result[f"num_chain_clashes_sym_{out_type_i}"] = 0
+        for type_j in const.chain_types:
+            out_type_j = type_j.lower()
+            out_type_j = out_type_j if out_type_j != "nonpolymer" else "ligand"
+            result[f"num_chain_pairs_asym_{out_type_i}_{out_type_j}"] = 0
+            result[f"num_chain_clashes_asym_{out_type_i}_{out_type_j}"] = 0
+
+    connected_chains = set()
+    for bond in structure.bonds:
+        if bond["chain_1"] != bond["chain_2"]:
+            connected_chains.add(tuple(sorted((bond["chain_1"], bond["chain_2"]))))
+
+    vdw_radii = []
+    for res in structure.residues:
+        mol = molecules[res["name"]]
+        token_atoms = structure.atoms[
+            res["atom_idx"] : res["atom_idx"] + res["atom_num"]
+        ]
+        atom_name_to_ref = {a.GetProp("name"): a for a in mol.GetAtoms()}
+        token_atoms_ref = [atom_name_to_ref[a["name"]] for a in token_atoms]
+        vdw_radii.extend(
+            [const.vdw_radii[a.GetAtomicNum() - 1] for a in token_atoms_ref]
+        )
+    vdw_radii = np.array(vdw_radii, dtype=np.float32)
+
+    np.array([a.GetAtomicNum() for a in token_atoms_ref])
+    for i, chain_i in enumerate(structure.chains):
+        for j, chain_j in enumerate(structure.chains):
+            if (
+                chain_i["atom_num"] == 1
+                or chain_j["atom_num"] == 1
+                or j <= i
+                or (i, j) in connected_chains
+            ):
+                continue
+            coords_i = structure.coords["coords"][
+                chain_i["atom_idx"] : chain_i["atom_idx"] + chain_i["atom_num"]
+            ]
+            coords_j = structure.coords["coords"][
+                chain_j["atom_idx"] : chain_j["atom_idx"] + chain_j["atom_num"]
+            ]
+            dists = np.linalg.norm(coords_i[:, None, :] - coords_j[None, :, :], axis=-1)
+            radii_i = vdw_radii[
+                chain_i["atom_idx"] : chain_i["atom_idx"] + chain_i["atom_num"]
+            ]
+            radii_j = vdw_radii[
+                chain_j["atom_idx"] : chain_j["atom_idx"] + chain_j["atom_num"]
+            ]
+            radii_sum = radii_i[:, None] + radii_j[None, :]
+            is_clashing = np.any(dists < radii_sum * (1.00 - buffer))
+            type_i = const.chain_types[chain_i["mol_type"]].lower()
+            type_j = const.chain_types[chain_j["mol_type"]].lower()
+            type_i = type_i if type_i != "nonpolymer" else "ligand"
+            type_j = type_j if type_j != "nonpolymer" else "ligand"
+            is_symmetric = (
+                chain_i["entity_id"] == chain_j["entity_id"]
+                and chain_i["atom_num"] == chain_j["atom_num"]
+            )
+            if is_symmetric:
+                key = "sym_" + type_i
+            else:
+                key = "asym_" + type_i + "_" + type_j
+            result["num_chain_pairs_" + key] += 1
+            result["num_chain_clashes_" + key] += int(is_clashing)
+    return result
+
+
+cache_dir = Path("/data/rbg/users/jwohlwend/boltz-cache")
+ccd_path = cache_dir / "ccd.pkl"
+moldir = cache_dir / "mols"
+with ccd_path.open("rb") as file:
+    ccd = pickle.load(file)
+
+boltz1_dir = Path(
+    "/data/rbg/shared/projects/foldeverything/boltz_results_final/outputs/test/boltz/predictions"
+)
+boltz1x_dir = Path(
+    "/data/scratch/getzn/boltz_private/boltz_1x_test_results_final_new/full_predictions"
+)
+chai_dir = Path(
+    "/data/rbg/shared/projects/foldeverything/boltz_results_final/outputs/test/chai"
+)
+af3_dir = Path(
+    "/data/rbg/shared/projects/foldeverything/boltz_results_final/outputs/test/af3"
+)
+
+boltz1_pdb_ids = set(os.listdir(boltz1_dir))
+boltz1x_pdb_ids = set(os.listdir(boltz1x_dir))
+chai_pdb_ids = set(os.listdir(chai_dir))
+af3_pdb_ids = set([pdb_id for pdb_id in os.listdir(af3_dir)])
+common_pdb_ids = boltz1_pdb_ids & boltz1x_pdb_ids & chai_pdb_ids & af3_pdb_ids
+
+tools = ["boltz1", "boltz1x", "chai", "af3"]
+num_samples = 5
+
+
+def process_fn(key):
+    tool, pdb_id, model_idx = key
+    if tool == "boltz1":
+        cif_path = boltz1_dir / pdb_id / f"{pdb_id}_model_{model_idx}.cif"
+    elif tool == "boltz1x":
+        cif_path = boltz1x_dir / pdb_id / f"{pdb_id}_model_{model_idx}.cif"
+    elif tool == "chai":
+        cif_path = chai_dir / pdb_id / f"pred.model_idx_{model_idx}.cif"
+    elif tool == "af3":
+        cif_path = af3_dir / pdb_id.lower() / f"seed-1_sample-{model_idx}" / "model.cif"
+
+    parsed_structure = parse_mmcif(
+        cif_path,
+        ccd,
+        moldir,
+    )
+    structure = parsed_structure.data
+    constraints = parsed_structure.residue_constraints
+
+    record = {
+        "tool": tool,
+        "pdb_id": pdb_id,
+        "model_idx": model_idx,
+    }
+    record.update(check_ligand_distance_geometry(structure, constraints))
+    record.update(check_ligand_stereochemistry(structure, constraints))
+    record.update(check_ligand_flatness(structure, constraints))
+    record.update(check_steric_clash(structure, molecules=ccd))
+    return record
+
+
+keys = []
+for tool in tools:
+    for pdb_id in common_pdb_ids:
+        for model_idx in range(num_samples):
+            keys.append((tool, pdb_id, model_idx))
+
+process_fn(keys[0])
+records = []
+with Pool(48) as p:
+    with tqdm(total=len(keys)) as pbar:
+        for record in p.imap_unordered(process_fn, keys):
+            records.append(record)
+            pbar.update(1)
+df = pd.DataFrame.from_records(records)
+
+df["num_chain_clashes_all"] = df[
+    [key for key in df.columns if "chain_clash" in key]
+].sum(axis=1)
+df["num_pairs_all"] = df[[key for key in df.columns if "chain_pair" in key]].sum(axis=1)
+df["clash_free"] = df["num_chain_clashes_all"] == 0
+df["valid_ligand"] = (
+    df[[key for key in df.columns if "violation" in key]].sum(axis=1) == 0
+)
+df["valid"] = (df["clash_free"]) & (df["valid_ligand"])
+
+df.to_csv("physical_checks_test.csv")
diff --git a/forks/boltz/scripts/eval/run_evals.py b/forks/boltz/scripts/eval/run_evals.py
new file mode 100644
index 00000000..48f3a068
--- /dev/null
+++ b/forks/boltz/scripts/eval/run_evals.py
@@ -0,0 +1,167 @@
+import argparse
+import concurrent.futures
+import subprocess
+from pathlib import Path
+
+from tqdm import tqdm
+
+OST_COMPARE_STRUCTURE = r"""
+#!/bin/bash
+# https://openstructure.org/docs/2.7/actions/#ost-compare-structures
+
+IMAGE_NAME=openstructure-0.2.8
+
+command="compare-structures \
+-m {model_file} \
+-r {reference_file} \
+--fault-tolerant \
+--min-pep-length 4 \
+--min-nuc-length 4 \
+-o {output_path} \
+--lddt --bb-lddt --qs-score --dockq \
+--ics --ips --rigid-scores --patch-scores --tm-score"
+
+sudo docker run -u $(id -u):$(id -g) --rm --volume {mount}:{mount} $IMAGE_NAME $command
+"""
+
+
+OST_COMPARE_LIGAND = r"""
+#!/bin/bash
+# https://openstructure.org/docs/2.7/actions/#ost-compare-structures
+
+IMAGE_NAME=openstructure-0.2.8
+
+command="compare-ligand-structures \
+-m {model_file} \
+-r {reference_file} \
+--fault-tolerant \
+--lddt-pli --rmsd \
+--substructure-match \
+-o {output_path}"
+
+sudo docker run -u $(id -u):$(id -g) --rm --volume {mount}:{mount} $IMAGE_NAME $command
+"""
+
+
+def evaluate_structure(
+    name: str,
+    pred: Path,
+    reference: Path,
+    outdir: str,
+    mount: str,
+    executable: str = "/bin/bash",
+) -> None:
+    """Evaluate the structure."""
+    # Evaluate polymer metrics
+    out_path = Path(outdir) / f"{name}.json"
+
+    if out_path.exists():
+        print(  # noqa: T201
+            f"Skipping recomputation of {name} as protein json file already exists"
+        )
+    else:
+        subprocess.run(
+            OST_COMPARE_STRUCTURE.format(
+                model_file=str(pred),
+                reference_file=str(reference),
+                output_path=str(out_path),
+                mount=mount,
+            ),
+            shell=True,  # noqa: S602
+            check=False,
+            executable=executable,
+            capture_output=True,
+        )
+
+    # Evaluate ligand metrics
+    out_path = Path(outdir) / f"{name}_ligand.json"
+    if out_path.exists():
+        print(f"Skipping recomputation of {name} as ligand json file already exists")  # noqa: T201
+    else:
+        subprocess.run(
+            OST_COMPARE_LIGAND.format(
+                model_file=str(pred),
+                reference_file=str(reference),
+                output_path=str(out_path),
+                mount=mount,
+            ),
+            shell=True,  # noqa: S602
+            check=False,
+            executable=executable,
+            capture_output=True,
+        )
+
+
+def main(args):
+    # Aggregate the predictions and references
+    files = list(args.data.iterdir())
+    names = {f.stem.lower(): f for f in files}
+
+    # Create the output directory
+    args.outdir.mkdir(parents=True, exist_ok=True)
+
+    first_item = True
+    with concurrent.futures.ThreadPoolExecutor(args.max_workers) as executor:
+        futures = []
+        for name, folder in names.items():
+            for model_id in range(5):
+                # Split the input data
+                if args.format == "af3":
+                    pred_path = folder / f"seed-1_sample-{model_id}" / "model.cif"
+                elif args.format == "chai":
+                    pred_path = folder / f"pred.model_idx_{model_id}.cif"
+                elif args.format == "boltz":
+                    name_file = (
+                        f"{name[0].upper()}{name[1:]}"
+                        if args.testset == "casp"
+                        else name.lower()
+                    )
+                    pred_path = folder / f"{name_file}_model_{model_id}.cif"
+
+                if args.testset == "casp":
+                    ref_path = args.pdb / f"{name[0].upper()}{name[1:]}.cif"
+                elif args.testset == "test":
+                    ref_path = args.pdb / f"{name.lower()}.cif.gz"
+
+                if first_item:
+                    # Evaluate the first item in the first prediction
+                    # Ensures that the docker image is downloaded
+                    evaluate_structure(
+                        name=f"{name}_model_{model_id}",
+                        pred=str(pred_path),
+                        reference=str(ref_path),
+                        outdir=str(args.outdir),
+                        mount=args.mount,
+                        executable=args.executable,
+                    )
+                    first_item = False
+                else:
+                    future = executor.submit(
+                        evaluate_structure,
+                        name=f"{name}_model_{model_id}",
+                        pred=str(pred_path),
+                        reference=str(ref_path),
+                        outdir=str(args.outdir),
+                        mount=args.mount,
+                        executable=args.executable,
+                    )
+                    futures.append(future)
+
+        # Wait for all tasks to complete
+        with tqdm(total=len(futures)) as pbar:
+            for _ in concurrent.futures.as_completed(futures):
+                pbar.update(1)
+
+
+if __name__ == "__main__":
+    parser = argparse.ArgumentParser()
+    parser.add_argument("data", type=Path)
+    parser.add_argument("pdb", type=Path)
+    parser.add_argument("outdir", type=Path)
+    parser.add_argument("--format", type=str, default="af3")
+    parser.add_argument("--testset", type=str, default="casp")
+    parser.add_argument("--mount", type=str)
+    parser.add_argument("--executable", type=str, default="/bin/bash")
+    parser.add_argument("--max-workers", type=int, default=32)
+    args = parser.parse_args()
+    main(args)
diff --git a/forks/boltz/scripts/process/README.md b/forks/boltz/scripts/process/README.md
new file mode 100644
index 00000000..db33fd65
--- /dev/null
+++ b/forks/boltz/scripts/process/README.md
@@ -0,0 +1 @@
+Please see our [data processing instructions](../../docs/training.md).
\ No newline at end of file
diff --git a/forks/boltz/scripts/process/ccd.py b/forks/boltz/scripts/process/ccd.py
new file mode 100644
index 00000000..080b2285
--- /dev/null
+++ b/forks/boltz/scripts/process/ccd.py
@@ -0,0 +1,295 @@
+"""Compute conformers and symmetries for all the CCD molecules."""
+
+import argparse
+import multiprocessing
+import pickle
+import sys
+from functools import partial
+from pathlib import Path
+
+import pandas as pd
+import rdkit
+from p_tqdm import p_uimap
+from pdbeccdutils.core import ccd_reader
+from pdbeccdutils.core.component import ConformerType
+from rdkit import rdBase
+from rdkit.Chem import AllChem
+from rdkit.Chem.rdchem import Conformer, Mol
+from tqdm import tqdm
+
+
+def load_molecules(components: str) -> list[Mol]:
+    """Load the CCD components file.
+
+    Parameters
+    ----------
+    components : str
+        Path to the CCD components file.
+
+    Returns
+    -------
+    list[Mol]
+
+    """
+    components: dict[str, ccd_reader.CCDReaderResult]
+    components = ccd_reader.read_pdb_components_file(components)
+
+    mols = []
+    for name, component in components.items():
+        mol = component.component.mol
+        mol.SetProp("PDB_NAME", name)
+        mols.append(mol)
+
+    return mols
+
+
+def compute_3d(mol: Mol, version: str = "v3") -> bool:
+    """Generate 3D coordinates using EKTDG method.
+
+    Taken from `pdbeccdutils.core.component.Component`.
+
+    Parameters
+    ----------
+    mol: Mol
+        The RDKit molecule to process
+    version: str, optional
+        The ETKDG version, defaults ot v3
+
+    Returns
+    -------
+    bool
+        Whether computation was successful.
+
+    """
+    if version == "v3":
+        options = rdkit.Chem.AllChem.ETKDGv3()
+    elif version == "v2":
+        options = rdkit.Chem.AllChem.ETKDGv2()
+    else:
+        options = rdkit.Chem.AllChem.ETKDGv2()
+
+    options.clearConfs = False
+    conf_id = -1
+
+    try:
+        conf_id = rdkit.Chem.AllChem.EmbedMolecule(mol, options)
+        rdkit.Chem.AllChem.UFFOptimizeMolecule(mol, confId=conf_id, maxIters=1000)
+
+    except RuntimeError:
+        pass  # Force field issue here
+    except ValueError:
+        pass  # sanitization issue here
+
+    if conf_id != -1:
+        conformer = mol.GetConformer(conf_id)
+        conformer.SetProp("name", ConformerType.Computed.name)
+        conformer.SetProp("coord_generation", f"ETKDG{version}")
+
+        return True
+
+    return False
+
+
+def get_conformer(mol: Mol, c_type: ConformerType) -> Conformer:
+    """Retrieve an rdkit object for a deemed conformer.
+
+    Taken from `pdbeccdutils.core.component.Component`.
+
+    Parameters
+    ----------
+    mol: Mol
+        The molecule to process.
+    c_type: ConformerType
+        The conformer type to extract.
+
+    Returns
+    -------
+    Conformer
+        The desired conformer, if any.
+
+    Raises
+    ------
+    ValueError
+        If there are no conformers of the given tyoe.
+
+    """
+    for c in mol.GetConformers():
+        try:
+            if c.GetProp("name") == c_type.name:
+                return c
+        except KeyError:  # noqa: PERF203
+            pass
+
+    msg = f"Conformer {c_type.name} does not exist."
+    raise ValueError(msg)
+
+
+def compute_symmetries(mol: Mol) -> list[list[int]]:
+    """Compute the symmetries of a molecule.
+
+    Parameters
+    ----------
+    mol : Mol
+        The molecule to process
+
+    Returns
+    -------
+    list[list[int]]
+        The symmetries as a list of index permutations
+
+    """
+    mol = AllChem.RemoveHs(mol)
+    idx_map = {}
+    atom_idx = 0
+    for i, atom in enumerate(mol.GetAtoms()):
+        # Skip if leaving atoms
+        if int(atom.GetProp("leaving_atom")):
+            continue
+        idx_map[i] = atom_idx
+        atom_idx += 1
+
+    # Calculate self permutations
+    permutations = []
+    raw_permutations = mol.GetSubstructMatches(mol, uniquify=False)
+    for raw_permutation in raw_permutations:
+        # Filter out permutations with leaving atoms
+        try:
+            if {raw_permutation[idx] for idx in idx_map} == set(idx_map.keys()):
+                permutation = [
+                    idx_map[idx] for idx in raw_permutation if idx in idx_map
+                ]
+                permutations.append(permutation)
+        except Exception:  # noqa: S110, PERF203, BLE001
+            pass
+    serialized_permutations = pickle.dumps(permutations)
+    mol.SetProp("symmetries", serialized_permutations.hex())
+    return permutations
+
+
+def process(mol: Mol, output: str) -> tuple[str, str]:
+    """Process a CCD component.
+
+    Parameters
+    ----------
+    mol : Mol
+        The molecule to process
+    output : str
+        The directory to save the molecules
+
+    Returns
+    -------
+    str
+        The name of the component
+    str
+        The result of the conformer generation
+
+    """
+    # Get name
+    name = mol.GetProp("PDB_NAME")
+
+    # Check if single atom
+    if mol.GetNumAtoms() == 1:
+        result = "single"
+    else:
+        # Get the 3D conformer
+        try:
+            # Try to generate a 3D conformer with RDKit
+            success = compute_3d(mol, version="v3")
+            if success:
+                _ = get_conformer(mol, ConformerType.Computed)
+                result = "computed"
+
+            # Otherwise, default to the ideal coordinates
+            else:
+                _ = get_conformer(mol, ConformerType.Ideal)
+                result = "ideal"
+        except ValueError:
+            result = "failed"
+
+    # Dump the molecule
+    path = Path(output) / f"{name}.pkl"
+    with path.open("wb") as f:
+        pickle.dump(mol, f)
+
+    # Output the results
+    return name, result
+
+
+def main(args: argparse.Namespace) -> None:
+    """Process conformers."""
+    # Set property saving
+    rdkit.Chem.SetDefaultPickleProperties(rdkit.Chem.PropertyPickleOptions.AllProps)
+
+    # Load components
+    print("Loading components")  # noqa: T201
+    molecules = load_molecules(args.components)
+
+    # Reset stdout and stderr, as pdbccdutils messes with them
+    sys.stdout = sys.__stdout__
+    sys.stderr = sys.__stderr__
+
+    # Disable rdkit warnings
+    blocker = rdBase.BlockLogs()  # noqa: F841
+
+    # Setup processing function
+    outdir = Path(args.outdir)
+    outdir.mkdir(parents=True, exist_ok=True)
+    mol_output = outdir / "mols"
+    mol_output.mkdir(parents=True, exist_ok=True)
+    process_fn = partial(process, output=str(mol_output))
+
+    # Process the files in parallel
+    print("Processing components")  # noqa: T201
+    metadata = []
+
+    # Check if we can run in parallel
+    max_processes = multiprocessing.cpu_count()
+    num_processes = max(1, min(args.num_processes, max_processes, len(molecules)))
+    parallel = num_processes > 1
+
+    if parallel:
+        for name, result in p_uimap(
+            process_fn,
+            molecules,
+            num_cpus=num_processes,
+        ):
+            metadata.append({"name": name, "result": result})
+    else:
+        for mol in tqdm(molecules):
+            name, result = process_fn(mol)
+            metadata.append({"name": name, "result": result})
+
+    # Load and group outputs
+    molecules = {}
+    for item in metadata:
+        if item["result"] == "failed":
+            continue
+
+        # Load the mol file
+        path = mol_output / f"{item['name']}.pkl"
+        with path.open("rb") as f:
+            mol = pickle.load(f)  # noqa: S301
+            molecules[item["name"]] = mol
+
+    # Dump metadata
+    path = outdir / "results.csv"
+    metadata = pd.DataFrame(metadata)
+    metadata.to_csv(path)
+
+    # Dump the components
+    path = outdir / "ccd.pkl"
+    with path.open("wb") as f:
+        pickle.dump(molecules, f)
+
+
+if __name__ == "__main__":
+    parser = argparse.ArgumentParser()
+    parser.add_argument("--components", type=str)
+    parser.add_argument("--outdir", type=str)
+    parser.add_argument(
+        "--num_processes",
+        type=int,
+        default=multiprocessing.cpu_count(),
+    )
+    args = parser.parse_args()
+    main(args)
diff --git a/forks/boltz/scripts/process/cluster.py b/forks/boltz/scripts/process/cluster.py
new file mode 100644
index 00000000..c45dcd99
--- /dev/null
+++ b/forks/boltz/scripts/process/cluster.py
@@ -0,0 +1,111 @@
+"""Create a mapping from structure and chain ID to MSA indices."""
+
+import argparse
+import hashlib
+import json
+import pickle
+import subprocess
+from pathlib import Path
+
+import pandas as pd
+from Bio import SeqIO
+
+
+def hash_sequence(seq: str) -> str:
+    """Hash a sequence."""
+    return hashlib.sha256(seq.encode()).hexdigest()
+
+
+def main(args: argparse.Namespace) -> None:
+    """Create clustering."""
+    # Set output directory
+    outdir = Path(args.outdir)
+    outdir.mkdir(parents=True, exist_ok=True)
+
+    # Split the sequences into proteins and nucleotides
+    with Path(args.sequences).open("r") as f:
+        data = list(SeqIO.parse(f, "fasta"))
+
+    proteins = set()
+    shorts = set()
+    nucleotides = set()
+
+    # Separate the sequences into proteins, nucleotides and short sequences
+    # Short sequences cause a bug in the clustering, so they are separated
+    for seq in data:
+        if set(str(seq.seq)).issubset({"A", "C", "G", "T", "U", "N"}):
+            nucleotides.add(str(seq.seq).strip())
+        elif len(str(seq.seq).strip()) < 10:  # noqa: PLR2004
+            shorts.add(str(seq.seq).strip())
+        else:
+            proteins.add(str(seq.seq).strip())
+
+    # Run mmseqs on the protein data
+    proteins = [f">{hash_sequence(seq)}\n{seq}" for seq in proteins]
+    with (outdir / "proteins.fasta").open("w") as f:
+        f.write("\n".join(proteins))
+
+    subprocess.run(
+        f"{args.mmseqs} easy-cluster {outdir / 'proteins.fasta'} {outdir / 'clust_prot'} {outdir / 'tmp'} --min-seq-id 0.4",  # noqa: E501
+        shell=True,  # noqa: S602
+        check=True,
+    )
+
+    # Load protein clusters
+    clustering_path = outdir / "clust_prot_cluster.tsv"
+    protein_data = pd.read_csv(clustering_path, sep="\t", header=None)
+    clusters = protein_data[0]
+    items = protein_data[1]
+    clustering = dict(zip(list(items), list(clusters)))
+
+    # Each shqrt sequence is given an id
+    for short in shorts:
+        short_id = hash_sequence(short)
+        clustering[short_id] = short_id
+
+    # Each unique rna sequence is given an id
+    for nucl in nucleotides:
+        nucl_id = hash_sequence(nucl)
+        clustering[nucl_id] = nucl_id
+
+    # Load ligand data
+    with Path(args.ccd).open("rb") as handle:
+        ligand_data = pickle.load(handle)  # noqa: S301
+
+    # Each unique ligand CCD is given an id
+    for ccd_code in ligand_data:
+        clustering[ccd_code] = ccd_code
+
+    # Save clustering
+    with (outdir / "clustering.json").open("w") as handle:
+        json.dump(clustering, handle)
+
+
+if __name__ == "__main__":
+    parser = argparse.ArgumentParser()
+    parser.add_argument(
+        "--sequences",
+        type=str,
+        help="Input to protein fasta.",
+        required=True,
+    )
+    parser.add_argument(
+        "--ccd",
+        type=str,
+        help="Input to rna fasta.",
+        required=True,
+    )
+    parser.add_argument(
+        "--outdir",
+        type=str,
+        help="Output directory.",
+        required=True,
+    )
+    parser.add_argument(
+        "--mmseqs",
+        type=str,
+        help="Path to mmseqs program.",
+        default="mmseqs",
+    )
+    args = parser.parse_args()
+    main(args)
diff --git a/forks/boltz/scripts/process/mmcif.py b/forks/boltz/scripts/process/mmcif.py
new file mode 100644
index 00000000..95cdb29e
--- /dev/null
+++ b/forks/boltz/scripts/process/mmcif.py
@@ -0,0 +1,1123 @@
+import contextlib
+from dataclasses import dataclass, replace
+from typing import Optional
+
+import gemmi
+import numpy as np
+from rdkit import rdBase
+from rdkit.Chem import AllChem
+from rdkit.Chem.rdchem import Conformer, Mol
+from sklearn.neighbors import KDTree
+
+from boltz.data import const
+from boltz.data.types import (
+    Atom,
+    Bond,
+    Chain,
+    Connection,
+    Interface,
+    Residue,
+    Structure,
+    StructureInfo,
+)
+
+####################################################################################################
+# DATACLASSES
+####################################################################################################
+
+
+@dataclass(frozen=True, slots=True)
+class ParsedAtom:
+    """A parsed atom object."""
+
+    name: str
+    element: int
+    charge: int
+    coords: tuple[float, float, float]
+    conformer: tuple[float, float, float]
+    is_present: bool
+    chirality: int
+
+
+@dataclass(frozen=True, slots=True)
+class ParsedBond:
+    """A parsed bond object."""
+
+    atom_1: int
+    atom_2: int
+    type: int
+
+
+@dataclass(frozen=True, slots=True)
+class ParsedResidue:
+    """A parsed residue object."""
+
+    name: str
+    type: int
+    idx: int
+    atoms: list[ParsedAtom]
+    bonds: list[ParsedBond]
+    orig_idx: Optional[int]
+    atom_center: int
+    atom_disto: int
+    is_standard: bool
+    is_present: bool
+
+
+@dataclass(frozen=True, slots=True)
+class ParsedChain:
+    """A parsed chain object."""
+
+    name: str
+    entity: str
+    type: str
+    residues: list[ParsedResidue]
+    sequence: list[str]
+
+
+@dataclass(frozen=True, slots=True)
+class ParsedConnection:
+    """A parsed connection object."""
+
+    chain_1: str
+    chain_2: str
+    residue_index_1: int
+    residue_index_2: int
+    atom_index_1: str
+    atom_index_2: str
+
+
+@dataclass(frozen=True, slots=True)
+class ParsedStructure:
+    """A parsed structure object."""
+
+    data: Structure
+    info: StructureInfo
+    covalents: list[int]
+
+
+####################################################################################################
+# HELPERS
+####################################################################################################
+
+
+def get_dates(block: gemmi.cif.Block) -> tuple[str, str, str]:
+    """Get the deposited, released, and last revision dates.
+
+    Parameters
+    ----------
+    block : gemmi.cif.Block
+        The block to process.
+
+    Returns
+    -------
+    str
+        The deposited date.
+    str
+        The released date.
+    str
+        The last revision date.
+
+    """
+    deposited = "_pdbx_database_status.recvd_initial_deposition_date"
+    revision = "_pdbx_audit_revision_history.revision_date"
+    deposit_date = revision_date = release_date = ""
+    with contextlib.suppress(Exception):
+        deposit_date = block.find([deposited])[0][0]
+        release_date = block.find([revision])[0][0]
+        revision_date = block.find([revision])[-1][0]
+
+    return deposit_date, release_date, revision_date
+
+
+def get_resolution(block: gemmi.cif.Block) -> float:
+    """Get the resolution from a gemmi structure.
+
+    Parameters
+    ----------
+    block : gemmi.cif.Block
+        The block to process.
+
+    Returns
+    -------
+    float
+        The resolution.
+
+    """
+    resolution = 0.0
+    for res_key in (
+        "_refine.ls_d_res_high",
+        "_em_3d_reconstruction.resolution",
+        "_reflns.d_resolution_high",
+    ):
+        with contextlib.suppress(Exception):
+            resolution = float(block.find([res_key])[0].str(0))
+            break
+    return resolution
+
+
+def get_method(block: gemmi.cif.Block) -> str:
+    """Get the method from a gemmi structure.
+
+    Parameters
+    ----------
+    block : gemmi.cif.Block
+        The block to process.
+
+    Returns
+    -------
+    str
+        The method.
+
+    """
+    method = ""
+    method_key = "_exptl.method"
+    with contextlib.suppress(Exception):
+        methods = block.find([method_key])
+        method = ",".join([m.str(0).lower() for m in methods])
+
+    return method
+
+
+def convert_atom_name(name: str) -> tuple[int, int, int, int]:
+    """Convert an atom name to a standard format.
+
+    Parameters
+    ----------
+    name : str
+        The atom name.
+
+    Returns
+    -------
+    tuple[int, int, int, int]
+        The converted atom name.
+
+    """
+    name = name.strip()
+    name = [ord(c) - 32 for c in name]
+    name = name + [0] * (4 - len(name))
+    return tuple(name)
+
+
+def get_unk_token(dtype: gemmi.PolymerType) -> str:
+    """Get the unknown token for a given entity type.
+
+    Parameters
+    ----------
+    dtype : gemmi.EntityType
+        The entity type.
+
+    Returns
+    -------
+    str
+        The unknown token.
+
+    """
+    if dtype == gemmi.PolymerType.PeptideL:
+        unk = const.unk_token["PROTEIN"]
+    elif dtype == gemmi.PolymerType.Dna:
+        unk = const.unk_token["DNA"]
+    elif dtype == gemmi.PolymerType.Rna:
+        unk = const.unk_token["RNA"]
+    else:
+        msg = f"Unknown polymer type: {dtype}"
+        raise ValueError(msg)
+
+    return unk
+
+
+def get_conformer(mol: Mol) -> Conformer:
+    """Retrieve an rdkit object for a deemed conformer.
+
+    Inspired by `pdbeccdutils.core.component.Component`.
+
+    Parameters
+    ----------
+    mol: Mol
+        The molecule to process.
+
+    Returns
+    -------
+    Conformer
+        The desired conformer, if any.
+
+    Raises
+    ------
+    ValueError
+        If there are no conformers of the given tyoe.
+
+    """
+    for c in mol.GetConformers():
+        try:
+            if c.GetProp("name") == "Computed":
+                return c
+        except KeyError:  # noqa: PERF203
+            pass
+
+    for c in mol.GetConformers():
+        try:
+            if c.GetProp("name") == "Ideal":
+                return c
+        except KeyError:  # noqa: PERF203
+            pass
+
+    msg = "Conformer does not exist."
+    raise ValueError(msg)
+
+
+def compute_covalent_ligands(
+    connections: list[gemmi.Connection],
+    subchain_map: dict[tuple[str, int], str],
+    entities: dict[str, gemmi.Entity],
+) -> set[str]:
+    """Compute the covalent ligands from a list of connections.
+
+    Parameters
+    ----------
+    connections: List[gemmi.Connection]
+        The connections to process.
+    subchain_map: dict[tuple[str, int], str]
+        The mapping from chain, residue index to subchain name.
+    entities: dict[str, gemmi.Entity]
+        The entities in the structure.
+
+    Returns
+    -------
+    set
+        The covalent ligand subchains.
+
+    """
+    # Get covalent chain ids
+    covalent_chain_ids = set()
+    for connection in connections:
+        if connection.type.name != "Covale":
+            continue
+
+        # Map to correct subchain
+        chain_1_name = connection.partner1.chain_name
+        chain_2_name = connection.partner2.chain_name
+
+        res_1_id = connection.partner1.res_id.seqid
+        res_1_id = str(res_1_id.num) + str(res_1_id.icode).strip()
+
+        res_2_id = connection.partner2.res_id.seqid
+        res_2_id = str(res_2_id.num) + str(res_2_id.icode).strip()
+
+        subchain_1 = subchain_map[(chain_1_name, res_1_id)]
+        subchain_2 = subchain_map[(chain_2_name, res_2_id)]
+
+        # If non-polymer or branched, add to set
+        entity_1 = entities[subchain_1].entity_type.name
+        entity_2 = entities[subchain_2].entity_type.name
+
+        if entity_1 in {"NonPolymer", "Branched"}:
+            covalent_chain_ids.add(subchain_1)
+        if entity_2 in {"NonPolymer", "Branched"}:
+            covalent_chain_ids.add(subchain_2)
+
+    return covalent_chain_ids
+
+
+def compute_interfaces(atom_data: np.ndarray, chain_data: np.ndarray) -> np.ndarray:
+    """Compute the chain-chain interfaces from a gemmi structure.
+
+    Parameters
+    ----------
+    atom_data : List[tuple]
+        The atom data.
+    chain_data : List[tuple]
+        The chain data.
+
+    Returns
+    -------
+    List[tuple[int, int]]
+        The interfaces.
+
+    """
+    # Compute chain_id per atom
+    chain_ids = []
+    for idx, chain in enumerate(chain_data):
+        chain_ids.extend([idx] * chain["atom_num"])
+    chain_ids = np.array(chain_ids)
+
+    # Filte to present atoms
+    coords = atom_data["coords"]
+    mask = atom_data["is_present"]
+
+    coords = coords[mask]
+    chain_ids = chain_ids[mask]
+
+    # Compute the distance matrix
+    tree = KDTree(coords, metric="euclidean")
+    query = tree.query_radius(coords, const.atom_interface_cutoff)
+
+    # Get unique chain pairs
+    interfaces = set()
+    for c1, pairs in zip(chain_ids, query):
+        chains = np.unique(chain_ids[pairs])
+        chains = chains[chains != c1]
+        interfaces.update((c1, c2) for c2 in chains)
+
+    # Get unique chain pairs
+    interfaces = [(min(i, j), max(i, j)) for i, j in interfaces]
+    interfaces = list({(int(i), int(j)) for i, j in interfaces})
+    interfaces = np.array(interfaces, dtype=Interface)
+    return interfaces
+
+
+####################################################################################################
+# PARSING
+####################################################################################################
+
+
+def parse_ccd_residue(  # noqa: PLR0915, C901
+    name: str,
+    components: dict[str, Mol],
+    res_idx: int,
+    gemmi_mol: Optional[gemmi.Residue] = None,
+    is_covalent: bool = False,
+) -> Optional[ParsedResidue]:
+    """Parse an MMCIF ligand.
+
+    First tries to get the SMILES string from the RCSB.
+    Then, tries to infer atom ordering using RDKit.
+
+    Parameters
+    ----------
+    name: str
+        The name of the molecule to parse.
+    components : dict
+        The preprocessed PDB components dictionary.
+    res_idx : int
+        The residue index.
+    gemmi_mol : Optional[gemmi.Residue]
+        The PDB molecule, as a gemmi Residue object, if any.
+
+    Returns
+    -------
+    ParsedResidue, optional
+       The output ParsedResidue, if successful.
+
+    """
+    unk_chirality = const.chirality_type_ids[const.unk_chirality_type]
+    # Check if we have a PDB structure for this residue,
+    # it could be a missing residue from the sequence
+    is_present = gemmi_mol is not None
+
+    # Save original index (required for parsing connections)
+    if is_present:
+        orig_idx = gemmi_mol.seqid
+        orig_idx = str(orig_idx.num) + str(orig_idx.icode).strip()
+    else:
+        orig_idx = None
+
+    # Get reference component
+    ref_mol = components[name]
+
+    # Remove hydrogens
+    ref_mol = AllChem.RemoveHs(ref_mol, sanitize=False)
+
+    # Check if this is a single atom CCD residue
+    if ref_mol.GetNumAtoms() == 1:
+        pos = (0, 0, 0)
+        if is_present:
+            pos = (
+                gemmi_mol[0].pos.x,
+                gemmi_mol[0].pos.y,
+                gemmi_mol[0].pos.z,
+            )
+        ref_atom = ref_mol.GetAtoms()[0]
+        chirality_type = const.chirality_type_ids.get(
+            str(ref_atom.GetChiralTag()), unk_chirality
+        )
+        atom = ParsedAtom(
+            name=ref_atom.GetProp("name"),
+            element=ref_atom.GetAtomicNum(),
+            charge=ref_atom.GetFormalCharge(),
+            coords=pos,
+            conformer=(0, 0, 0),
+            is_present=is_present,
+            chirality=chirality_type,
+        )
+        unk_prot_id = const.unk_token_ids["PROTEIN"]
+        residue = ParsedResidue(
+            name=name,
+            type=unk_prot_id,
+            atoms=[atom],
+            bonds=[],
+            idx=res_idx,
+            orig_idx=orig_idx,
+            atom_center=0,  # Placeholder, no center
+            atom_disto=0,  # Placeholder, no center
+            is_standard=False,
+            is_present=is_present,
+        )
+        return residue
+
+    # If multi-atom, start by getting the PDB coordinates
+    pdb_pos = {}
+    if is_present:
+        # Match atoms based on names
+        for atom in gemmi_mol:
+            atom: gemmi.Atom
+            pos = (atom.pos.x, atom.pos.y, atom.pos.z)
+            pdb_pos[atom.name] = pos
+
+    # Get reference conformer coordinates
+    conformer = get_conformer(ref_mol)
+
+    # Parse each atom in order of the reference mol
+    atoms = []
+    atom_idx = 0
+    idx_map = {}  # Used for bonds later
+
+    for i, atom in enumerate(ref_mol.GetAtoms()):
+        # Get atom name, charge, element and reference coordinates
+        atom_name = atom.GetProp("name")
+        charge = atom.GetFormalCharge()
+        element = atom.GetAtomicNum()
+        ref_coords = conformer.GetAtomPosition(atom.GetIdx())
+        ref_coords = (ref_coords.x, ref_coords.y, ref_coords.z)
+        chirality_type = const.chirality_type_ids.get(
+            str(atom.GetChiralTag()), unk_chirality
+        )
+
+        # If the atom is a leaving atom, skip if not in the PDB and is_covalent
+        if (
+            int(atom.GetProp("leaving_atom")) == 1
+            and is_covalent
+            and (atom_name not in pdb_pos)
+        ):
+            continue
+
+        # Get PDB coordinates, if any
+        coords = pdb_pos.get(atom_name)
+        if coords is None:
+            atom_is_present = False
+            coords = (0, 0, 0)
+        else:
+            atom_is_present = True
+
+        # Add atom to list
+        atoms.append(
+            ParsedAtom(
+                name=atom_name,
+                element=element,
+                charge=charge,
+                coords=coords,
+                conformer=ref_coords,
+                is_present=atom_is_present,
+                chirality=chirality_type,
+            )
+        )
+        idx_map[i] = atom_idx
+        atom_idx += 1
+
+    # Load bonds
+    bonds = []
+    unk_bond = const.bond_type_ids[const.unk_bond_type]
+    for bond in ref_mol.GetBonds():
+        idx_1 = bond.GetBeginAtomIdx()
+        idx_2 = bond.GetEndAtomIdx()
+
+        # Skip bonds with atoms ignored
+        if (idx_1 not in idx_map) or (idx_2 not in idx_map):
+            continue
+
+        idx_1 = idx_map[idx_1]
+        idx_2 = idx_map[idx_2]
+        start = min(idx_1, idx_2)
+        end = max(idx_1, idx_2)
+        bond_type = bond.GetBondType().name
+        bond_type = const.bond_type_ids.get(bond_type, unk_bond)
+        bonds.append(ParsedBond(start, end, bond_type))
+
+    unk_prot_id = const.unk_token_ids["PROTEIN"]
+    return ParsedResidue(
+        name=name,
+        type=unk_prot_id,
+        atoms=atoms,
+        bonds=bonds,
+        idx=res_idx,
+        atom_center=0,
+        atom_disto=0,
+        orig_idx=orig_idx,
+        is_standard=False,
+        is_present=is_present,
+    )
+
+
+def parse_polymer(  # noqa: C901, PLR0915, PLR0912
+    polymer: gemmi.ResidueSpan,
+    polymer_type: gemmi.PolymerType,
+    sequence: list[str],
+    chain_id: str,
+    entity: str,
+    components: dict[str, Mol],
+) -> Optional[ParsedChain]:
+    """Process a gemmi Polymer into a chain object.
+
+    Performs alignment of the full sequence to the polymer
+    residues. Loads coordinates and masks for the atoms in
+    the polymer, following the ordering in const.atom_order.
+
+    Parameters
+    ----------
+    polymer : gemmi.ResidueSpan
+        The polymer to process.
+    polymer_type : gemmi.PolymerType
+        The polymer type.
+    sequence : str
+        The full sequence of the polymer.
+    chain_id : str
+        The chain identifier.
+    entity : str
+        The entity name.
+    components : dict[str, Mol]
+        The preprocessed PDB components dictionary.
+
+    Returns
+    -------
+    ParsedChain, optional
+        The output chain, if successful.
+
+    Raises
+    ------
+    ValueError
+        If the alignment fails.
+
+    """
+    # Get unknown chirality token
+    unk_chirality = const.chirality_type_ids[const.unk_chirality_type]
+
+    # Ignore microheterogenities (pick first)
+    sequence = [gemmi.Entity.first_mon(item) for item in sequence]
+
+    # Align full sequence to polymer residues
+    # This is a simple way to handle all the different numbering schemes
+    result = gemmi.align_sequence_to_polymer(
+        sequence,
+        polymer,
+        polymer_type,
+        gemmi.AlignmentScoring(),
+    )
+
+    # Get coordinates and masks
+    i = 0
+    ref_res = set(const.tokens)
+    parsed = []
+    for j, match in enumerate(result.match_string):
+        # Get residue name from sequence
+        res_name = sequence[j]
+
+        # Check if we have a match in the structure
+        res = None
+        name_to_atom = {}
+
+        if match == "|":
+            # Get pdb residue
+            res = polymer[i]
+            name_to_atom = {a.name.upper(): a for a in res}
+
+            # Double check the match
+            if res.name != res_name:
+                msg = "Alignment mismatch!"
+                raise ValueError(msg)
+
+            # Increment polymer index
+            i += 1
+
+        # Map MSE to MET, put the selenium atom in the sulphur column
+        if res_name == "MSE":
+            res_name = "MET"
+            if "SE" in name_to_atom:
+                name_to_atom["SD"] = name_to_atom["SE"]
+
+        # Handle non-standard residues
+        elif res_name not in ref_res:
+            residue = parse_ccd_residue(
+                name=res_name,
+                components=components,
+                res_idx=j,
+                gemmi_mol=res,
+                is_covalent=True,
+            )
+            parsed.append(residue)
+            continue
+
+        # Load regular residues
+        ref_mol = components[res_name]
+        ref_mol = AllChem.RemoveHs(ref_mol, sanitize=False)
+        ref_conformer = get_conformer(ref_mol)
+
+        # Only use reference atoms set in constants
+        ref_name_to_atom = {a.GetProp("name"): a for a in ref_mol.GetAtoms()}
+        ref_atoms = [ref_name_to_atom[a] for a in const.ref_atoms[res_name]]
+
+        # Iterate, always in the same order
+        atoms: list[ParsedAtom] = []
+
+        for ref_atom in ref_atoms:
+            # Get atom name
+            atom_name = ref_atom.GetProp("name")
+            idx = ref_atom.GetIdx()
+
+            # Get conformer coordinates
+            ref_coords = ref_conformer.GetAtomPosition(idx)
+            ref_coords = (ref_coords.x, ref_coords.y, ref_coords.z)
+
+            # Get coordinated from PDB
+            if atom_name in name_to_atom:
+                atom = name_to_atom[atom_name]
+                atom_is_present = True
+                coords = (atom.pos.x, atom.pos.y, atom.pos.z)
+            else:
+                atom_is_present = False
+                coords = (0, 0, 0)
+
+            # Add atom to list
+            atoms.append(
+                ParsedAtom(
+                    name=atom_name,
+                    element=ref_atom.GetAtomicNum(),
+                    charge=ref_atom.GetFormalCharge(),
+                    coords=coords,
+                    conformer=ref_coords,
+                    is_present=atom_is_present,
+                    chirality=const.chirality_type_ids.get(
+                        str(ref_atom.GetChiralTag()), unk_chirality
+                    ),
+                )
+            )
+
+        # Fix naming errors in arginine residues where NH2 is
+        # incorrectly assigned to be closer to CD than NH1
+        if (res is not None) and (res_name == "ARG"):
+            ref_atoms: list[str] = const.ref_atoms["ARG"]
+            cd = atoms[ref_atoms.index("CD")]
+            nh1 = atoms[ref_atoms.index("NH1")]
+            nh2 = atoms[ref_atoms.index("NH2")]
+
+            cd_coords = np.array(cd.coords)
+            nh1_coords = np.array(nh1.coords)
+            nh2_coords = np.array(nh2.coords)
+
+            if all(atom.is_present for atom in (cd, nh1, nh2)) and (
+                np.linalg.norm(nh1_coords - cd_coords)
+                > np.linalg.norm(nh2_coords - cd_coords)
+            ):
+                atoms[ref_atoms.index("NH1")] = replace(nh1, coords=nh2.coords)
+                atoms[ref_atoms.index("NH2")] = replace(nh2, coords=nh1.coords)
+
+        # Add residue to parsed list
+        if res is not None:
+            orig_idx = res.seqid
+            orig_idx = str(orig_idx.num) + str(orig_idx.icode).strip()
+        else:
+            orig_idx = None
+
+        atom_center = const.res_to_center_atom_id[res_name]
+        atom_disto = const.res_to_disto_atom_id[res_name]
+        parsed.append(
+            ParsedResidue(
+                name=res_name,
+                type=const.token_ids[res_name],
+                atoms=atoms,
+                bonds=[],
+                idx=j,
+                atom_center=atom_center,
+                atom_disto=atom_disto,
+                is_standard=True,
+                is_present=res is not None,
+                orig_idx=orig_idx,
+            )
+        )
+
+    # Get polymer class
+    if polymer_type == gemmi.PolymerType.PeptideL:
+        chain_type = const.chain_type_ids["PROTEIN"]
+    elif polymer_type == gemmi.PolymerType.Dna:
+        chain_type = const.chain_type_ids["DNA"]
+    elif polymer_type == gemmi.PolymerType.Rna:
+        chain_type = const.chain_type_ids["RNA"]
+
+    # Return polymer object
+    return ParsedChain(
+        name=chain_id,
+        entity=entity,
+        residues=parsed,
+        type=chain_type,
+        sequence=gemmi.one_letter_code(sequence),
+    )
+
+
+def parse_connection(
+    connection: gemmi.Connection,
+    chains: list[ParsedChain],
+    subchain_map: dict[tuple[str, int], str],
+) -> ParsedConnection:
+    """Parse (covalent) connection from a gemmi Connection.
+
+    Parameters
+    ----------
+    connections : gemmi.ConnectionList
+        The connection list to parse.
+    chains : List[Chain]
+        The parsed chains.
+    subchain_map : dict[tuple[str, int], str]
+        The mapping from chain, residue index to subchain name.
+
+    Returns
+    -------
+    List[Connection]
+        The parsed connections.
+
+    """
+    # Map to correct subchains
+    chain_1_name = connection.partner1.chain_name
+    chain_2_name = connection.partner2.chain_name
+
+    res_1_id = connection.partner1.res_id.seqid
+    res_1_id = str(res_1_id.num) + str(res_1_id.icode).strip()
+
+    res_2_id = connection.partner2.res_id.seqid
+    res_2_id = str(res_2_id.num) + str(res_2_id.icode).strip()
+
+    subchain_1 = subchain_map[(chain_1_name, res_1_id)]
+    subchain_2 = subchain_map[(chain_2_name, res_2_id)]
+
+    # Get chain indices
+    chain_1 = next(chain for chain in chains if (chain.name == subchain_1))
+    chain_2 = next(chain for chain in chains if (chain.name == subchain_2))
+
+    # Get residue indices
+    res_1_idx, res_1 = next(
+        (idx, res)
+        for idx, res in enumerate(chain_1.residues)
+        if (res.orig_idx == res_1_id)
+    )
+    res_2_idx, res_2 = next(
+        (idx, res)
+        for idx, res in enumerate(chain_2.residues)
+        if (res.orig_idx == res_2_id)
+    )
+
+    # Get atom indices
+    atom_index_1 = next(
+        idx
+        for idx, atom in enumerate(res_1.atoms)
+        if atom.name == connection.partner1.atom_name
+    )
+    atom_index_2 = next(
+        idx
+        for idx, atom in enumerate(res_2.atoms)
+        if atom.name == connection.partner2.atom_name
+    )
+
+    conn = ParsedConnection(
+        chain_1=subchain_1,
+        chain_2=subchain_2,
+        residue_index_1=res_1_idx,
+        residue_index_2=res_2_idx,
+        atom_index_1=atom_index_1,
+        atom_index_2=atom_index_2,
+    )
+
+    return conn
+
+
+def parse_mmcif(  # noqa: C901, PLR0915, PLR0912
+    path: str,
+    components: dict[str, Mol],
+    use_assembly: bool = True,
+) -> ParsedStructure:
+    """Parse a structure in MMCIF format.
+
+    Parameters
+    ----------
+    mmcif_file : PathLike
+        Path to the MMCIF file.
+    components: dict[str, Mol]
+        The preprocessed PDB components dictionary.
+    use_assembly: bool
+        Whether to use the first assembly.
+
+    Returns
+    -------
+    ParsedStructure
+        The parsed structure.
+
+    """
+    # Disable rdkit warnings
+    blocker = rdBase.BlockLogs()  # noqa: F841
+
+    # Parse MMCIF input file
+    block = gemmi.cif.read(str(path))[0]
+
+    # Extract medatadata
+    deposit_date, release_date, revision_date = get_dates(block)
+    resolution = get_resolution(block)
+    method = get_method(block)
+
+    # Load structure object
+    structure = gemmi.make_structure_from_block(block)
+
+    # Clean up the structure
+    structure.merge_chain_parts()
+    structure.remove_waters()
+    structure.remove_hydrogens()
+    structure.remove_alternative_conformations()
+    structure.remove_empty_chains()
+
+    # Expand assembly 1
+    if use_assembly and structure.assemblies:
+        how = gemmi.HowToNameCopiedChain.AddNumber
+        assembly_name = structure.assemblies[0].name
+        structure.transform_to_assembly(assembly_name, how=how)
+
+    # Parse entities
+    # Create mapping from subchain id to entity
+    entities: dict[str, gemmi.Entity] = {}
+    entity_ids: dict[str, int] = {}
+    for entity_id, entity in enumerate(structure.entities):
+        entity: gemmi.Entity
+        if entity.entity_type.name == "Water":
+            continue
+        for subchain_id in entity.subchains:
+            entities[subchain_id] = entity
+            entity_ids[subchain_id] = entity_id
+
+    # Create mapping from chain, residue to subchains
+    # since a Connection uses the chains and not subchins
+    subchain_map = {}
+    for chain in structure[0]:
+        for residue in chain:
+            seq_id = residue.seqid
+            seq_id = str(seq_id.num) + str(seq_id.icode).strip()
+            subchain_map[(chain.name, seq_id)] = residue.subchain
+
+    # Find covalent ligands
+    covalent_chain_ids = compute_covalent_ligands(
+        connections=structure.connections,
+        subchain_map=subchain_map,
+        entities=entities,
+    )
+
+    # Parse chains
+    chains: list[ParsedChain] = []
+    chain_seqs = []
+    for raw_chain in structure[0].subchains():
+        # Check chain type
+        subchain_id = raw_chain.subchain_id()
+        entity: gemmi.Entity = entities[subchain_id]
+        entity_type = entity.entity_type.name
+
+        # Parse a polymer
+        if entity_type == "Polymer":
+            # Skip PeptideD, DnaRnaHybrid, Pna, Other
+            if entity.polymer_type.name not in {
+                "PeptideL",
+                "Dna",
+                "Rna",
+            }:
+                continue
+
+            # Add polymer if successful
+            parsed_polymer = parse_polymer(
+                polymer=raw_chain,
+                polymer_type=entity.polymer_type,
+                sequence=entity.full_sequence,
+                chain_id=subchain_id,
+                entity=entity.name,
+                components=components,
+            )
+            if parsed_polymer is not None:
+                chains.append(parsed_polymer)
+                chain_seqs.append(parsed_polymer.sequence)
+
+        # Parse a non-polymer
+        elif entity_type in {"NonPolymer", "Branched"}:
+            # Skip UNL or other missing ligands
+            if any(components.get(lig.name) is None for lig in raw_chain):
+                continue
+
+            residues = []
+            for lig_idx, ligand in enumerate(raw_chain):
+                # Check if ligand is covalent
+                if entity_type == "Branched":
+                    is_covalent = True
+                else:
+                    is_covalent = subchain_id in covalent_chain_ids
+
+                ligand: gemmi.Residue
+                residue = parse_ccd_residue(
+                    name=ligand.name,
+                    components=components,
+                    res_idx=lig_idx,
+                    gemmi_mol=ligand,
+                    is_covalent=is_covalent,
+                )
+                residues.append(residue)
+
+            if residues:
+                chains.append(
+                    ParsedChain(
+                        name=subchain_id,
+                        entity=entity.name,
+                        residues=residues,
+                        type=const.chain_type_ids["NONPOLYMER"],
+                        sequence=None,
+                    )
+                )
+
+    # If no chains parsed fail
+    if not chains:
+        msg = "No chains parsed!"
+        raise ValueError(msg)
+
+    # Parse covalent connections
+    connections: list[ParsedConnection] = []
+    for connection in structure.connections:
+        # Skip non-covalent connections
+        connection: gemmi.Connection
+        if connection.type.name != "Covale":
+            continue
+
+        parsed_connection = parse_connection(
+            connection=connection,
+            chains=chains,
+            subchain_map=subchain_map,
+        )
+        connections.append(parsed_connection)
+
+    # Create tables
+    atom_data = []
+    bond_data = []
+    res_data = []
+    chain_data = []
+    connection_data = []
+
+    # Convert parsed chains to tables
+    atom_idx = 0
+    res_idx = 0
+    asym_id = 0
+    sym_count = {}
+    chain_to_idx = {}
+    res_to_idx = {}
+
+    for asym_id, chain in enumerate(chains):
+        # Compute number of atoms and residues
+        res_num = len(chain.residues)
+        atom_num = sum(len(res.atoms) for res in chain.residues)
+
+        # Find all copies of this chain in the assembly
+        entity_id = entity_ids[chain.name]
+        sym_id = sym_count.get(entity_id, 0)
+        chain_data.append(
+            (
+                chain.name,
+                chain.type,
+                entity_id,
+                sym_id,
+                asym_id,
+                atom_idx,
+                atom_num,
+                res_idx,
+                res_num,
+            )
+        )
+        chain_to_idx[chain.name] = asym_id
+        sym_count[entity_id] = sym_id + 1
+
+        # Add residue, atom, bond, data
+        for i, res in enumerate(chain.residues):
+            atom_center = atom_idx + res.atom_center
+            atom_disto = atom_idx + res.atom_disto
+            res_data.append(
+                (
+                    res.name,
+                    res.type,
+                    res.idx,
+                    atom_idx,
+                    len(res.atoms),
+                    atom_center,
+                    atom_disto,
+                    res.is_standard,
+                    res.is_present,
+                )
+            )
+            res_to_idx[(chain.name, i)] = (res_idx, atom_idx)
+
+            for bond in res.bonds:
+                atom_1 = atom_idx + bond.atom_1
+                atom_2 = atom_idx + bond.atom_2
+                bond_data.append((atom_1, atom_2, bond.type))
+
+            for atom in res.atoms:
+                atom_data.append(
+                    (
+                        convert_atom_name(atom.name),
+                        atom.element,
+                        atom.charge,
+                        atom.coords,
+                        atom.conformer,
+                        atom.is_present,
+                        atom.chirality,
+                    )
+                )
+                atom_idx += 1
+
+            res_idx += 1
+
+    # Convert connections to tables
+    for conn in connections:
+        chain_1_idx = chain_to_idx[conn.chain_1]
+        chain_2_idx = chain_to_idx[conn.chain_2]
+        res_1_idx, atom_1_offset = res_to_idx[(conn.chain_1, conn.residue_index_1)]
+        res_2_idx, atom_2_offset = res_to_idx[(conn.chain_2, conn.residue_index_2)]
+        atom_1_idx = atom_1_offset + conn.atom_index_1
+        atom_2_idx = atom_2_offset + conn.atom_index_2
+        connection_data.append(
+            (
+                chain_1_idx,
+                chain_2_idx,
+                res_1_idx,
+                res_2_idx,
+                atom_1_idx,
+                atom_2_idx,
+            )
+        )
+
+    # Convert into datatypes
+    atoms = np.array(atom_data, dtype=Atom)
+    bonds = np.array(bond_data, dtype=Bond)
+    residues = np.array(res_data, dtype=Residue)
+    chains = np.array(chain_data, dtype=Chain)
+    connections = np.array(connection_data, dtype=Connection)
+    mask = np.ones(len(chain_data), dtype=bool)
+
+    # Compute interface chains (find chains with a heavy atom within 5A)
+    interfaces = compute_interfaces(atoms, chains)
+
+    # Return parsed structure
+    info = StructureInfo(
+        deposited=deposit_date,
+        revised=revision_date,
+        released=release_date,
+        resolution=resolution,
+        method=method,
+        num_chains=len(chains),
+        num_interfaces=len(interfaces),
+    )
+
+    data = Structure(
+        atoms=atoms,
+        bonds=bonds,
+        residues=residues,
+        chains=chains,
+        connections=connections,
+        interfaces=interfaces,
+        mask=mask,
+    )
+
+    return ParsedStructure(data=data, info=info, covalents=[])
diff --git a/forks/boltz/scripts/process/msa.py b/forks/boltz/scripts/process/msa.py
new file mode 100644
index 00000000..609f53ef
--- /dev/null
+++ b/forks/boltz/scripts/process/msa.py
@@ -0,0 +1,130 @@
+import argparse
+import multiprocessing
+from dataclasses import asdict
+from functools import partial
+from pathlib import Path
+from typing import Any
+
+import numpy as np
+from p_tqdm import p_umap
+from redis import Redis
+from tqdm import tqdm
+
+from boltz.data.parse.a3m import parse_a3m
+
+
+class Resource:
+    """A shared resource for processing."""
+
+    def __init__(self, host: str, port: int) -> None:
+        """Initialize the redis database."""
+        self._redis = Redis(host=host, port=port)
+
+    def get(self, key: str) -> Any:  # noqa: ANN401
+        """Get an item from the Redis database."""
+        return self._redis.get(key)
+
+    def __getitem__(self, key: str) -> Any:  # noqa: ANN401
+        """Get an item from the resource."""
+        out = self.get(key)
+        if out is None:
+            raise KeyError(key)
+        return out
+
+
+def process_msa(
+    path: Path,
+    outdir: str,
+    max_seqs: int,
+    resource: Resource,
+) -> None:
+    """Run processing in a worker thread."""
+    outdir = Path(outdir)
+    out_path = outdir / f"{path.stem}.npz"
+    if not out_path.exists():
+        msa = parse_a3m(path, resource, max_seqs)
+        np.savez_compressed(out_path, **asdict(msa))
+
+
+def process(args) -> None:
+    """Run the data processing task."""
+    # Create output directory
+    args.outdir.mkdir(parents=True, exist_ok=True)
+
+    # Load the resource
+    resource = Resource(host=args.redis_host, port=args.redis_port)
+
+    # Get data points
+    print("Fetching data...")
+    data = list(args.msadir.rglob("*.a3m*"))
+    print(f"Found {len(data)} MSA's.")
+
+    # Check if we can run in parallel
+    max_processes = multiprocessing.cpu_count()
+    num_processes = max(1, min(args.num_processes, max_processes, len(data)))
+    parallel = num_processes > 1
+
+    # Run processing
+    if parallel:
+        # Create processing function
+        fn = partial(
+            process_msa,
+            outdir=args.outdir,
+            max_seqs=args.max_seqs,
+            resource=resource,
+        )
+
+        # Run in parallel
+        p_umap(fn, data, num_cpus=num_processes)
+
+    else:
+        # Run in serial
+        for path in tqdm(data):
+            process_msa(
+                path,
+                outdir=args.outdir,
+                max_seqs=args.max_seqs,
+                resource=resource,
+            )
+
+
+if __name__ == "__main__":
+    parser = argparse.ArgumentParser(description="Process MSA data.")
+    parser.add_argument(
+        "--msadir",
+        type=Path,
+        required=True,
+        help="The MSA data directory.",
+    )
+    parser.add_argument(
+        "--outdir",
+        type=Path,
+        default="data",
+        help="The output directory.",
+    )
+    parser.add_argument(
+        "--num-processes",
+        type=int,
+        default=multiprocessing.cpu_count(),
+        help="The number of processes.",
+    )
+    parser.add_argument(
+        "--redis-host",
+        type=str,
+        default="localhost",
+        help="The Redis host.",
+    )
+    parser.add_argument(
+        "--redis-port",
+        type=int,
+        default=7777,
+        help="The Redis port.",
+    )
+    parser.add_argument(
+        "--max-seqs",
+        type=int,
+        default=16384,
+        help="The maximum number of sequences.",
+    )
+    args = parser.parse_args()
+    process(args)
diff --git a/forks/boltz/scripts/process/rcsb.py b/forks/boltz/scripts/process/rcsb.py
new file mode 100644
index 00000000..ee0d7a98
--- /dev/null
+++ b/forks/boltz/scripts/process/rcsb.py
@@ -0,0 +1,359 @@
+import argparse
+import json
+import multiprocessing
+import pickle
+import traceback
+from dataclasses import asdict, dataclass, replace
+from functools import partial
+from pathlib import Path
+from typing import Any, Optional
+
+import numpy as np
+import rdkit
+from mmcif import parse_mmcif
+from p_tqdm import p_umap
+from redis import Redis
+from tqdm import tqdm
+
+from boltz.data.filter.static.filter import StaticFilter
+from boltz.data.filter.static.ligand import ExcludedLigands
+from boltz.data.filter.static.polymer import (
+    ClashingChainsFilter,
+    ConsecutiveCA,
+    MinimumLengthFilter,
+    UnknownFilter,
+)
+from boltz.data.types import ChainInfo, InterfaceInfo, Record, Target
+
+
+@dataclass(frozen=True, slots=True)
+class PDB:
+    """A raw MMCIF PDB file."""
+
+    id: str
+    path: str
+
+
+class Resource:
+    """A shared resource for processing."""
+
+    def __init__(self, host: str, port: int) -> None:
+        """Initialize the redis database."""
+        self._redis = Redis(host=host, port=port)
+
+    def get(self, key: str) -> Any:  # noqa: ANN401
+        """Get an item from the Redis database."""
+        value = self._redis.get(key)
+        if value is not None:
+            value = pickle.loads(value)  # noqa: S301
+        return value
+
+    def __getitem__(self, key: str) -> Any:  # noqa: ANN401
+        """Get an item from the resource."""
+        out = self.get(key)
+        if out is None:
+            raise KeyError(key)
+        return out
+
+
+def fetch(datadir: Path, max_file_size: Optional[int] = None) -> list[PDB]:
+    """Fetch the PDB files."""
+    data = []
+    excluded = 0
+    for file in datadir.rglob("*.cif*"):
+        # The clustering file is annotated by pdb_entity id
+        pdb_id = str(file.stem).lower()
+
+        # Check file size and skip if too large
+        if max_file_size is not None and (file.stat().st_size > max_file_size):
+            excluded += 1
+            continue
+
+        # Create the target
+        target = PDB(id=pdb_id, path=str(file))
+        data.append(target)
+
+    print(f"Excluded {excluded} files due to size.")  # noqa: T201
+    return data
+
+
+def finalize(outdir: Path) -> None:
+    """Run post-processing in main thread.
+
+    Parameters
+    ----------
+    outdir : Path
+        The output directory.
+
+    """
+    # Group records into a manifest
+    records_dir = outdir / "records"
+
+    failed_count = 0
+    records = []
+    for record in records_dir.iterdir():
+        path = record
+        try:
+            with path.open("r") as f:
+                records.append(json.load(f))
+        except:  # noqa: E722
+            failed_count += 1
+            print(f"Failed to parse {record}")  # noqa: T201
+    if failed_count > 0:
+        print(f"Failed to parse {failed_count} entries.")  # noqa: T201
+    else:
+        print("All entries parsed successfully.")
+
+    # Save manifest
+    outpath = outdir / "manifest.json"
+    with outpath.open("w") as f:
+        json.dump(records, f)
+
+
+def parse(data: PDB, resource: Resource, clusters: dict) -> Target:
+    """Process a structure.
+
+    Parameters
+    ----------
+    data : PDB
+        The raw input data.
+    resource: Resource
+        The shared resource.
+
+    Returns
+    -------
+    Target
+        The processed data.
+
+    """
+    # Get the PDB id
+    pdb_id = data.id.lower()
+
+    # Parse structure
+    parsed = parse_mmcif(data.path, resource)
+    structure = parsed.data
+    structure_info = parsed.info
+
+    # Create chain metadata
+    chain_info = []
+    for i, chain in enumerate(structure.chains):
+        key = f"{pdb_id}_{chain['entity_id']}"
+        chain_info.append(
+            ChainInfo(
+                chain_id=i,
+                chain_name=chain["name"],
+                msa_id="",  # FIX
+                mol_type=int(chain["mol_type"]),
+                cluster_id=clusters.get(key, -1),
+                num_residues=int(chain["res_num"]),
+            )
+        )
+
+    # Get interface metadata
+    interface_info = []
+    for interface in structure.interfaces:
+        chain_1 = int(interface["chain_1"])
+        chain_2 = int(interface["chain_2"])
+        interface_info.append(
+            InterfaceInfo(
+                chain_1=chain_1,
+                chain_2=chain_2,
+            )
+        )
+
+    # Create record
+    record = Record(
+        id=data.id,
+        structure=structure_info,
+        chains=chain_info,
+        interfaces=interface_info,
+    )
+
+    return Target(structure=structure, record=record)
+
+
+def process_structure(
+    data: PDB,
+    resource: Resource,
+    outdir: Path,
+    filters: list[StaticFilter],
+    clusters: dict,
+) -> None:
+    """Process a target.
+
+    Parameters
+    ----------
+    item : PDB
+        The raw input data.
+    resource: Resource
+        The shared resource.
+    outdir : Path
+        The output directory.
+
+    """
+    # Check if we need to process
+    struct_path = outdir / "structures" / f"{data.id}.npz"
+    record_path = outdir / "records" / f"{data.id}.json"
+
+    if struct_path.exists() and record_path.exists():
+        return
+
+    try:
+        # Parse the target
+        target: Target = parse(data, resource, clusters)
+        structure = target.structure
+
+        # Apply the filters
+        mask = structure.mask
+        if filters is not None:
+            for f in filters:
+                filter_mask = f.filter(structure)
+                mask = mask & filter_mask
+    except Exception:  # noqa: BLE001
+        traceback.print_exc()
+        print(f"Failed to parse {data.id}")
+        return
+
+    # Replace chains and interfaces
+    chains = []
+    for i, chain in enumerate(target.record.chains):
+        chains.append(replace(chain, valid=bool(mask[i])))
+
+    interfaces = []
+    for interface in target.record.interfaces:
+        chain_1 = bool(mask[interface.chain_1])
+        chain_2 = bool(mask[interface.chain_2])
+        interfaces.append(replace(interface, valid=(chain_1 and chain_2)))
+
+    # Replace structure and record
+    structure = replace(structure, mask=mask)
+    record = replace(target.record, chains=chains, interfaces=interfaces)
+    target = replace(target, structure=structure, record=record)
+
+    # Dump structure
+    np.savez_compressed(struct_path, **asdict(structure))
+
+    # Dump record
+    with record_path.open("w") as f:
+        json.dump(asdict(record), f)
+
+
+def process(args) -> None:
+    """Run the data processing task."""
+    # Create output directory
+    args.outdir.mkdir(parents=True, exist_ok=True)
+
+    # Create output directories
+    records_dir = args.outdir / "records"
+    records_dir.mkdir(parents=True, exist_ok=True)
+
+    structure_dir = args.outdir / "structures"
+    structure_dir.mkdir(parents=True, exist_ok=True)
+
+    # Load clusters
+    with Path(args.clusters).open("r") as f:
+        clusters: dict[str, str] = json.load(f)
+        clusters = {k.lower(): v.lower() for k, v in clusters.items()}
+
+    # Load filters
+    filters = [
+        ExcludedLigands(),
+        MinimumLengthFilter(min_len=4, max_len=5000),
+        UnknownFilter(),
+        ConsecutiveCA(max_dist=10.0),
+        ClashingChainsFilter(freq=0.3, dist=1.7),
+    ]
+
+    # Set default pickle properties
+    pickle_option = rdkit.Chem.PropertyPickleOptions.AllProps
+    rdkit.Chem.SetDefaultPickleProperties(pickle_option)
+
+    # Load shared data from redis
+    resource = Resource(host=args.redis_host, port=args.redis_port)
+
+    # Get data points
+    print("Fetching data...")
+    data = fetch(args.datadir)
+
+    # Check if we can run in parallel
+    max_processes = multiprocessing.cpu_count()
+    num_processes = max(1, min(args.num_processes, max_processes, len(data)))
+    parallel = num_processes > 1
+
+    # Run processing
+    print("Processing data...")
+    if parallel:
+        # Create processing function
+        fn = partial(
+            process_structure,
+            resource=resource,
+            outdir=args.outdir,
+            clusters=clusters,
+            filters=filters,
+        )
+        # Run processing in parallel
+        p_umap(fn, data, num_cpus=num_processes)
+    else:
+        for item in tqdm(data):
+            process_structure(
+                item,
+                resource=resource,
+                outdir=args.outdir,
+                clusters=clusters,
+                filters=filters,
+            )
+
+    # Finalize
+    finalize(args.outdir)
+
+
+if __name__ == "__main__":
+    parser = argparse.ArgumentParser(description="Process MSA data.")
+    parser.add_argument(
+        "--datadir",
+        type=Path,
+        required=True,
+        help="The data containing the MMCIF files.",
+    )
+    parser.add_argument(
+        "--clusters",
+        type=Path,
+        required=True,
+        help="Path to the cluster file.",
+    )
+    parser.add_argument(
+        "--outdir",
+        type=Path,
+        default="data",
+        help="The output directory.",
+    )
+    parser.add_argument(
+        "--num-processes",
+        type=int,
+        default=multiprocessing.cpu_count(),
+        help="The number of processes.",
+    )
+    parser.add_argument(
+        "--redis-host",
+        type=str,
+        default="localhost",
+        help="The Redis host.",
+    )
+    parser.add_argument(
+        "--redis-port",
+        type=int,
+        default=7777,
+        help="The Redis port.",
+    )
+    parser.add_argument(
+        "--use-assembly",
+        action="store_true",
+        help="Whether to use assembly 1.",
+    )
+    parser.add_argument(
+        "--max-file-size",
+        type=int,
+        default=None,
+    )
+    args = parser.parse_args()
+    process(args)
diff --git a/forks/boltz/scripts/process/requirements.txt b/forks/boltz/scripts/process/requirements.txt
new file mode 100644
index 00000000..d4f7611a
--- /dev/null
+++ b/forks/boltz/scripts/process/requirements.txt
@@ -0,0 +1,5 @@
+gemmi
+pdbeccdutils
+redis
+scikit-learn
+p_tqdm
\ No newline at end of file
diff --git a/forks/boltz/scripts/train/README.md b/forks/boltz/scripts/train/README.md
new file mode 100644
index 00000000..ed00f22b
--- /dev/null
+++ b/forks/boltz/scripts/train/README.md
@@ -0,0 +1 @@
+Please see our [training instructions](../../docs/training.md).
\ No newline at end of file
diff --git a/forks/boltz/scripts/train/assets/casp15_ids.txt b/forks/boltz/scripts/train/assets/casp15_ids.txt
new file mode 100644
index 00000000..b3464ddd
--- /dev/null
+++ b/forks/boltz/scripts/train/assets/casp15_ids.txt
@@ -0,0 +1,72 @@
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diff --git a/forks/boltz/scripts/train/assets/test_ids.txt b/forks/boltz/scripts/train/assets/test_ids.txt
new file mode 100644
index 00000000..2bb230da
--- /dev/null
+++ b/forks/boltz/scripts/train/assets/test_ids.txt
@@ -0,0 +1,550 @@
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diff --git a/forks/boltz/scripts/train/assets/validation_ids.txt b/forks/boltz/scripts/train/assets/validation_ids.txt
new file mode 100644
index 00000000..13f5bb93
--- /dev/null
+++ b/forks/boltz/scripts/train/assets/validation_ids.txt
@@ -0,0 +1,552 @@
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diff --git a/forks/boltz/scripts/train/configs/confidence.yaml b/forks/boltz/scripts/train/configs/confidence.yaml
new file mode 100644
index 00000000..8ed2ed94
--- /dev/null
+++ b/forks/boltz/scripts/train/configs/confidence.yaml
@@ -0,0 +1,201 @@
+trainer:
+  accelerator: gpu
+  devices: 1
+  precision: 32
+  gradient_clip_val: 10.0
+  max_epochs: -1
+  accumulate_grad_batches: 128    # to adjust depending on the number of devices
+
+# Optional set wandb here
+# wandb:
+#   name: boltz
+#   project: boltz
+#   entity: boltz
+
+
+output: SET_PATH_HERE
+pretrained: PATH_TO_STRUCTURE_CHECKPOINT_FILE
+resume: null
+disable_checkpoint: false
+matmul_precision: null
+save_top_k: -1
+load_confidence_from_trunk: false  # should be set to true only when starting from scratch, not from a pretrained confidence model
+
+data:
+  datasets:
+    - _target_: boltz.data.module.training.DatasetConfig
+      target_dir: PATH_TO_TARGETS_DIR
+      msa_dir: PATH_TO_MSA_DIR
+      prob: 1.0
+      sampler:
+        _target_: boltz.data.sample.cluster.ClusterSampler
+      cropper:
+        _target_: boltz.data.crop.boltz.BoltzCropper
+        min_neighborhood: 0
+        max_neighborhood: 40
+      split: ./scripts/train/assets/validation_ids.txt
+
+  filters:
+    - _target_: boltz.data.filter.dynamic.size.SizeFilter
+      min_chains: 1
+      max_chains: 300
+    - _target_: boltz.data.filter.dynamic.date.DateFilter
+      date: "2021-09-30"
+      ref: released
+    - _target_: boltz.data.filter.dynamic.resolution.ResolutionFilter
+      resolution: 4.0
+
+  tokenizer:
+    _target_: boltz.data.tokenize.boltz.BoltzTokenizer
+  featurizer:
+    _target_: boltz.data.feature.featurizer.BoltzFeaturizer
+
+  symmetries: PATH_TO_SYMMETRY_FILE
+  max_tokens: 512
+  max_atoms: 4608
+  max_seqs: 2048
+  pad_to_max_tokens: true
+  pad_to_max_atoms: true
+  pad_to_max_seqs: true
+  samples_per_epoch: 100000
+  batch_size: 1
+  num_workers: 4
+  random_seed: 42
+  pin_memory: true
+  overfit: null
+  crop_validation: true
+  return_train_symmetries: true
+  return_val_symmetries: true
+  train_binder_pocket_conditioned_prop: 0.3
+  val_binder_pocket_conditioned_prop: 0.3
+  binder_pocket_cutoff: 6.0
+  binder_pocket_sampling_geometric_p: 0.3
+  min_dist: 2.0
+  max_dist: 22.0
+  num_bins: 64
+  atoms_per_window_queries: 32
+  compute_constraint_features: false
+
+model:
+  _target_: boltz.model.model.Boltz1
+  atom_s: 128
+  atom_z: 16
+  token_s: 384
+  token_z: 128
+  num_bins: 64
+  atom_feature_dim: 389
+  atoms_per_window_queries: 32
+  atoms_per_window_keys: 128
+  compile_pairformer: false
+  nucleotide_rmsd_weight: 5.0
+  ligand_rmsd_weight: 10.0
+  ema: true
+  ema_decay: 0.999
+
+  embedder_args:
+    atom_encoder_depth: 3
+    atom_encoder_heads: 4
+
+  msa_args:
+    msa_s: 64
+    msa_blocks: 4
+    msa_dropout: 0.15
+    z_dropout: 0.25
+    pairwise_head_width: 32
+    pairwise_num_heads: 4
+    activation_checkpointing: true
+    offload_to_cpu: false
+
+  pairformer_args:
+    num_blocks: 48
+    num_heads: 16
+    dropout: 0.25
+    activation_checkpointing: true
+    offload_to_cpu: false
+
+  score_model_args:
+    sigma_data: 16
+    dim_fourier: 256
+    atom_encoder_depth: 3
+    atom_encoder_heads: 4
+    token_transformer_depth: 24
+    token_transformer_heads: 16
+    atom_decoder_depth: 3
+    atom_decoder_heads: 4
+    conditioning_transition_layers: 2
+    activation_checkpointing: true
+    offload_to_cpu: false
+
+  structure_prediction_training: false
+  confidence_prediction: true
+  alpha_pae: 1
+  confidence_imitate_trunk: true
+  confidence_model_args:
+    num_dist_bins: 64
+    max_dist: 22
+    add_s_to_z_prod: true
+    add_s_input_to_s: true
+    use_s_diffusion: true
+    add_z_input_to_z: true
+
+    confidence_args:
+      num_plddt_bins: 50
+      num_pde_bins: 64
+      num_pae_bins: 64
+
+  training_args:
+    recycling_steps: 3
+    sampling_steps: 200
+    diffusion_multiplicity: 16
+    diffusion_samples: 1
+    confidence_loss_weight: 3e-3
+    diffusion_loss_weight: 4.0
+    distogram_loss_weight: 3e-2
+    adam_beta_1: 0.9
+    adam_beta_2: 0.95
+    adam_eps: 0.00000001
+    lr_scheduler: af3
+    base_lr: 0.0
+    max_lr: 0.0018
+    lr_warmup_no_steps: 1000
+    lr_start_decay_after_n_steps: 50000
+    lr_decay_every_n_steps: 50000
+    lr_decay_factor: 0.95
+    symmetry_correction: true
+    run_confidence_sequentially: false
+
+  validation_args:
+    recycling_steps: 3
+    sampling_steps: 200
+    diffusion_samples: 5
+    symmetry_correction: true
+    run_confidence_sequentially: true
+
+  diffusion_process_args:
+    sigma_min: 0.0004
+    sigma_max: 160.0
+    sigma_data: 16.0
+    rho: 7
+    P_mean: -1.2
+    P_std: 1.5
+    gamma_0: 0.8
+    gamma_min: 1.0
+    noise_scale: 1.0
+    step_scale: 1.0
+    coordinate_augmentation: true
+    alignment_reverse_diff: true
+    synchronize_sigmas: true
+    use_inference_model_cache: true
+
+  diffusion_loss_args:
+    add_smooth_lddt_loss: true
+    nucleotide_loss_weight: 5.0
+    ligand_loss_weight: 10.0
+
+  steering_args:
+    fk_steering: False
+    num_particles: 3
+    fk_lambda: 4.0
+    fk_resampling_interval: 3
+    physical_guidance_update: False
+    num_gd_steps: 16 
diff --git a/forks/boltz/scripts/train/configs/full.yaml b/forks/boltz/scripts/train/configs/full.yaml
new file mode 100644
index 00000000..0c13f423
--- /dev/null
+++ b/forks/boltz/scripts/train/configs/full.yaml
@@ -0,0 +1,200 @@
+trainer:
+  accelerator: gpu
+  devices: 1
+  precision: 32
+  gradient_clip_val: 10.0
+  max_epochs: -1
+  accumulate_grad_batches: 128    # to adjust depending on the number of devices
+
+# Optional set wandb here
+# wandb:
+#   name: boltz
+#   project: boltz
+#   entity: boltz
+
+
+output: SET_PATH_HERE
+pretrained: PATH_TO_CHECKPOINT_FILE
+resume: null
+disable_checkpoint: false
+matmul_precision: null
+save_top_k: -1
+
+data:
+  datasets:
+    - _target_: boltz.data.module.training.DatasetConfig
+      target_dir: PATH_TO_TARGETS_DIR
+      msa_dir: PATH_TO_MSA_DIR
+      prob: 1.0
+      sampler:
+        _target_: boltz.data.sample.cluster.ClusterSampler
+      cropper:
+        _target_: boltz.data.crop.boltz.BoltzCropper
+        min_neighborhood: 0
+        max_neighborhood: 40
+      split: ./scripts/train/assets/validation_ids.txt
+
+  filters:
+    - _target_: boltz.data.filter.dynamic.size.SizeFilter
+      min_chains: 1
+      max_chains: 300
+    - _target_: boltz.data.filter.dynamic.date.DateFilter
+      date: "2021-09-30"
+      ref: released
+    - _target_: boltz.data.filter.dynamic.resolution.ResolutionFilter
+      resolution: 4.0
+
+  tokenizer:
+    _target_: boltz.data.tokenize.boltz.BoltzTokenizer
+  featurizer:
+    _target_: boltz.data.feature.featurizer.BoltzFeaturizer
+
+  symmetries: PATH_TO_SYMMETRY_FILE
+  max_tokens: 512
+  max_atoms: 4608
+  max_seqs: 2048
+  pad_to_max_tokens: true
+  pad_to_max_atoms: true
+  pad_to_max_seqs: true
+  samples_per_epoch: 100000
+  batch_size: 1
+  num_workers: 4
+  random_seed: 42
+  pin_memory: true
+  overfit: null
+  crop_validation: true
+  return_train_symmetries: true
+  return_val_symmetries: true
+  train_binder_pocket_conditioned_prop: 0.3
+  val_binder_pocket_conditioned_prop: 0.3
+  binder_pocket_cutoff: 6.0
+  binder_pocket_sampling_geometric_p: 0.3
+  min_dist: 2.0
+  max_dist: 22.0
+  num_bins: 64
+  atoms_per_window_queries: 32
+  compute_constraint_features: false
+
+model:
+  _target_: boltz.model.model.Boltz1
+  atom_s: 128
+  atom_z: 16
+  token_s: 384
+  token_z: 128
+  num_bins: 64
+  atom_feature_dim: 389
+  atoms_per_window_queries: 32
+  atoms_per_window_keys: 128
+  compile_pairformer: false
+  nucleotide_rmsd_weight: 5.0
+  ligand_rmsd_weight: 10.0
+  ema: true
+  ema_decay: 0.999
+
+  embedder_args:
+    atom_encoder_depth: 3
+    atom_encoder_heads: 4
+
+  msa_args:
+    msa_s: 64
+    msa_blocks: 4
+    msa_dropout: 0.15
+    z_dropout: 0.25
+    pairwise_head_width: 32
+    pairwise_num_heads: 4
+    activation_checkpointing: true
+    offload_to_cpu: false
+
+  pairformer_args:
+    num_blocks: 48
+    num_heads: 16
+    dropout: 0.25
+    activation_checkpointing: true
+    offload_to_cpu: false
+
+  score_model_args:
+    sigma_data: 16
+    dim_fourier: 256
+    atom_encoder_depth: 3
+    atom_encoder_heads: 4
+    token_transformer_depth: 24
+    token_transformer_heads: 16
+    atom_decoder_depth: 3
+    atom_decoder_heads: 4
+    conditioning_transition_layers: 2
+    activation_checkpointing: true
+    offload_to_cpu: false
+
+  structure_prediction_training: true
+  confidence_prediction: true
+  alpha_pae: 1
+  confidence_imitate_trunk: true
+  confidence_model_args:
+    num_dist_bins: 64
+    max_dist: 22
+    add_s_to_z_prod: true
+    add_s_input_to_s: true
+    use_s_diffusion: true
+    add_z_input_to_z: true
+
+    confidence_args:
+      num_plddt_bins: 50
+      num_pde_bins: 64
+      num_pae_bins: 64
+
+  training_args:
+    recycling_steps: 3
+    sampling_steps: 200
+    diffusion_multiplicity: 16
+    diffusion_samples: 1
+    confidence_loss_weight: 3e-3
+    diffusion_loss_weight: 4.0
+    distogram_loss_weight: 3e-2
+    adam_beta_1: 0.9
+    adam_beta_2: 0.95
+    adam_eps: 0.00000001
+    lr_scheduler: af3
+    base_lr: 0.0
+    max_lr: 0.0018
+    lr_warmup_no_steps: 1000
+    lr_start_decay_after_n_steps: 50000
+    lr_decay_every_n_steps: 50000
+    lr_decay_factor: 0.95
+    symmetry_correction: true
+    run_confidence_sequentially: false
+
+  validation_args:
+    recycling_steps: 3
+    sampling_steps: 200
+    diffusion_samples: 5
+    symmetry_correction: true
+    run_confidence_sequentially: true
+
+  diffusion_process_args:
+    sigma_min: 0.0004
+    sigma_max: 160.0
+    sigma_data: 16.0
+    rho: 7
+    P_mean: -1.2
+    P_std: 1.5
+    gamma_0: 0.8
+    gamma_min: 1.0
+    noise_scale: 1.0
+    step_scale: 1.0
+    coordinate_augmentation: true
+    alignment_reverse_diff: true
+    synchronize_sigmas: true
+    use_inference_model_cache: true
+
+  diffusion_loss_args:
+    add_smooth_lddt_loss: true
+    nucleotide_loss_weight: 5.0
+    ligand_loss_weight: 10.0
+
+  steering_args:
+    fk_steering: False
+    num_particles: 3
+    fk_lambda: 4.0
+    fk_resampling_interval: 3
+    physical_guidance_update: False
+    num_gd_steps: 16 
diff --git a/forks/boltz/scripts/train/configs/structure.yaml b/forks/boltz/scripts/train/configs/structure.yaml
new file mode 100644
index 00000000..6591f386
--- /dev/null
+++ b/forks/boltz/scripts/train/configs/structure.yaml
@@ -0,0 +1,194 @@
+trainer:
+  accelerator: gpu
+  devices: 1
+  precision: 32
+  gradient_clip_val: 10.0
+  max_epochs: -1
+  accumulate_grad_batches: 128    # to adjust depending on the number of devices
+
+# Optional set wandb here
+# wandb:
+#   name: boltz
+#   project: boltz
+#   entity: boltz
+
+output: SET_PATH_HERE
+pretrained: PATH_TO_CHECKPOINT_FILE
+resume: null
+disable_checkpoint: false
+matmul_precision: null
+save_top_k: -1
+
+data:
+  datasets:
+    - _target_: boltz.data.module.training.DatasetConfig
+      target_dir: PATH_TO_TARGETS_DIR
+      msa_dir: PATH_TO_MSA_DIR
+      prob: 1.0
+      sampler:
+        _target_: boltz.data.sample.cluster.ClusterSampler
+      cropper:
+        _target_: boltz.data.crop.boltz.BoltzCropper
+        min_neighborhood: 0
+        max_neighborhood: 40
+      split: ./scripts/train/assets/validation_ids.txt
+
+  filters:
+    - _target_: boltz.data.filter.dynamic.size.SizeFilter
+      min_chains: 1
+      max_chains: 300
+    - _target_: boltz.data.filter.dynamic.date.DateFilter
+      date: "2021-09-30"
+      ref: released
+    - _target_: boltz.data.filter.dynamic.resolution.ResolutionFilter
+      resolution: 9.0
+  
+  tokenizer:
+    _target_: boltz.data.tokenize.boltz.BoltzTokenizer
+  featurizer:
+    _target_: boltz.data.feature.featurizer.BoltzFeaturizer
+
+  symmetries: PATH_TO_SYMMETRY_FILE
+  max_tokens: 512
+  max_atoms: 4608
+  max_seqs: 2048
+  pad_to_max_tokens: true
+  pad_to_max_atoms: true
+  pad_to_max_seqs: true
+  samples_per_epoch: 100000
+  batch_size: 1
+  num_workers: 4
+  random_seed: 42
+  pin_memory: true
+  overfit: null
+  crop_validation: false
+  return_train_symmetries: false
+  return_val_symmetries: true
+  train_binder_pocket_conditioned_prop: 0.3
+  val_binder_pocket_conditioned_prop: 0.3
+  binder_pocket_cutoff: 6.0
+  binder_pocket_sampling_geometric_p: 0.3
+  min_dist: 2.0
+  max_dist: 22.0
+  num_bins: 64
+  atoms_per_window_queries: 32
+  compute_constraint_features: false
+
+model:
+  _target_: boltz.model.model.Boltz1
+  atom_s: 128
+  atom_z: 16
+  token_s: 384
+  token_z: 128
+  num_bins: 64
+  atom_feature_dim: 389
+  atoms_per_window_queries: 32
+  atoms_per_window_keys: 128
+  compile_pairformer: false
+  nucleotide_rmsd_weight: 5.0
+  ligand_rmsd_weight: 10.0
+  ema: true
+  ema_decay: 0.999
+
+  embedder_args:
+    atom_encoder_depth: 3
+    atom_encoder_heads: 4
+
+  msa_args:
+    msa_s: 64
+    msa_blocks: 4
+    msa_dropout: 0.15
+    z_dropout: 0.25
+    pairwise_head_width: 32
+    pairwise_num_heads: 4
+    activation_checkpointing: true
+    offload_to_cpu: false
+
+  pairformer_args:
+    num_blocks: 48
+    num_heads: 16
+    dropout: 0.25
+    activation_checkpointing: true
+    offload_to_cpu: false
+
+  score_model_args:
+    sigma_data: 16
+    dim_fourier: 256
+    atom_encoder_depth: 3
+    atom_encoder_heads: 4
+    token_transformer_depth: 24
+    token_transformer_heads: 16
+    atom_decoder_depth: 3
+    atom_decoder_heads: 4
+    conditioning_transition_layers: 2
+    activation_checkpointing: true
+    offload_to_cpu: false
+
+  confidence_prediction: false
+  confidence_model_args:
+    num_dist_bins: 64
+    max_dist: 22
+    add_s_to_z_prod: true
+    add_s_input_to_s: true
+    use_s_diffusion: true
+    add_z_input_to_z: true
+
+    confidence_args:
+      num_plddt_bins: 50
+      num_pde_bins: 64
+      num_pae_bins: 64
+
+  training_args:
+    recycling_steps: 3
+    sampling_steps: 20
+    diffusion_multiplicity: 16
+    diffusion_samples: 2
+    confidence_loss_weight: 1e-4
+    diffusion_loss_weight: 4.0
+    distogram_loss_weight: 3e-2
+    adam_beta_1: 0.9
+    adam_beta_2: 0.95
+    adam_eps: 0.00000001
+    lr_scheduler: af3
+    base_lr: 0.0
+    max_lr: 0.0018
+    lr_warmup_no_steps: 1000
+    lr_start_decay_after_n_steps: 50000
+    lr_decay_every_n_steps: 50000
+    lr_decay_factor: 0.95
+
+  validation_args:
+    recycling_steps: 3
+    sampling_steps: 200
+    diffusion_samples: 5
+    symmetry_correction: true
+    run_confidence_sequentially: false
+
+  diffusion_process_args:
+    sigma_min: 0.0004
+    sigma_max: 160.0
+    sigma_data: 16.0
+    rho: 7
+    P_mean: -1.2
+    P_std: 1.5
+    gamma_0: 0.8
+    gamma_min: 1.0
+    noise_scale: 1.0
+    step_scale: 1.0
+    coordinate_augmentation: true
+    alignment_reverse_diff: true
+    synchronize_sigmas: true
+    use_inference_model_cache: true
+
+  diffusion_loss_args:
+    add_smooth_lddt_loss: true
+    nucleotide_loss_weight: 5.0
+    ligand_loss_weight: 10.0
+
+  steering_args:
+    fk_steering: False
+    num_particles: 3
+    fk_lambda: 4.0
+    fk_resampling_interval: 3
+    physical_guidance_update: False
+    num_gd_steps: 16 
diff --git a/forks/boltz/scripts/train/train.py b/forks/boltz/scripts/train/train.py
new file mode 100644
index 00000000..f83966bd
--- /dev/null
+++ b/forks/boltz/scripts/train/train.py
@@ -0,0 +1,241 @@
+import os
+import random
+import string
+import sys
+from dataclasses import dataclass
+from pathlib import Path
+from typing import Optional
+
+import hydra
+import omegaconf
+import pytorch_lightning as pl
+import torch
+import torch.multiprocessing
+from omegaconf import OmegaConf, listconfig
+from pytorch_lightning import LightningModule
+from pytorch_lightning.callbacks.model_checkpoint import ModelCheckpoint
+from pytorch_lightning.loggers import WandbLogger
+from pytorch_lightning.strategies import DDPStrategy
+from pytorch_lightning.utilities import rank_zero_only
+
+from boltz.data.module.training import BoltzTrainingDataModule, DataConfig
+
+
+@dataclass
+class TrainConfig:
+    """Train configuration.
+
+    Attributes
+    ----------
+    data : DataConfig
+        The data configuration.
+    model : ModelConfig
+        The model configuration.
+    output : str
+        The output directory.
+    trainer : Optional[dict]
+        The trainer configuration.
+    resume : Optional[str]
+        The resume checkpoint.
+    pretrained : Optional[str]
+        The pretrained model.
+    wandb : Optional[dict]
+        The wandb configuration.
+    disable_checkpoint : bool
+        Disable checkpoint.
+    matmul_precision : Optional[str]
+        The matmul precision.
+    find_unused_parameters : Optional[bool]
+        Find unused parameters.
+    save_top_k : Optional[int]
+        Save top k checkpoints.
+    validation_only : bool
+        Run validation only.
+    debug : bool
+        Debug mode.
+    strict_loading : bool
+        Fail on mismatched checkpoint weights.
+    load_confidence_from_trunk: Optional[bool]
+        Load pre-trained confidence weights from trunk.
+
+    """
+
+    data: DataConfig
+    model: LightningModule
+    output: str
+    trainer: Optional[dict] = None
+    resume: Optional[str] = None
+    pretrained: Optional[str] = None
+    wandb: Optional[dict] = None
+    disable_checkpoint: bool = False
+    matmul_precision: Optional[str] = None
+    find_unused_parameters: Optional[bool] = False
+    save_top_k: Optional[int] = 1
+    validation_only: bool = False
+    debug: bool = False
+    strict_loading: bool = True
+    load_confidence_from_trunk: Optional[bool] = False
+
+
+def train(raw_config: str, args: list[str]) -> None:  # noqa: C901, PLR0912, PLR0915
+    """Run training.
+
+    Parameters
+    ----------
+    raw_config : str
+        The input yaml configuration.
+    args : list[str]
+        Any command line overrides.
+
+    """
+    # Load the configuration
+    raw_config = omegaconf.OmegaConf.load(raw_config)
+
+    # Apply input arguments
+    args = omegaconf.OmegaConf.from_dotlist(args)
+    raw_config = omegaconf.OmegaConf.merge(raw_config, args)
+
+    # Instantiate the task
+    cfg = hydra.utils.instantiate(raw_config)
+    cfg = TrainConfig(**cfg)
+
+    # Set matmul precision
+    if cfg.matmul_precision is not None:
+        torch.set_float32_matmul_precision(cfg.matmul_precision)
+
+    # Create trainer dict
+    trainer = cfg.trainer
+    if trainer is None:
+        trainer = {}
+
+    # Flip some arguments in debug mode
+    devices = trainer.get("devices", 1)
+
+    wandb = cfg.wandb
+    if cfg.debug:
+        if isinstance(devices, int):
+            devices = 1
+        elif isinstance(devices, (list, listconfig.ListConfig)):
+            devices = [devices[0]]
+        trainer["devices"] = devices
+        cfg.data.num_workers = 0
+        if wandb:
+            wandb = None
+
+    # Create objects
+    data_config = DataConfig(**cfg.data)
+    data_module = BoltzTrainingDataModule(data_config)
+    model_module = cfg.model
+
+    if cfg.pretrained and not cfg.resume:
+        # Load the pretrained weights into the confidence module
+        if cfg.load_confidence_from_trunk:
+            checkpoint = torch.load(cfg.pretrained, map_location="cpu")
+
+            # Modify parameter names in the state_dict
+            new_state_dict = {}
+            for key, value in checkpoint["state_dict"].items():
+                if not key.startswith("structure_module") and not key.startswith(
+                    "distogram_module"
+                ):
+                    new_key = "confidence_module." + key
+                    new_state_dict[new_key] = value
+            new_state_dict.update(checkpoint["state_dict"])
+
+            # Update the checkpoint with the new state_dict
+            checkpoint["state_dict"] = new_state_dict
+
+            # Save the modified checkpoint
+            random_string = "".join(
+                random.choices(string.ascii_lowercase + string.digits, k=10)
+            )
+            file_path = os.path.dirname(cfg.pretrained) + "/" + random_string + ".ckpt"
+            print(
+                f"Saving modified checkpoint to {file_path} created by broadcasting trunk of {cfg.pretrained} to confidence module."
+            )
+            torch.save(checkpoint, file_path)
+        else:
+            file_path = cfg.pretrained
+
+        print(f"Loading model from {file_path}")
+        model_module = type(model_module).load_from_checkpoint(
+            file_path, map_location="cpu", strict=False, **(model_module.hparams)
+        )
+
+        if cfg.load_confidence_from_trunk:
+            os.remove(file_path)
+
+    # Create checkpoint callback
+    callbacks = []
+    dirpath = cfg.output
+    if not cfg.disable_checkpoint:
+        mc = ModelCheckpoint(
+            monitor="val/lddt",
+            save_top_k=cfg.save_top_k,
+            save_last=True,
+            mode="max",
+            every_n_epochs=1,
+        )
+        callbacks = [mc]
+
+    # Create wandb logger
+    loggers = []
+    if wandb:
+        wdb_logger = WandbLogger(
+            name=wandb["name"],
+            group=wandb["name"],
+            save_dir=cfg.output,
+            project=wandb["project"],
+            entity=wandb["entity"],
+            log_model=False,
+        )
+        loggers.append(wdb_logger)
+        # Save the config to wandb
+
+        @rank_zero_only
+        def save_config_to_wandb() -> None:
+            config_out = Path(wdb_logger.experiment.dir) / "run.yaml"
+            with Path.open(config_out, "w") as f:
+                OmegaConf.save(raw_config, f)
+            wdb_logger.experiment.save(str(config_out))
+
+        save_config_to_wandb()
+
+    # Set up trainer
+    strategy = "auto"
+    if (isinstance(devices, int) and devices > 1) or (
+        isinstance(devices, (list, listconfig.ListConfig)) and len(devices) > 1
+    ):
+        strategy = DDPStrategy(find_unused_parameters=cfg.find_unused_parameters)
+
+    trainer = pl.Trainer(
+        default_root_dir=str(dirpath),
+        strategy=strategy,
+        callbacks=callbacks,
+        logger=loggers,
+        enable_checkpointing=not cfg.disable_checkpoint,
+        reload_dataloaders_every_n_epochs=1,
+        **trainer,
+    )
+
+    if not cfg.strict_loading:
+        model_module.strict_loading = False
+
+    if cfg.validation_only:
+        trainer.validate(
+            model_module,
+            datamodule=data_module,
+            ckpt_path=cfg.resume,
+        )
+    else:
+        trainer.fit(
+            model_module,
+            datamodule=data_module,
+            ckpt_path=cfg.resume,
+        )
+
+
+if __name__ == "__main__":
+    arg1 = sys.argv[1]
+    arg2 = sys.argv[2:]
+    train(arg1, arg2)
diff --git a/forks/boltz/src/boltz/__init__.py b/forks/boltz/src/boltz/__init__.py
new file mode 100644
index 00000000..ce79ee0a
--- /dev/null
+++ b/forks/boltz/src/boltz/__init__.py
@@ -0,0 +1,7 @@
+from importlib.metadata import PackageNotFoundError, version
+
+try:  # noqa: SIM105
+    __version__ = version("boltz")
+except PackageNotFoundError:
+    # package is not installed
+    pass
diff --git a/forks/boltz/src/boltz/data/__init__.py b/forks/boltz/src/boltz/data/__init__.py
new file mode 100644
index 00000000..e69de29b
diff --git a/forks/boltz/src/boltz/data/const.py b/forks/boltz/src/boltz/data/const.py
new file mode 100644
index 00000000..71fc1b62
--- /dev/null
+++ b/forks/boltz/src/boltz/data/const.py
@@ -0,0 +1,1184 @@
+####################################################################################################
+# CHAINS
+####################################################################################################
+
+chain_types = [
+    "PROTEIN",
+    "DNA",
+    "RNA",
+    "NONPOLYMER",
+]
+chain_type_ids = {chain: i for i, chain in enumerate(chain_types)}
+
+out_types = [
+    "dna_protein",
+    "rna_protein",
+    "ligand_protein",
+    "dna_ligand",
+    "rna_ligand",
+    "intra_ligand",
+    "intra_dna",
+    "intra_rna",
+    "intra_protein",
+    "protein_protein",
+    "modified",
+]
+
+out_types_weights_af3 = {
+    "dna_protein": 10.0,
+    "rna_protein": 10.0,
+    "ligand_protein": 10.0,
+    "dna_ligand": 5.0,
+    "rna_ligand": 5.0,
+    "intra_ligand": 20.0,
+    "intra_dna": 4.0,
+    "intra_rna": 16.0,
+    "intra_protein": 20.0,
+    "protein_protein": 20.0,
+    "modified": 0.0,
+}
+
+out_types_weights = {
+    "dna_protein": 5.0,
+    "rna_protein": 5.0,
+    "ligand_protein": 20.0,
+    "dna_ligand": 2.0,
+    "rna_ligand": 2.0,
+    "intra_ligand": 20.0,
+    "intra_dna": 2.0,
+    "intra_rna": 8.0,
+    "intra_protein": 20.0,
+    "protein_protein": 20.0,
+    "modified": 0.0,
+}
+
+
+out_single_types = ["protein", "ligand", "dna", "rna"]
+
+clash_types = [
+    "dna_protein",
+    "rna_protein",
+    "ligand_protein",
+    "protein_protein",
+    "dna_ligand",
+    "rna_ligand",
+    "ligand_ligand",
+    "rna_dna",
+    "dna_dna",
+    "rna_rna",
+]
+
+chain_types_to_clash_type = {
+    frozenset(("PROTEIN", "DNA")): "dna_protein",
+    frozenset(("PROTEIN", "RNA")): "rna_protein",
+    frozenset(("PROTEIN", "NONPOLYMER")): "ligand_protein",
+    frozenset(("PROTEIN",)): "protein_protein",
+    frozenset(("NONPOLYMER", "DNA")): "dna_ligand",
+    frozenset(("NONPOLYMER", "RNA")): "rna_ligand",
+    frozenset(("NONPOLYMER",)): "ligand_ligand",
+    frozenset(("DNA", "RNA")): "rna_dna",
+    frozenset(("DNA",)): "dna_dna",
+    frozenset(("RNA",)): "rna_rna",
+}
+
+chain_type_to_out_single_type = {
+    "PROTEIN": "protein",
+    "DNA": "dna",
+    "RNA": "rna",
+    "NONPOLYMER": "ligand",
+}
+####################################################################################################
+# RESIDUES & TOKENS
+####################################################################################################
+
+
+canonical_tokens = [
+    "ALA",
+    "ARG",
+    "ASN",
+    "ASP",
+    "CYS",
+    "GLN",
+    "GLU",
+    "GLY",
+    "HIS",
+    "ILE",
+    "LEU",
+    "LYS",
+    "MET",
+    "PHE",
+    "PRO",
+    "SER",
+    "THR",
+    "TRP",
+    "TYR",
+    "VAL",
+    "UNK",  # unknown protein token
+]
+
+tokens = [
+    "<pad>",
+    "-",
+    *canonical_tokens,
+    "A",
+    "G",
+    "C",
+    "U",
+    "N",  # unknown rna token
+    "DA",
+    "DG",
+    "DC",
+    "DT",
+    "DN",  # unknown dna token
+]
+
+token_ids = {token: i for i, token in enumerate(tokens)}
+num_tokens = len(tokens)
+unk_token = {"PROTEIN": "UNK", "DNA": "DN", "RNA": "N"}
+unk_token_ids = {m: token_ids[t] for m, t in unk_token.items()}
+
+prot_letter_to_token = {
+    "A": "ALA",
+    "R": "ARG",
+    "N": "ASN",
+    "D": "ASP",
+    "C": "CYS",
+    "E": "GLU",
+    "Q": "GLN",
+    "G": "GLY",
+    "H": "HIS",
+    "I": "ILE",
+    "L": "LEU",
+    "K": "LYS",
+    "M": "MET",
+    "F": "PHE",
+    "P": "PRO",
+    "S": "SER",
+    "T": "THR",
+    "W": "TRP",
+    "Y": "TYR",
+    "V": "VAL",
+    "X": "UNK",
+    "J": "UNK",
+    "B": "UNK",
+    "Z": "UNK",
+    "O": "UNK",
+    "U": "UNK",
+    "-": "-",
+}
+
+prot_token_to_letter = {v: k for k, v in prot_letter_to_token.items()}
+prot_token_to_letter["UNK"] = "X"
+
+rna_letter_to_token = {
+    "A": "A",
+    "G": "G",
+    "C": "C",
+    "U": "U",
+    "N": "N",
+}
+rna_token_to_letter = {v: k for k, v in rna_letter_to_token.items()}
+
+dna_letter_to_token = {
+    "A": "DA",
+    "G": "DG",
+    "C": "DC",
+    "T": "DT",
+    "N": "DN",
+}
+dna_token_to_letter = {v: k for k, v in dna_letter_to_token.items()}
+
+####################################################################################################
+# ATOMS
+####################################################################################################
+
+num_elements = 128
+
+chirality_types = [
+    "CHI_UNSPECIFIED",
+    "CHI_TETRAHEDRAL_CW",
+    "CHI_TETRAHEDRAL_CCW",
+    "CHI_SQUAREPLANAR",
+    "CHI_OCTAHEDRAL",
+    "CHI_TRIGONALBIPYRAMIDAL",
+    "CHI_OTHER",
+]
+chirality_type_ids = {chirality: i for i, chirality in enumerate(chirality_types)}
+unk_chirality_type = "CHI_OTHER"
+
+hybridization_map = [
+    "S",
+    "SP",
+    "SP2",
+    "SP2D",
+    "SP3",
+    "SP3D",
+    "SP3D2",
+    "OTHER",
+    "UNSPECIFIED",
+]
+hybridization_type_ids = {hybrid: i for i, hybrid in enumerate(hybridization_map)}
+unk_hybridization_type = "UNSPECIFIED"
+
+# fmt: off
+ref_atoms = {
+    "PAD": [],
+    "UNK": ["N", "CA", "C", "O", "CB"],
+    "-": [],
+    "ALA": ["N", "CA", "C", "O", "CB"],
+    "ARG": ["N", "CA", "C", "O", "CB", "CG", "CD", "NE", "CZ", "NH1", "NH2"],
+    "ASN": ["N", "CA", "C", "O", "CB", "CG", "OD1", "ND2"],
+    "ASP": ["N", "CA", "C", "O", "CB", "CG", "OD1", "OD2"],
+    "CYS": ["N", "CA", "C", "O", "CB", "SG"],
+    "GLN": ["N", "CA", "C", "O", "CB", "CG", "CD", "OE1", "NE2"],
+    "GLU": ["N", "CA", "C", "O", "CB", "CG", "CD", "OE1", "OE2"],
+    "GLY": ["N", "CA", "C", "O"],
+    "HIS": ["N", "CA", "C", "O", "CB", "CG", "ND1", "CD2", "CE1", "NE2"],
+    "ILE": ["N", "CA", "C", "O", "CB", "CG1", "CG2", "CD1"],
+    "LEU": ["N", "CA", "C", "O", "CB", "CG", "CD1", "CD2"],
+    "LYS": ["N", "CA", "C", "O", "CB", "CG", "CD", "CE", "NZ"],
+    "MET": ["N", "CA", "C", "O", "CB", "CG", "SD", "CE"],
+    "PHE": ["N", "CA", "C", "O", "CB", "CG", "CD1", "CD2", "CE1", "CE2", "CZ"],
+    "PRO": ["N", "CA", "C", "O", "CB", "CG", "CD"],
+    "SER": ["N", "CA", "C", "O", "CB", "OG"],
+    "THR": ["N", "CA", "C", "O", "CB", "OG1", "CG2"],
+    "TRP": ["N", "CA", "C", "O", "CB", "CG", "CD1", "CD2", "NE1", "CE2", "CE3", "CZ2", "CZ3", "CH2"],  # noqa: E501
+    "TYR": ["N", "CA", "C", "O", "CB", "CG", "CD1", "CD2", "CE1", "CE2", "CZ", "OH"],
+    "VAL": ["N", "CA", "C", "O", "CB", "CG1", "CG2"],
+    "A": ["P", "OP1", "OP2", "O5'", "C5'", "C4'", "O4'", "C3'", "O3'", "C2'", "O2'", "C1'", "N9", "C8", "N7", "C5", "C6", "N6", "N1", "C2", "N3", "C4"],  # noqa: E501
+    "G": ["P", "OP1", "OP2", "O5'", "C5'", "C4'", "O4'", "C3'", "O3'", "C2'", "O2'", "C1'", "N9", "C8", "N7", "C5", "C6", "O6", "N1", "C2", "N2", "N3", "C4"],  # noqa: E501
+    "C": ["P", "OP1", "OP2", "O5'", "C5'", "C4'", "O4'", "C3'", "O3'", "C2'", "O2'", "C1'", "N1", "C2", "O2", "N3", "C4", "N4", "C5", "C6"],  # noqa: E501
+    "U": ["P", "OP1", "OP2", "O5'", "C5'", "C4'", "O4'", "C3'", "O3'", "C2'", "O2'", "C1'", "N1", "C2", "O2", "N3", "C4", "O4", "C5", "C6"],  # noqa: E501
+    "N": ["P", "OP1", "OP2", "O5'", "C5'", "C4'", "O4'", "C3'", "O3'", "C2'", "O2'", "C1'"],  # noqa: E501
+    "DA": ["P", "OP1", "OP2", "O5'", "C5'", "C4'", "O4'", "C3'", "O3'", "C2'", "C1'", "N9", "C8", "N7", "C5", "C6", "N6", "N1", "C2", "N3", "C4"],  # noqa: E501
+    "DG": ["P", "OP1", "OP2", "O5'", "C5'", "C4'", "O4'", "C3'", "O3'", "C2'", "C1'", "N9", "C8", "N7", "C5", "C6", "O6", "N1", "C2", "N2", "N3", "C4"],  # noqa: E501
+    "DC": ["P", "OP1", "OP2", "O5'", "C5'", "C4'", "O4'", "C3'", "O3'", "C2'", "C1'", "N1", "C2", "O2", "N3", "C4", "N4", "C5", "C6"],  # noqa: E501
+    "DT": ["P", "OP1", "OP2", "O5'", "C5'", "C4'", "O4'", "C3'", "O3'", "C2'", "C1'", "N1", "C2", "O2", "N3", "C4", "O4", "C5", "C7", "C6"],  # noqa: E501
+    "DN": ["P", "OP1", "OP2", "O5'", "C5'", "C4'", "O4'", "C3'", "O3'", "C2'", "C1'"]
+}
+
+protein_backbone_atom_names = ["N", "CA", "C", "O"]
+nucleic_backbone_atom_names = ["P", "OP1", "OP2", "O5'", "C5'", "C4'", "O4'", "C3'", "O3'", "C2'", "O2'", "C1'"]
+
+protein_backbone_atom_index = {name: i for i, name in enumerate(protein_backbone_atom_names)}
+nucleic_backbone_atom_index = {name: i for i, name in enumerate(nucleic_backbone_atom_names)}
+
+ref_symmetries = {
+    "PAD": [],
+    "ALA": [],
+    "ARG": [],
+    "ASN": [],
+    "ASP": [[(6, 7), (7, 6)]],
+    "CYS": [],
+    "GLN": [],
+    "GLU": [[(7, 8), (8, 7)]],
+    "GLY": [],
+    "HIS": [],
+    "ILE": [],
+    "LEU": [],
+    "LYS": [],
+    "MET": [],
+    "PHE": [[(6, 7), (7, 6), (8, 9), (9, 8)]],
+    "PRO": [],
+    "SER": [],
+    "THR": [],
+    "TRP": [],
+    "TYR": [[(6, 7), (7, 6), (8, 9), (9, 8)]],
+    "VAL": [],
+    "A": [[(1, 2), (2, 1)]],
+    "G": [[(1, 2), (2, 1)]],
+    "C": [[(1, 2), (2, 1)]],
+    "U": [[(1, 2), (2, 1)]],
+    #"N": [[(1, 2), (2, 1)]],
+    "DA": [[(1, 2), (2, 1)]],
+    "DG": [[(1, 2), (2, 1)]],
+    "DC": [[(1, 2), (2, 1)]],
+    "DT": [[(1, 2), (2, 1)]],
+    #"DN": [[(1, 2), (2, 1)]]
+}
+
+
+res_to_center_atom = {
+    "UNK": "CA",
+    "ALA": "CA",
+    "ARG": "CA",
+    "ASN": "CA",
+    "ASP": "CA",
+    "CYS": "CA",
+    "GLN": "CA",
+    "GLU": "CA",
+    "GLY": "CA",
+    "HIS": "CA",
+    "ILE": "CA",
+    "LEU": "CA",
+    "LYS": "CA",
+    "MET": "CA",
+    "PHE": "CA",
+    "PRO": "CA",
+    "SER": "CA",
+    "THR": "CA",
+    "TRP": "CA",
+    "TYR": "CA",
+    "VAL": "CA",
+    "A": "C1'",
+    "G": "C1'",
+    "C": "C1'",
+    "U": "C1'",
+    "N": "C1'",
+    "DA": "C1'",
+    "DG": "C1'",
+    "DC": "C1'",
+    "DT": "C1'",
+    "DN": "C1'"
+}
+
+res_to_disto_atom = {
+    "UNK": "CB",
+    "ALA": "CB",
+    "ARG": "CB",
+    "ASN": "CB",
+    "ASP": "CB",
+    "CYS": "CB",
+    "GLN": "CB",
+    "GLU": "CB",
+    "GLY": "CA",
+    "HIS": "CB",
+    "ILE": "CB",
+    "LEU": "CB",
+    "LYS": "CB",
+    "MET": "CB",
+    "PHE": "CB",
+    "PRO": "CB",
+    "SER": "CB",
+    "THR": "CB",
+    "TRP": "CB",
+    "TYR": "CB",
+    "VAL": "CB",
+    "A": "C4",
+    "G": "C4",
+    "C": "C2",
+    "U": "C2",
+    "N": "C1'",
+    "DA": "C4",
+    "DG": "C4",
+    "DC": "C2",
+    "DT": "C2",
+    "DN": "C1'"
+}
+
+res_to_center_atom_id = {
+    res: ref_atoms[res].index(atom)
+    for res, atom in res_to_center_atom.items()
+}
+
+res_to_disto_atom_id = {
+    res: ref_atoms[res].index(atom)
+    for res, atom in res_to_disto_atom.items()
+}
+
+# fmt: on
+
+####################################################################################################
+# BONDS
+####################################################################################################
+
+atom_interface_cutoff = 5.0
+interface_cutoff = 15.0
+
+bond_types = [
+    "OTHER",
+    "SINGLE",
+    "DOUBLE",
+    "TRIPLE",
+    "AROMATIC",
+    "COVALENT",
+]
+bond_type_ids = {bond: i for i, bond in enumerate(bond_types)}
+unk_bond_type = "OTHER"
+
+
+####################################################################################################
+# Contacts
+####################################################################################################
+
+
+pocket_contact_info = {
+    "UNSPECIFIED": 0,
+    "UNSELECTED": 1,
+    "POCKET": 2,
+    "BINDER": 3,
+}
+
+contact_conditioning_info = {
+    "UNSPECIFIED": 0,
+    "UNSELECTED": 1,
+    "POCKET>BINDER": 2,
+    "BINDER>POCKET": 3,
+    "CONTACT": 4,
+}
+
+
+####################################################################################################
+# MSA
+####################################################################################################
+
+max_msa_seqs = 16384
+max_paired_seqs = 8192
+
+
+####################################################################################################
+# CHUNKING
+####################################################################################################
+
+chunk_size_threshold = 384
+
+####################################################################################################
+# Method conditioning
+####################################################################################################
+
+# Methods
+method_types_ids = {
+    "MD": 0,
+    "X-RAY DIFFRACTION": 1,
+    "ELECTRON MICROSCOPY": 2,
+    "SOLUTION NMR": 3,
+    "SOLID-STATE NMR": 4,
+    "NEUTRON DIFFRACTION": 4,
+    "ELECTRON CRYSTALLOGRAPHY": 4,
+    "FIBER DIFFRACTION": 4,
+    "POWDER DIFFRACTION": 4,
+    "INFRARED SPECTROSCOPY": 4,
+    "FLUORESCENCE TRANSFER": 4,
+    "EPR": 4,
+    "THEORETICAL MODEL": 4,
+    "SOLUTION SCATTERING": 4,
+    "OTHER": 4,
+    "AFDB": 5,
+    "BOLTZ-1": 6,
+    "FUTURE1": 7,  # Placeholder for future supervision sources
+    "FUTURE2": 8,
+    "FUTURE3": 9,
+    "FUTURE4": 10,
+    "FUTURE5": 11,
+}
+method_types_ids = {k.lower(): v for k, v in method_types_ids.items()}
+num_method_types = len(set(method_types_ids.values()))
+
+# Temperature
+temperature_bins = [(265, 280), (280, 295), (295, 310)]
+temperature_bins_ids = {temp: i for i, temp in enumerate(temperature_bins)}
+temperature_bins_ids["other"] = len(temperature_bins)
+num_temp_bins = len(temperature_bins_ids)
+
+
+# pH
+ph_bins = [(0, 6), (6, 8), (8, 14)]
+ph_bins_ids = {ph: i for i, ph in enumerate(ph_bins)}
+ph_bins_ids["other"] = len(ph_bins)
+num_ph_bins = len(ph_bins_ids)
+
+####################################################################################################
+# VDW_RADII
+####################################################################################################
+
+# fmt: off
+vdw_radii = [
+    1.2, 1.4, 2.2, 1.9, 1.8, 1.7, 1.6, 1.55, 1.5, 1.54,
+    2.4, 2.2, 2.1, 2.1, 1.95, 1.8, 1.8, 1.88, 2.8, 2.4,
+    2.3, 2.15, 2.05, 2.05, 2.05, 2.05, 2.0, 2.0, 2.0, 2.1,
+    2.1, 2.1, 2.05, 1.9, 1.9, 2.02, 2.9, 2.55, 2.4, 2.3,
+    2.15, 2.1, 2.05, 2.05, 2.0, 2.05, 2.1, 2.2, 2.2, 2.25,
+    2.2, 2.1, 2.1, 2.16, 3.0, 2.7, 2.5, 2.48, 2.47, 2.45,
+    2.43, 2.42, 2.4, 2.38, 2.37, 2.35, 2.33, 2.32, 2.3, 2.28,
+    2.27, 2.25, 2.2, 2.1, 2.05, 2.0, 2.0, 2.05, 2.1, 2.05,
+    2.2, 2.3, 2.3, 2.0, 2.0, 2.0, 2.0, 2.0, 2.0, 2.4,
+    2.0, 2.3, 2.0, 2.0, 2.0, 2.0, 2.0, 2.0, 2.0, 2.0,
+    2.0, 2.0, 2.0, 2.0, 2.0, 2.0, 2.0, 2.0, 2.0, 2.0,
+    2.0, 2.0, 2.0, 2.0, 2.0, 2.0, 2.0, 2.0
+]
+# fmt: on
+
+####################################################################################################
+# Excluded ligands
+####################################################################################################
+
+ligand_exclusion = {
+    "144",
+    "15P",
+    "1PE",
+    "2F2",
+    "2JC",
+    "3HR",
+    "3SY",
+    "7N5",
+    "7PE",
+    "9JE",
+    "AAE",
+    "ABA",
+    "ACE",
+    "ACN",
+    "ACT",
+    "ACY",
+    "AZI",
+    "BAM",
+    "BCN",
+    "BCT",
+    "BDN",
+    "BEN",
+    "BME",
+    "BO3",
+    "BTB",
+    "BTC",
+    "BU1",
+    "C8E",
+    "CAD",
+    "CAQ",
+    "CBM",
+    "CCN",
+    "CIT",
+    "CL",
+    "CLR",
+    "CM",
+    "CMO",
+    "CO3",
+    "CPT",
+    "CXS",
+    "D10",
+    "DEP",
+    "DIO",
+    "DMS",
+    "DN",
+    "DOD",
+    "DOX",
+    "EDO",
+    "EEE",
+    "EGL",
+    "EOH",
+    "EOX",
+    "EPE",
+    "ETF",
+    "FCY",
+    "FJO",
+    "FLC",
+    "FMT",
+    "FW5",
+    "GOL",
+    "GSH",
+    "GTT",
+    "GYF",
+    "HED",
+    "IHP",
+    "IHS",
+    "IMD",
+    "IOD",
+    "IPA",
+    "IPH",
+    "LDA",
+    "MB3",
+    "MEG",
+    "MES",
+    "MLA",
+    "MLI",
+    "MOH",
+    "MPD",
+    "MRD",
+    "MSE",
+    "MYR",
+    "N",
+    "NA",
+    "NH2",
+    "NH4",
+    "NHE",
+    "NO3",
+    "O4B",
+    "OHE",
+    "OLA",
+    "OLC",
+    "OMB",
+    "OME",
+    "OXA",
+    "P6G",
+    "PE3",
+    "PE4",
+    "PEG",
+    "PEO",
+    "PEP",
+    "PG0",
+    "PG4",
+    "PGE",
+    "PGR",
+    "PLM",
+    "PO4",
+    "POL",
+    "POP",
+    "PVO",
+    "SAR",
+    "SCN",
+    "SEO",
+    "SEP",
+    "SIN",
+    "SO4",
+    "SPD",
+    "SPM",
+    "SR",
+    "STE",
+    "STO",
+    "STU",
+    "TAR",
+    "TBU",
+    "TME",
+    "TPO",
+    "TRS",
+    "UNK",
+    "UNL",
+    "UNX",
+    "UPL",
+    "URE",
+}
+
+
+####################################################################################################
+# TEMPLATES
+####################################################################################################
+
+min_coverage_residues = 10
+min_coverage_fraction = 0.1
+
+
+####################################################################################################
+# Ambiguous atoms
+####################################################################################################
+
+ambiguous_atoms = {
+    "CA": {
+        "*": "C",
+        "OEX": "CA",
+        "OEC": "CA",
+        "543": "CA",
+        "OC6": "CA",
+        "OC1": "CA",
+        "OC7": "CA",
+        "OEY": "CA",
+        "OC4": "CA",
+        "OC3": "CA",
+        "ICA": "CA",
+        "CA": "CA",
+        "OC2": "CA",
+        "OC5": "CA",
+    },
+    "CD": {"*": "C", "CD": "CD", "CD3": "CD", "CD5": "CD", "CD1": "CD"},
+    "BR": "BR",
+    "CL": {
+        "*": "CL",
+        "C8P": "C",
+        "L3T": "C",
+        "TLC": "C",
+        "TZ0": "C",
+        "471": "C",
+        "NLK": "C",
+        "PGM": "C",
+        "PNE": "C",
+        "RCY": "C",
+        "11F": "C",
+        "PII": "C",
+        "C1Q": "C",
+        "4MD": "C",
+        "R5A": "C",
+        "KW2": "C",
+        "I7M": "C",
+        "R48": "C",
+        "FC3": "C",
+        "55V": "C",
+        "KPF": "C",
+        "SPZ": "C",
+        "0TT": "C",
+        "R9A": "C",
+        "5NA": "C",
+        "C55": "C",
+        "NIX": "C",
+        "5PM": "C",
+        "PP8": "C",
+        "544": "C",
+        "812": "C",
+        "NPM": "C",
+        "KU8": "C",
+        "A1AMM": "C",
+        "4S0": "C",
+        "AQC": "C",
+        "2JK": "C",
+        "WJR": "C",
+        "A1AAW": "C",
+        "85E": "C",
+        "MB0": "C",
+        "ZAB": "C",
+        "85K": "C",
+        "GBP": "C",
+        "A1H80": "C",
+        "A1AFR": "C",
+        "L9M": "C",
+        "MYK": "C",
+        "MB9": "C",
+        "38R": "C",
+        "EKB": "C",
+        "NKF": "C",
+        "UMQ": "C",
+        "T4K": "C",
+        "3PT": "C",
+        "A1A7S": "C",
+        "1Q9": "C",
+        "11R": "C",
+        "D2V": "C",
+        "SM8": "C",
+        "IFC": "C",
+        "DB5": "C",
+        "L2T": "C",
+        "GNB": "C",
+        "PP7": "C",
+        "072": "C",
+        "P88": "C",
+        "DRL": "C",
+        "C9W": "C",
+        "NTP": "C",
+        "4HJ": "C",
+        "7NA": "C",
+        "LPC": "C",
+        "T8W": "C",
+        "63R": "C",
+        "570": "C",
+        "R4A": "C",
+        "3BG": "C",
+        "4RB": "C",
+        "GSO": "C",
+        "BQ6": "C",
+        "R4P": "C",
+        "5CP": "C",
+        "TTR": "C",
+        "6UZ": "C",
+        "SPJ": "C",
+        "0SA": "C",
+        "ZL1": "C",
+        "BYG": "C",
+        "F0E": "C",
+        "PC0": "C",
+        "B2Q": "C",
+        "KV6": "C",
+        "NTO": "C",
+        "CLG": "C",
+        "R7U": "C",
+        "SMQ": "C",
+        "GM2": "C",
+        "Z7P": "C",
+        "NXF": "C",
+        "C6Q": "C",
+        "A1G": "C",
+        "433": "C",
+        "L9N": "C",
+        "7OX": "C",
+        "A1H84": "C",
+        "97L": "C",
+        "HDV": "C",
+        "LUO": "C",
+        "R6A": "C",
+        "1PC": "C",
+        "4PT": "C",
+        "SBZ": "C",
+        "EAB": "C",
+        "FL4": "C",
+        "OPS": "C",
+        "C2X": "C",
+        "SLL": "C",
+        "BFC": "C",
+        "GIP": "C",
+        "7CP": "C",
+        "CLH": "C",
+        "34E": "C",
+        "5NE": "C",
+        "PBF": "C",
+        "ABD": "C",
+        "ABC": "C",
+        "LPF": "C",
+        "TIZ": "C",
+        "4HH": "C",
+        "AFC": "C",
+        "WQH": "C",
+        "9JL": "C",
+        "CS3": "C",
+        "NL0": "C",
+        "KPY": "C",
+        "DNA": "C",
+        "B3C": "C",
+        "TKL": "C",
+        "KVS": "C",
+        "HO6": "C",
+        "NLH": "C",
+        "1PB": "C",
+        "CYF": "C",
+        "G4M": "C",
+        "R5B": "C",
+        "N4S": "C",
+        "N11": "C",
+        "C8F": "C",
+        "PIJ": "C",
+        "WIN": "C",
+        "NT1": "C",
+        "WJW": "C",
+        "HF7": "C",
+        "TY1": "C",
+        "VM1": "C",
+    },
+    "OS": {"*": "O", "DWC": "OS", "OHX": "OS", "OS": "OS", "8WV": "OS", "OS4": "OS"},
+    "PB": {"*": "P", "ZN9": "PB", "ZN7": "PB", "PBM": "PB", "PB": "PB", "CSB": "PB"},
+    "CE": {"*": "C", "CE": "CE"},
+    "FE": {"*": "FE", "TFR": "F", "PF5": "F", "IFC": "F", "F5C": "F"},
+    "NA": {"*": "N", "CGO": "NA", "R2K": "NA", "LVQ": "NA", "NA": "NA"},
+    "ND": {"*": "N", "ND": "ND"},
+    "CF": {"*": "C", "CF": "CF"},
+    "RU": "RU",
+    "BRAF": "BR",
+    "EU": "EU",
+    "CLAA": "CL",
+    "CLBQ": "CL",
+    "CM": {"*": "C", "ZCM": "CM"},
+    "SN": {"*": "SN", "TAP": "S", "SND": "S", "TAD": "S", "XPT": "S"},
+    "AG": "AG",
+    "CLN": "CL",
+    "CLM": "CL",
+    "CLA": {"*": "CL", "PII": "C", "TDL": "C", "D0J": "C", "GM2": "C", "PIJ": "C"},
+    "CLB": {
+        "*": "CL",
+        "TD5": "C",
+        "PII": "C",
+        "TDL": "C",
+        "GM2": "C",
+        "TD7": "C",
+        "TD6": "C",
+        "PIJ": "C",
+    },
+    "CR": {
+        "*": "C",
+        "BW9": "CR",
+        "CQ4": "CR",
+        "AC9": "CR",
+        "TIL": "CR",
+        "J7U": "CR",
+        "CR": "CR",
+    },
+    "CLAY": "CL",
+    "CLBC": "CL",
+    "PD": {
+        "*": "P",
+        "F6Q": "PD",
+        "SVP": "PD",
+        "SXC": "PD",
+        "U5U": "PD",
+        "PD": "PD",
+        "PLL": "PD",
+    },
+    "CO": {
+        "*": "C",
+        "J1S": "CO",
+        "OCN": "CO",
+        "OL3": "CO",
+        "OL4": "CO",
+        "B12": "CO",
+        "XCO": "CO",
+        "UFU": "CO",
+        "CON": "CO",
+        "OL5": "CO",
+        "B13": "CO",
+        "7KI": "CO",
+        "PL1": "CO",
+        "OCO": "CO",
+        "J1R": "CO",
+        "COH": "CO",
+        "SIR": "CO",
+        "6KI": "CO",
+        "NCO": "CO",
+        "9CO": "CO",
+        "PC3": "CO",
+        "BWU": "CO",
+        "B1Z": "CO",
+        "J83": "CO",
+        "CO": "CO",
+        "COY": "CO",
+        "CNC": "CO",
+        "3CO": "CO",
+        "OCL": "CO",
+        "R5Q": "CO",
+        "X5Z": "CO",
+        "CBY": "CO",
+        "OLS": "CO",
+        "F0X": "CO",
+        "I2A": "CO",
+        "OCM": "CO",
+    },
+    "CU": {
+        "*": "C",
+        "8ZR": "CU",
+        "K7E": "CU",
+        "CU3": "CU",
+        "SI9": "CU",
+        "35N": "CU",
+        "C2O": "CU",
+        "SI7": "CU",
+        "B15": "CU",
+        "SI0": "CU",
+        "CUP": "CU",
+        "SQ1": "CU",
+        "CUK": "CU",
+        "CUL": "CU",
+        "SI8": "CU",
+        "IC4": "CU",
+        "CUM": "CU",
+        "MM2": "CU",
+        "B30": "CU",
+        "S32": "CU",
+        "V79": "CU",
+        "IMF": "CU",
+        "CUN": "CU",
+        "MM1": "CU",
+        "MP1": "CU",
+        "IME": "CU",
+        "B17": "CU",
+        "C2C": "CU",
+        "1CU": "CU",
+        "CU6": "CU",
+        "C1O": "CU",
+        "CU1": "CU",
+        "B22": "CU",
+        "CUS": "CU",
+        "RUQ": "CU",
+        "CUF": "CU",
+        "CUA": "CU",
+        "CU": "CU",
+        "CUO": "CU",
+        "0TE": "CU",
+        "SI4": "CU",
+    },
+    "CS": {"*": "C", "CS": "CS"},
+    "CLQ": "CL",
+    "CLR": "CL",
+    "CLU": "CL",
+    "TE": "TE",
+    "NI": {
+        "*": "N",
+        "USN": "NI",
+        "NFO": "NI",
+        "NI2": "NI",
+        "NFS": "NI",
+        "NFR": "NI",
+        "82N": "NI",
+        "R5N": "NI",
+        "NFU": "NI",
+        "A1ICD": "NI",
+        "NI3": "NI",
+        "M43": "NI",
+        "MM5": "NI",
+        "BF8": "NI",
+        "TCN": "NI",
+        "NIK": "NI",
+        "CUV": "NI",
+        "MM6": "NI",
+        "J52": "NI",
+        "NI": "NI",
+        "SNF": "NI",
+        "XCC": "NI",
+        "F0L": "NI",
+        "UWE": "NI",
+        "NFC": "NI",
+        "3NI": "NI",
+        "HNI": "NI",
+        "F43": "NI",
+        "RQM": "NI",
+        "NFE": "NI",
+        "NFB": "NI",
+        "B51": "NI",
+        "NI1": "NI",
+        "WCC": "NI",
+        "NUF": "NI",
+    },
+    "SB": {"*": "S", "UJI": "SB", "SB": "SB", "118": "SB", "SBO": "SB", "3CG": "SB"},
+    "MO": "MO",
+    "SEG": "SE",
+    "CLL": "CL",
+    "CLAH": "CL",
+    "CLC": {
+        "*": "CL",
+        "TD5": "C",
+        "PII": "C",
+        "TDL": "C",
+        "GM2": "C",
+        "TD7": "C",
+        "TD6": "C",
+        "PIJ": "C",
+    },
+    "CLD": {"*": "CL", "PII": "C", "GM2": "C", "PIJ": "C"},
+    "CLAD": "CL",
+    "CLAE": "CL",
+    "LA": "LA",
+    "RH": "RH",
+    "BRAC": "BR",
+    "BRAD": "BR",
+    "CLBN": "CL",
+    "CLAC": "CL",
+    "BRAB": "BR",
+    "BRAE": "BR",
+    "MG": "MG",
+    "IR": "IR",
+    "SE": {
+        "*": "SE",
+        "HII": "S",
+        "NT2": "S",
+        "R2P": "S",
+        "S2P": "S",
+        "0IU": "S",
+        "QMB": "S",
+        "81S": "S",
+        "0QB": "S",
+        "UB4": "S",
+        "OHS": "S",
+        "Q78": "S",
+        "0Y2": "S",
+        "B3M": "S",
+        "NT1": "S",
+        "81R": "S",
+    },
+    "BRAG": "BR",
+    "CLF": {"*": "CL", "PII": "C", "GM2": "C", "PIJ": "C"},
+    "CLE": {"*": "CL", "PII": "C", "GM2": "C", "PIJ": "C"},
+    "BRAX": "BR",
+    "CLK": "CL",
+    "ZN": "ZN",
+    "AS": "AS",
+    "AU": "AU",
+    "PT": "PT",
+    "CLAS": "CL",
+    "MN": "MN",
+    "CLBE": "CL",
+    "CLBF": "CL",
+    "CLAF": "CL",
+    "NA'": {"*": "N", "CGO": "NA"},
+    "BRAH": "BR",
+    "BRAI": "BR",
+    "BRA": "BR",
+    "BRB": "BR",
+    "BRAV": "BR",
+    "HG": {
+        "*": "HG",
+        "BBA": "H",
+        "MID": "H",
+        "APM": "H",
+        "4QQ": "H",
+        "0ZG": "H",
+        "APH": "H",
+    },
+    "AR": "AR",
+    "D": "H",
+    "CLAN": "CL",
+    "SI": "SI",
+    "CLS": "CL",
+    "ZR": "ZR",
+    "CLAR": {"*": "CL", "ZM4": "C"},
+    "HO": "HO",
+    "CLI": {"*": "CL", "GM2": "C"},
+    "CLH": {"*": "CL", "GM2": "C"},
+    "CLAP": "CL",
+    "CLBL": "CL",
+    "CLBM": "CL",
+    "PR": {"*": "PR", "UF0": "P", "252": "P"},
+    "IN": "IN",
+    "CLJ": "CL",
+    "BRU": "BR",
+    "SC": {"*": "S", "SFL": "SC"},
+    "CLG": {"*": "CL", "GM2": "C"},
+    "BRAT": "BR",
+    "BRAR": "BR",
+    "CLAG": "CL",
+    "CLAB": "CL",
+    "CLV": "CL",
+    "TI": "TI",
+    "CLAX": "CL",
+    "CLAJ": "CL",
+    "CL'": {"*": "CL", "BNR": "C", "25A": "C", "BDA": "C"},
+    "CLAW": "CL",
+    "BRF": "BR",
+    "BRE": "BR",
+    "RE": "RE",
+    "GD": "GD",
+    "SM": {"*": "S", "SM": "SM"},
+    "CLBH": "CL",
+    "CLBI": "CL",
+    "CLAI": "CL",
+    "CLY": "CL",
+    "CLZ": "CL",
+    "AC": "AC",
+    "BR'": "BR",
+    "CLT": "CL",
+    "CLO": "CL",
+    "CLP": "CL",
+    "LU": "LU",
+    "BA": {"*": "B", "BA": "BA"},
+    "CLAU": "CL",
+    "RB": "RB",
+    "LI": "LI",
+    "MOM": "MO",
+    "BRAQ": "BR",
+    "SR": {"*": "S", "SR": "SR", "OER": "SR"},
+    "CLAT": "CL",
+    "BRAL": "BR",
+    "SEB": "SE",
+    "CLW": "CL",
+    "CLX": "CL",
+    "BE": "BE",
+    "BRG": "BR",
+    "SEA": "SE",
+    "BRAW": "BR",
+    "BRBB": "BR",
+    "ER": "ER",
+    "TH": "TH",
+    "BRR": "BR",
+    "CLBV": "CL",
+    "AL": "AL",
+    "CLAV": "CL",
+    "BRH": "BR",
+    "CLAQ": "CL",
+    "GA": "GA",
+    "X": "*",
+    "TL": "TL",
+    "CLBB": "CL",
+    "TB": "TB",
+    "CLAK": "CL",
+    "XE": {"*": "*", "XE": "XE"},
+    "SEL": "SE",
+    "PU": {"*": "P", "4PU": "PU"},
+    "CLAZ": "CL",
+    "SE'": "SE",
+    "CLBA": "CL",
+    "SEN": "SE",
+    "SNN": "SN",
+    "MOB": "MO",
+    "YB": "YB",
+    "BRC": "BR",
+    "BRD": "BR",
+    "CLAM": "CL",
+    "DA": "H",
+    "DB": "H",
+    "DC": "H",
+    "DXT": "H",
+    "DXU": "H",
+    "DXX": "H",
+    "DXY": "H",
+    "DXZ": "H",
+    "DY": "DY",
+    "TA": "TA",
+    "XD": "*",
+    "SED": "SE",
+    "CLAL": "CL",
+    "BRAJ": "BR",
+    "AM": "AM",
+    "CLAO": "CL",
+    "BI": "BI",
+    "KR": "KR",
+    "BRBJ": "BR",
+    "UNK": "*",
+}
diff --git a/forks/boltz/src/boltz/data/crop/__init__.py b/forks/boltz/src/boltz/data/crop/__init__.py
new file mode 100644
index 00000000..e69de29b
diff --git a/forks/boltz/src/boltz/data/crop/affinity.py b/forks/boltz/src/boltz/data/crop/affinity.py
new file mode 100644
index 00000000..32a9a4d3
--- /dev/null
+++ b/forks/boltz/src/boltz/data/crop/affinity.py
@@ -0,0 +1,164 @@
+from dataclasses import replace
+from typing import Optional
+
+import numpy as np
+
+from boltz.data import const
+from boltz.data.crop.cropper import Cropper
+from boltz.data.types import Tokenized
+
+
+class AffinityCropper(Cropper):
+    """Interpolate between contiguous and spatial crops."""
+
+    def __init__(
+        self,
+        neighborhood_size: int = 10,
+        max_tokens_protein: int = 200,
+    ) -> None:
+        """Initialize the cropper.
+
+        Parameters
+        ----------
+        neighborhood_size : int
+            Modulates the type of cropping to be performed.
+            Smaller neighborhoods result in more spatial
+            cropping. Larger neighborhoods result in more
+            continuous cropping.
+
+        """
+        self.neighborhood_size = neighborhood_size
+        self.max_tokens_protein = max_tokens_protein
+
+    def crop(
+        self,
+        data: Tokenized,
+        max_tokens: int,
+        max_atoms: Optional[int] = None,
+    ) -> Tokenized:
+        """Crop the data to a maximum number of tokens.
+
+        Parameters
+        ----------
+        data : Tokenized
+            The tokenized data.
+        max_tokens : int
+            The maximum number of tokens to crop.
+        random : np.random.RandomState
+            The random state for reproducibility.
+        max_atoms : Optional[int]
+            The maximum number of atoms to consider.
+
+        Returns
+        -------
+        Tokenized
+            The cropped data.
+
+        """
+        # Get token data
+        token_data = data.tokens
+        token_bonds = data.bonds
+
+        # Filter to resolved tokens
+        valid_tokens = token_data[token_data["resolved_mask"]]
+
+        # Check if we have any valid tokens
+        if not valid_tokens.size:
+            msg = "No valid tokens in structure"
+            raise ValueError(msg)
+
+        # compute minimum distance to ligand
+        ligand_coords = valid_tokens[valid_tokens["affinity_mask"]]["center_coords"]
+        dists = np.min(
+            np.sum(
+                (valid_tokens["center_coords"][:, None] - ligand_coords[None]) ** 2,
+                axis=-1,
+            )
+            ** 0.5,
+            axis=1,
+        )
+
+        indices = np.argsort(dists)
+
+        # Select cropped indices
+        cropped: set[int] = set()
+        total_atoms = 0
+
+        # protein tokens
+        cropped_protein: set[int] = set()
+        ligand_ids = set(
+            valid_tokens[
+                valid_tokens["mol_type"] == const.chain_type_ids["NONPOLYMER"]
+            ]["token_idx"]
+        )
+
+        for idx in indices:
+            # Get the token
+            token = valid_tokens[idx]
+
+            # Get all tokens from this chain
+            chain_tokens = token_data[token_data["asym_id"] == token["asym_id"]]
+
+            # Pick the whole chain if possible, otherwise select
+            # a contiguous subset centered at the query token
+            if len(chain_tokens) <= self.neighborhood_size:
+                new_tokens = chain_tokens
+            else:
+                # First limit to the maximum set of tokens, with the
+                # neighborhood on both sides to handle edges. This
+                # is mostly for efficiency with the while loop below.
+                min_idx = token["res_idx"] - self.neighborhood_size
+                max_idx = token["res_idx"] + self.neighborhood_size
+
+                max_token_set = chain_tokens
+                max_token_set = max_token_set[max_token_set["res_idx"] >= min_idx]
+                max_token_set = max_token_set[max_token_set["res_idx"] <= max_idx]
+
+                # Start by adding just the query token
+                new_tokens = max_token_set[max_token_set["res_idx"] == token["res_idx"]]
+
+                # Expand the neighborhood until we have enough tokens, one
+                # by one to handle some edge cases with non-standard chains.
+                # We switch to the res_idx instead of the token_idx to always
+                # include all tokens from modified residues or from ligands.
+                min_idx = max_idx = token["res_idx"]
+                while new_tokens.size < self.neighborhood_size:
+                    min_idx = min_idx - 1
+                    max_idx = max_idx + 1
+                    new_tokens = max_token_set
+                    new_tokens = new_tokens[new_tokens["res_idx"] >= min_idx]
+                    new_tokens = new_tokens[new_tokens["res_idx"] <= max_idx]
+
+            # Compute new tokens and new atoms
+            new_indices = set(new_tokens["token_idx"]) - cropped
+            new_tokens = token_data[list(new_indices)]
+            new_atoms = np.sum(new_tokens["atom_num"])
+
+            # Stop if we exceed the max number of tokens or atoms
+            if (
+                (len(new_indices) > (max_tokens - len(cropped)))
+                or ((max_atoms is not None) and ((total_atoms + new_atoms) > max_atoms))
+                or (
+                    len(cropped_protein | new_indices - ligand_ids)
+                    > self.max_tokens_protein
+                )
+            ):
+                break
+
+            # Add new indices
+            cropped.update(new_indices)
+            total_atoms += new_atoms
+
+            # Add protein indices
+            cropped_protein.update(new_indices - ligand_ids)
+
+        # Get the cropped tokens sorted by index
+        token_data = token_data[sorted(cropped)]
+
+        # Only keep bonds within the cropped tokens
+        indices = token_data["token_idx"]
+        token_bonds = token_bonds[np.isin(token_bonds["token_1"], indices)]
+        token_bonds = token_bonds[np.isin(token_bonds["token_2"], indices)]
+
+        # Return the cropped tokens
+        return replace(data, tokens=token_data, bonds=token_bonds)
diff --git a/forks/boltz/src/boltz/data/crop/boltz.py b/forks/boltz/src/boltz/data/crop/boltz.py
new file mode 100644
index 00000000..2e4b31cb
--- /dev/null
+++ b/forks/boltz/src/boltz/data/crop/boltz.py
@@ -0,0 +1,296 @@
+from dataclasses import replace
+from typing import Optional
+
+import numpy as np
+from scipy.spatial.distance import cdist
+
+from boltz.data import const
+from boltz.data.crop.cropper import Cropper
+from boltz.data.types import Tokenized
+
+
+def pick_random_token(
+    tokens: np.ndarray,
+    random: np.random.RandomState,
+) -> np.ndarray:
+    """Pick a random token from the data.
+
+    Parameters
+    ----------
+    tokens : np.ndarray
+        The token data.
+    random : np.ndarray
+        The random state for reproducibility.
+
+    Returns
+    -------
+    np.ndarray
+        The selected token.
+
+    """
+    return tokens[random.randint(len(tokens))]
+
+
+def pick_chain_token(
+    tokens: np.ndarray,
+    chain_id: int,
+    random: np.random.RandomState,
+) -> np.ndarray:
+    """Pick a random token from a chain.
+
+    Parameters
+    ----------
+    tokens : np.ndarray
+        The token data.
+    chain_id : int
+        The chain ID.
+    random : np.ndarray
+        The random state for reproducibility.
+
+    Returns
+    -------
+    np.ndarray
+        The selected token.
+
+    """
+    # Filter to chain
+    chain_tokens = tokens[tokens["asym_id"] == chain_id]
+
+    # Pick from chain, fallback to all tokens
+    if chain_tokens.size:
+        query = pick_random_token(chain_tokens, random)
+    else:
+        query = pick_random_token(tokens, random)
+
+    return query
+
+
+def pick_interface_token(
+    tokens: np.ndarray,
+    interface: np.ndarray,
+    random: np.random.RandomState,
+) -> np.ndarray:
+    """Pick a random token from an interface.
+
+    Parameters
+    ----------
+    tokens : np.ndarray
+        The token data.
+    interface : int
+        The interface ID.
+    random : np.ndarray
+        The random state for reproducibility.
+
+    Returns
+    -------
+    np.ndarray
+        The selected token.
+
+    """
+    # Sample random interface
+    chain_1 = int(interface["chain_1"])
+    chain_2 = int(interface["chain_2"])
+
+    tokens_1 = tokens[tokens["asym_id"] == chain_1]
+    tokens_2 = tokens[tokens["asym_id"] == chain_2]
+
+    # If no interface, pick from the chains
+    if tokens_1.size and (not tokens_2.size):
+        query = pick_random_token(tokens_1, random)
+    elif tokens_2.size and (not tokens_1.size):
+        query = pick_random_token(tokens_2, random)
+    elif (not tokens_1.size) and (not tokens_2.size):
+        query = pick_random_token(tokens, random)
+    else:
+        # If we have tokens, compute distances
+        tokens_1_coords = tokens_1["center_coords"]
+        tokens_2_coords = tokens_2["center_coords"]
+
+        dists = cdist(tokens_1_coords, tokens_2_coords)
+        cuttoff = dists < const.interface_cutoff
+
+        # In rare cases, the interface cuttoff is slightly
+        # too small, then we slightly expand it if it happens
+        if not np.any(cuttoff):
+            cuttoff = dists < (const.interface_cutoff + 5.0)
+
+        tokens_1 = tokens_1[np.any(cuttoff, axis=1)]
+        tokens_2 = tokens_2[np.any(cuttoff, axis=0)]
+
+        # Select random token
+        candidates = np.concatenate([tokens_1, tokens_2])
+        query = pick_random_token(candidates, random)
+
+    return query
+
+
+class BoltzCropper(Cropper):
+    """Interpolate between contiguous and spatial crops."""
+
+    def __init__(self, min_neighborhood: int = 0, max_neighborhood: int = 40) -> None:
+        """Initialize the cropper.
+
+        Modulates the type of cropping to be performed.
+        Smaller neighborhoods result in more spatial
+        cropping. Larger neighborhoods result in more
+        continuous cropping. A mix can be achieved by
+        providing a range over which to sample.
+
+        Parameters
+        ----------
+        min_neighborhood : int
+            The minimum neighborhood size, by default 0.
+        max_neighborhood : int
+            The maximum neighborhood size, by default 40.
+
+        """
+        sizes = list(range(min_neighborhood, max_neighborhood + 1, 2))
+        self.neighborhood_sizes = sizes
+
+    def crop(  # noqa: PLR0915
+        self,
+        data: Tokenized,
+        max_tokens: int,
+        random: np.random.RandomState,
+        max_atoms: Optional[int] = None,
+        chain_id: Optional[int] = None,
+        interface_id: Optional[int] = None,
+    ) -> Tokenized:
+        """Crop the data to a maximum number of tokens.
+
+        Parameters
+        ----------
+        data : Tokenized
+            The tokenized data.
+        max_tokens : int
+            The maximum number of tokens to crop.
+        random : np.random.RandomState
+            The random state for reproducibility.
+        max_atoms : int, optional
+            The maximum number of atoms to consider.
+        chain_id : int, optional
+            The chain ID to crop.
+        interface_id : int, optional
+            The interface ID to crop.
+
+        Returns
+        -------
+        Tokenized
+            The cropped data.
+
+        """
+        # Check inputs
+        if chain_id is not None and interface_id is not None:
+            msg = "Only one of chain_id or interface_id can be provided."
+            raise ValueError(msg)
+
+        # Randomly select a neighborhood size
+        neighborhood_size = random.choice(self.neighborhood_sizes)
+
+        # Get token data
+        token_data = data.tokens
+        token_bonds = data.bonds
+        mask = data.structure.mask
+        chains = data.structure.chains
+        interfaces = data.structure.interfaces
+
+        # Filter to valid chains
+        valid_chains = chains[mask]
+
+        # Filter to valid interfaces
+        valid_interfaces = interfaces
+        valid_interfaces = valid_interfaces[mask[valid_interfaces["chain_1"]]]
+        valid_interfaces = valid_interfaces[mask[valid_interfaces["chain_2"]]]
+
+        # Filter to resolved tokens
+        valid_tokens = token_data[token_data["resolved_mask"]]
+
+        # Check if we have any valid tokens
+        if not valid_tokens.size:
+            msg = "No valid tokens in structure"
+            raise ValueError(msg)
+
+        # Pick a random token, chain, or interface
+        if chain_id is not None:
+            query = pick_chain_token(valid_tokens, chain_id, random)
+        elif interface_id is not None:
+            interface = interfaces[interface_id]
+            query = pick_interface_token(valid_tokens, interface, random)
+        elif valid_interfaces.size:
+            idx = random.randint(len(valid_interfaces))
+            interface = valid_interfaces[idx]
+            query = pick_interface_token(valid_tokens, interface, random)
+        else:
+            idx = random.randint(len(valid_chains))
+            chain_id = valid_chains[idx]["asym_id"]
+            query = pick_chain_token(valid_tokens, chain_id, random)
+
+        # Sort all tokens by distance to query_coords
+        dists = valid_tokens["center_coords"] - query["center_coords"]
+        indices = np.argsort(np.linalg.norm(dists, axis=1))
+
+        # Select cropped indices
+        cropped: set[int] = set()
+        total_atoms = 0
+        for idx in indices:
+            # Get the token
+            token = valid_tokens[idx]
+
+            # Get all tokens from this chain
+            chain_tokens = token_data[token_data["asym_id"] == token["asym_id"]]
+
+            # Pick the whole chain if possible, otherwise select
+            # a contiguous subset centered at the query token
+            if len(chain_tokens) <= neighborhood_size:
+                new_tokens = chain_tokens
+            else:
+                # First limit to the maximum set of tokens, with the
+                # neighborhood on both sides to handle edges. This
+                # is mostly for efficiency with the while loop below.
+                min_idx = token["res_idx"] - neighborhood_size
+                max_idx = token["res_idx"] + neighborhood_size
+
+                max_token_set = chain_tokens
+                max_token_set = max_token_set[max_token_set["res_idx"] >= min_idx]
+                max_token_set = max_token_set[max_token_set["res_idx"] <= max_idx]
+
+                # Start by adding just the query token
+                new_tokens = max_token_set[max_token_set["res_idx"] == token["res_idx"]]
+
+                # Expand the neighborhood until we have enough tokens, one
+                # by one to handle some edge cases with non-standard chains.
+                # We switch to the res_idx instead of the token_idx to always
+                # include all tokens from modified residues or from ligands.
+                min_idx = max_idx = token["res_idx"]
+                while new_tokens.size < neighborhood_size:
+                    min_idx = min_idx - 1
+                    max_idx = max_idx + 1
+                    new_tokens = max_token_set
+                    new_tokens = new_tokens[new_tokens["res_idx"] >= min_idx]
+                    new_tokens = new_tokens[new_tokens["res_idx"] <= max_idx]
+
+            # Compute new tokens and new atoms
+            new_indices = set(new_tokens["token_idx"]) - cropped
+            new_tokens = token_data[list(new_indices)]
+            new_atoms = np.sum(new_tokens["atom_num"])
+
+            # Stop if we exceed the max number of tokens or atoms
+            if (len(new_indices) > (max_tokens - len(cropped))) or (
+                (max_atoms is not None) and ((total_atoms + new_atoms) > max_atoms)
+            ):
+                break
+
+            # Add new indices
+            cropped.update(new_indices)
+            total_atoms += new_atoms
+
+        # Get the cropped tokens sorted by index
+        token_data = token_data[sorted(cropped)]
+
+        # Only keep bonds within the cropped tokens
+        indices = token_data["token_idx"]
+        token_bonds = token_bonds[np.isin(token_bonds["token_1"], indices)]
+        token_bonds = token_bonds[np.isin(token_bonds["token_2"], indices)]
+
+        # Return the cropped tokens
+        return replace(data, tokens=token_data, bonds=token_bonds)
diff --git a/forks/boltz/src/boltz/data/crop/cropper.py b/forks/boltz/src/boltz/data/crop/cropper.py
new file mode 100644
index 00000000..4eb1dbf3
--- /dev/null
+++ b/forks/boltz/src/boltz/data/crop/cropper.py
@@ -0,0 +1,45 @@
+from abc import ABC, abstractmethod
+from typing import Optional
+
+import numpy as np
+
+from boltz.data.types import Tokenized
+
+
+class Cropper(ABC):
+    """Abstract base class for cropper."""
+
+    @abstractmethod
+    def crop(
+        self,
+        data: Tokenized,
+        max_tokens: int,
+        random: np.random.RandomState,
+        max_atoms: Optional[int] = None,
+        chain_id: Optional[int] = None,
+        interface_id: Optional[int] = None,
+    ) -> Tokenized:
+        """Crop the data to a maximum number of tokens.
+
+        Parameters
+        ----------
+        data : Tokenized
+            The tokenized data.
+        max_tokens : int
+            The maximum number of tokens to crop.
+        random : np.random.RandomState
+            The random state for reproducibility.
+        max_atoms : Optional[int]
+            The maximum number of atoms to consider.
+        chain_id : Optional[int]
+            The chain ID to crop.
+        interface_id : Optional[int]
+            The interface ID to crop.
+
+        Returns
+        -------
+        Tokenized
+            The cropped data.
+
+        """
+        raise NotImplementedError
diff --git a/forks/boltz/src/boltz/data/feature/__init__.py b/forks/boltz/src/boltz/data/feature/__init__.py
new file mode 100644
index 00000000..e69de29b
diff --git a/forks/boltz/src/boltz/data/feature/featurizer.py b/forks/boltz/src/boltz/data/feature/featurizer.py
new file mode 100644
index 00000000..4f314338
--- /dev/null
+++ b/forks/boltz/src/boltz/data/feature/featurizer.py
@@ -0,0 +1,1224 @@
+import math
+import random
+from typing import Optional
+from collections import deque
+import numba
+import numpy as np
+import numpy.typing as npt
+import torch
+from numba import types
+from torch import Tensor, from_numpy
+from torch.nn.functional import one_hot
+
+from boltz.data import const
+from boltz.data.feature.symmetry import (
+    get_amino_acids_symmetries,
+    get_chain_symmetries,
+    get_ligand_symmetries,
+)
+from boltz.data.pad import pad_dim
+from boltz.data.types import (
+    MSA,
+    MSADeletion,
+    MSAResidue,
+    MSASequence,
+    Tokenized,
+)
+from boltz.model.modules.utils import center_random_augmentation
+
+####################################################################################################
+# HELPERS
+####################################################################################################
+
+
+def compute_frames_nonpolymer(
+    data: Tokenized,
+    coords,
+    resolved_mask,
+    atom_to_token,
+    frame_data: list,
+    resolved_frame_data: list,
+) -> tuple[list, list]:
+    """Get the frames for non-polymer tokens.
+
+    Parameters
+    ----------
+    data : Tokenized
+        The tokenized data.
+    frame_data : list
+        The frame data.
+    resolved_frame_data : list
+        The resolved frame data.
+
+    Returns
+    -------
+    tuple[list, list]
+        The frame data and resolved frame data.
+
+    """
+    frame_data = np.array(frame_data)
+    resolved_frame_data = np.array(resolved_frame_data)
+    asym_id_token = data.tokens["asym_id"]
+    asym_id_atom = data.tokens["asym_id"][atom_to_token]
+    token_idx = 0
+    atom_idx = 0
+    for id in np.unique(data.tokens["asym_id"]):
+        mask_chain_token = asym_id_token == id
+        mask_chain_atom = asym_id_atom == id
+        num_tokens = mask_chain_token.sum()
+        num_atoms = mask_chain_atom.sum()
+        if (
+            data.tokens[token_idx]["mol_type"] != const.chain_type_ids["NONPOLYMER"]
+            or num_atoms < 3
+        ):
+            token_idx += num_tokens
+            atom_idx += num_atoms
+            continue
+        dist_mat = (
+            (
+                coords.reshape(-1, 3)[mask_chain_atom][:, None, :]
+                - coords.reshape(-1, 3)[mask_chain_atom][None, :, :]
+            )
+            ** 2
+        ).sum(-1) ** 0.5
+        resolved_pair = 1 - (
+            resolved_mask[mask_chain_atom][None, :]
+            * resolved_mask[mask_chain_atom][:, None]
+        ).astype(np.float32)
+        resolved_pair[resolved_pair == 1] = math.inf
+        indices = np.argsort(dist_mat + resolved_pair, axis=1)
+        frames = (
+            np.concatenate(
+                [
+                    indices[:, 1:2],
+                    indices[:, 0:1],
+                    indices[:, 2:3],
+                ],
+                axis=1,
+            )
+            + atom_idx
+        )
+        frame_data[token_idx : token_idx + num_atoms, :] = frames
+        resolved_frame_data[token_idx : token_idx + num_atoms] = resolved_mask[
+            frames
+        ].all(axis=1)
+        token_idx += num_tokens
+        atom_idx += num_atoms
+    frames_expanded = coords.reshape(-1, 3)[frame_data]
+
+    mask_collinear = compute_collinear_mask(
+        frames_expanded[:, 1] - frames_expanded[:, 0],
+        frames_expanded[:, 1] - frames_expanded[:, 2],
+    )
+    return frame_data, resolved_frame_data & mask_collinear
+
+
+def compute_collinear_mask(v1, v2):
+    norm1 = np.linalg.norm(v1, axis=1, keepdims=True)
+    norm2 = np.linalg.norm(v2, axis=1, keepdims=True)
+    v1 = v1 / (norm1 + 1e-6)
+    v2 = v2 / (norm2 + 1e-6)
+    mask_angle = np.abs(np.sum(v1 * v2, axis=1)) < 0.9063
+    mask_overlap1 = norm1.reshape(-1) > 1e-2
+    mask_overlap2 = norm2.reshape(-1) > 1e-2
+    return mask_angle & mask_overlap1 & mask_overlap2
+
+
+def dummy_msa(residues: np.ndarray) -> MSA:
+    """Create a dummy MSA for a chain.
+
+    Parameters
+    ----------
+    residues : np.ndarray
+        The residues for the chain.
+
+    Returns
+    -------
+    MSA
+        The dummy MSA.
+
+    """
+    residues = [res["res_type"] for res in residues]
+    deletions = []
+    sequences = [(0, -1, 0, len(residues), 0, 0)]
+    return MSA(
+        residues=np.array(residues, dtype=MSAResidue),
+        deletions=np.array(deletions, dtype=MSADeletion),
+        sequences=np.array(sequences, dtype=MSASequence),
+    )
+
+
+def construct_paired_msa(  # noqa: C901, PLR0915, PLR0912
+    data: Tokenized,
+    max_seqs: int,
+    max_pairs: int = 8192,
+    max_total: int = 16384,
+    random_subset: bool = False,
+) -> tuple[Tensor, Tensor, Tensor]:
+    """Pair the MSA data.
+
+    Parameters
+    ----------
+    data : Input
+        The input data.
+
+    Returns
+    -------
+    Tensor
+        The MSA data.
+    Tensor
+        The deletion data.
+    Tensor
+        Mask indicating paired sequences.
+
+    """
+    # Get unique chains (ensuring monotonicity in the order)
+    assert np.all(np.diff(data.tokens["asym_id"], n=1) >= 0)
+    chain_ids = np.unique(data.tokens["asym_id"])
+
+    # Get relevant MSA, and create a dummy for chains without
+    msa = {k: data.msa[k] for k in chain_ids if k in data.msa}
+    for chain_id in chain_ids:
+        if chain_id not in msa:
+            chain = data.structure.chains[chain_id]
+            res_start = chain["res_idx"]
+            res_end = res_start + chain["res_num"]
+            residues = data.structure.residues[res_start:res_end]
+            msa[chain_id] = dummy_msa(residues)
+
+    # Map taxonomies to (chain_id, seq_idx)
+    taxonomy_map: dict[str, list] = {}
+    for chain_id, chain_msa in msa.items():
+        sequences = chain_msa.sequences
+        sequences = sequences[sequences["taxonomy"] != -1]
+        for sequence in sequences:
+            seq_idx = sequence["seq_idx"]
+            taxon = sequence["taxonomy"]
+            taxonomy_map.setdefault(taxon, []).append((chain_id, seq_idx))
+
+    # Remove taxonomies with only one sequence and sort by the
+    # number of chain_id present in each of the taxonomies
+    taxonomy_map = {k: v for k, v in taxonomy_map.items() if len(v) > 1}
+    taxonomy_map = sorted(
+        taxonomy_map.items(),
+        key=lambda x: len({c for c, _ in x[1]}),
+        reverse=True,
+    )
+
+    # Keep track of the sequences available per chain, keeping the original
+    # order of the sequences in the MSA to favor the best matching sequences
+    visited = {(c, s) for c, items in taxonomy_map for s in items}
+    available = {}
+    for c in chain_ids:
+        available[c] = deque(
+            i for i in range(1, len(msa[c].sequences)) if (c, i) not in visited
+        )
+
+    # Create sequence pairs
+    is_paired = []
+    pairing = []
+
+    # Start with the first sequence for each chain
+    is_paired.append({c: 1 for c in chain_ids})
+    pairing.append({c: 0 for c in chain_ids})
+
+    # Then add up to 8191 paired rows
+    for _, pairs in taxonomy_map:
+        # Group occurences by chain_id in case we have multiple
+        # sequences from the same chain and same taxonomy
+        chain_occurences = {}
+        for chain_id, seq_idx in pairs:
+            chain_occurences.setdefault(chain_id, []).append(seq_idx)
+
+        # We create as many pairings as the maximum number of occurences
+        max_occurences = max(len(v) for v in chain_occurences.values())
+        for i in range(max_occurences):
+            row_pairing = {}
+            row_is_paired = {}
+
+            # Add the chains present in the taxonomy
+            for chain_id, seq_idxs in chain_occurences.items():
+                # Roll over the sequence index to maximize diversity
+                idx = i % len(seq_idxs)
+                seq_idx = seq_idxs[idx]
+
+                # Add the sequence to the pairing
+                row_pairing[chain_id] = seq_idx
+                row_is_paired[chain_id] = 1
+
+            # Add any missing chains
+            for chain_id in chain_ids:
+                if chain_id not in row_pairing:
+                    row_is_paired[chain_id] = 0
+                    if available[chain_id]:
+                        # Add the next available sequence
+                        row_pairing[chain_id] = available[chain_id].popleft()
+                    else:
+                        # No more sequences available, we place a gap
+                        row_pairing[chain_id] = -1
+
+            pairing.append(row_pairing)
+            is_paired.append(row_is_paired)
+
+            # Break if we have enough pairs
+            if len(pairing) >= max_pairs:
+                break
+
+        # Break if we have enough pairs
+        if len(pairing) >= max_pairs:
+            break
+
+    # Now add up to 16384 unpaired rows total
+    max_left = max(len(v) for v in available.values())
+    for _ in range(min(max_total - len(pairing), max_left)):
+        row_pairing = {}
+        row_is_paired = {}
+        for chain_id in chain_ids:
+            row_is_paired[chain_id] = 0
+            if available[chain_id]:
+                # Add the next available sequence
+                row_pairing[chain_id] = available[chain_id].popleft()
+            else:
+                # No more sequences available, we place a gap
+                row_pairing[chain_id] = -1
+
+        pairing.append(row_pairing)
+        is_paired.append(row_is_paired)
+
+        # Break if we have enough sequences
+        if len(pairing) >= max_total:
+            break
+
+    # Randomly sample a subset of the pairs
+    # ensuring the first row is always present
+    if random_subset:
+        num_seqs = len(pairing)
+        if num_seqs > max_seqs:
+            indices = np.random.choice(
+                list(range(1, num_seqs)), size=max_seqs - 1, replace=False
+            )  # noqa: NPY002
+            pairing = [pairing[0]] + [pairing[i] for i in indices]
+            is_paired = [is_paired[0]] + [is_paired[i] for i in indices]
+    else:
+        # Deterministic downsample to max_seqs
+        pairing = pairing[:max_seqs]
+        is_paired = is_paired[:max_seqs]
+
+    # Map (chain_id, seq_idx, res_idx) to deletion
+    deletions = numba.typed.Dict.empty(
+        key_type=numba.types.Tuple(
+            [numba.types.int64, numba.types.int64, numba.types.int64]),
+        value_type=numba.types.int64
+    )
+    for chain_id, chain_msa in msa.items():
+        chain_deletions = chain_msa.deletions
+        for sequence in chain_msa.sequences:
+            seq_idx = sequence["seq_idx"]
+            del_start = sequence["del_start"]
+            del_end = sequence["del_end"]
+            chain_deletions = chain_deletions[del_start:del_end]
+            for deletion_data in chain_deletions:
+                res_idx = deletion_data["res_idx"]
+                deletion_values = deletion_data["deletion"]
+                deletions[(chain_id, seq_idx, res_idx)] = deletion_values
+
+    # Add all the token MSA data
+    msa_data, del_data, paired_data = prepare_msa_arrays(
+        data.tokens, pairing, is_paired, deletions, msa
+    )
+
+    msa_data = torch.tensor(msa_data, dtype=torch.long)
+    del_data = torch.tensor(del_data, dtype=torch.float)
+    paired_data = torch.tensor(paired_data, dtype=torch.float)
+
+    return msa_data, del_data, paired_data
+
+
+def prepare_msa_arrays(
+    tokens,
+    pairing: list[dict[int, int]],
+    is_paired: list[dict[int, int]],
+    deletions: dict[tuple[int, int, int], int],
+    msa: dict[int, MSA],
+) -> tuple[npt.NDArray[np.int64], npt.NDArray[np.int64], npt.NDArray[np.int64]]:
+    """Reshape data to play nicely with numba jit."""
+    token_asym_ids_arr = np.array([t["asym_id"] for t in tokens], dtype=np.int64)
+    token_res_idxs_arr = np.array([t["res_idx"] for t in tokens], dtype=np.int64)
+
+    chain_ids = sorted(msa.keys())
+
+    # chain_ids are not necessarily contiguous (e.g. they might be 0, 24, 25).
+    # This allows us to look up a chain_id by it's index in the chain_ids list.
+    chain_id_to_idx = {chain_id: i for i, chain_id in enumerate(chain_ids)}
+    token_asym_ids_idx_arr = np.array(
+        [chain_id_to_idx[asym_id] for asym_id in token_asym_ids_arr], dtype=np.int64
+    )
+
+    pairing_arr = np.zeros((len(pairing), len(chain_ids)), dtype=np.int64)
+    is_paired_arr = np.zeros((len(is_paired), len(chain_ids)), dtype=np.int64)
+
+    for i, row_pairing in enumerate(pairing):
+        for chain_id in chain_ids:
+            pairing_arr[i, chain_id_to_idx[chain_id]] = row_pairing[chain_id]
+
+    for i, row_is_paired in enumerate(is_paired):
+        for chain_id in chain_ids:
+            is_paired_arr[i, chain_id_to_idx[chain_id]] = row_is_paired[chain_id]
+
+    max_seq_len = max(len(msa[chain_id].sequences) for chain_id in chain_ids)
+
+    # we want res_start from sequences
+    msa_sequences = np.full((len(chain_ids), max_seq_len), -1, dtype=np.int64)
+    for chain_id in chain_ids:
+        for i, seq in enumerate(msa[chain_id].sequences):
+            msa_sequences[chain_id_to_idx[chain_id], i] = seq["res_start"]
+
+    max_residues_len = max(len(msa[chain_id].residues) for chain_id in chain_ids)
+    msa_residues = np.full((len(chain_ids), max_residues_len), -1, dtype=np.int64)
+    for chain_id in chain_ids:
+        residues = msa[chain_id].residues.astype(np.int64)
+        idxs = np.arange(len(residues))
+        chain_idx = chain_id_to_idx[chain_id]
+        msa_residues[chain_idx, idxs] = residues
+
+    return _prepare_msa_arrays_inner(
+        token_asym_ids_arr,
+        token_res_idxs_arr,
+        token_asym_ids_idx_arr,
+        pairing_arr,
+        is_paired_arr,
+        deletions,
+        msa_sequences,
+        msa_residues,
+        const.token_ids["-"],
+    )
+
+
+deletions_dict_type = types.DictType(types.UniTuple(types.int64, 3), types.int64)
+
+
+@numba.njit(
+    [
+        types.Tuple(
+            (
+                types.int64[:, ::1],  # msa_data
+                types.int64[:, ::1],  # del_data
+                types.int64[:, ::1],  # paired_data
+            )
+        )(
+            types.int64[::1],  # token_asym_ids
+            types.int64[::1],  # token_res_idxs
+            types.int64[::1],  # token_asym_ids_idx
+            types.int64[:, ::1],  # pairing
+            types.int64[:, ::1],  # is_paired
+            deletions_dict_type,  # deletions
+            types.int64[:, ::1],  # msa_sequences
+            types.int64[:, ::1],  # msa_residues
+            types.int64,  # gap_token
+        )
+    ],
+    cache=True,
+)
+def _prepare_msa_arrays_inner(
+    token_asym_ids: npt.NDArray[np.int64],
+    token_res_idxs: npt.NDArray[np.int64],
+    token_asym_ids_idx: npt.NDArray[np.int64],
+    pairing: npt.NDArray[np.int64],
+    is_paired: npt.NDArray[np.int64],
+    deletions: dict[tuple[int, int, int], int],
+    msa_sequences: npt.NDArray[np.int64],
+    msa_residues: npt.NDArray[np.int64],
+    gap_token: int,
+) -> tuple[npt.NDArray[np.int64], npt.NDArray[np.int64], npt.NDArray[np.int64]]:
+    n_tokens = len(token_asym_ids)
+    n_pairs = len(pairing)
+    msa_data = np.full((n_tokens, n_pairs), gap_token, dtype=np.int64)
+    paired_data = np.zeros((n_tokens, n_pairs), dtype=np.int64)
+    del_data = np.zeros((n_tokens, n_pairs), dtype=np.int64)
+
+    # Add all the token MSA data
+    for token_idx in range(n_tokens):
+        chain_id_idx = token_asym_ids_idx[token_idx]
+        chain_id = token_asym_ids[token_idx]
+        res_idx = token_res_idxs[token_idx]
+
+        for pair_idx in range(n_pairs):
+            seq_idx = pairing[pair_idx, chain_id_idx]
+            paired_data[token_idx, pair_idx] = is_paired[pair_idx, chain_id_idx]
+
+            # Add residue type
+            if seq_idx != -1:
+                res_start = msa_sequences[chain_id_idx, seq_idx]
+                res_type = msa_residues[chain_id_idx, res_start + res_idx]
+                k = (chain_id, seq_idx, res_idx)
+                if k in deletions:
+                    del_data[token_idx, pair_idx] = deletions[k]
+                msa_data[token_idx, pair_idx] = res_type
+
+    return msa_data, del_data, paired_data
+
+
+####################################################################################################
+# FEATURES
+####################################################################################################
+
+
+def select_subset_from_mask(mask, p):
+    num_true = np.sum(mask)
+    v = np.random.geometric(p) + 1
+    k = min(v, num_true)
+
+    true_indices = np.where(mask)[0]
+
+    # Randomly select k indices from the true_indices
+    selected_indices = np.random.choice(true_indices, size=k, replace=False)
+
+    new_mask = np.zeros_like(mask)
+    new_mask[selected_indices] = 1
+
+    return new_mask
+
+
+def process_token_features(
+    data: Tokenized,
+    max_tokens: Optional[int] = None,
+    binder_pocket_conditioned_prop: Optional[float] = 0.0,
+    binder_pocket_cutoff: Optional[float] = 6.0,
+    binder_pocket_sampling_geometric_p: Optional[float] = 0.0,
+    only_ligand_binder_pocket: Optional[bool] = False,
+    inference_binder: Optional[list[int]] = None,
+    inference_pocket: Optional[list[tuple[int, int]]] = None,
+) -> dict[str, Tensor]:
+    """Get the token features.
+
+    Parameters
+    ----------
+    data : Tokenized
+        The tokenized data.
+    max_tokens : int
+        The maximum number of tokens.
+
+    Returns
+    -------
+    dict[str, Tensor]
+        The token features.
+
+    """
+    # Token data
+    token_data = data.tokens
+    token_bonds = data.bonds
+
+    # Token core features
+    token_index = torch.arange(len(token_data), dtype=torch.long)
+    residue_index = from_numpy(token_data["res_idx"].copy()).long()
+    asym_id = from_numpy(token_data["asym_id"].copy()).long()
+    entity_id = from_numpy(token_data["entity_id"].copy()).long()
+    sym_id = from_numpy(token_data["sym_id"].copy()).long()
+    mol_type = from_numpy(token_data["mol_type"].copy()).long()
+    res_type = from_numpy(token_data["res_type"].copy()).long()
+    res_type = one_hot(res_type, num_classes=const.num_tokens)
+    disto_center = from_numpy(token_data["disto_coords"].copy())
+
+    # Token mask features
+    pad_mask = torch.ones(len(token_data), dtype=torch.float)
+    resolved_mask = from_numpy(token_data["resolved_mask"].copy()).float()
+    disto_mask = from_numpy(token_data["disto_mask"].copy()).float()
+    cyclic_period = from_numpy(token_data["cyclic_period"].copy())
+
+    # Token bond features
+    if max_tokens is not None:
+        pad_len = max_tokens - len(token_data)
+        num_tokens = max_tokens if pad_len > 0 else len(token_data)
+    else:
+        num_tokens = len(token_data)
+
+    tok_to_idx = {tok["token_idx"]: idx for idx, tok in enumerate(token_data)}
+    bonds = torch.zeros(num_tokens, num_tokens, dtype=torch.float)
+    for token_bond in token_bonds:
+        token_1 = tok_to_idx[token_bond["token_1"]]
+        token_2 = tok_to_idx[token_bond["token_2"]]
+        bonds[token_1, token_2] = 1
+        bonds[token_2, token_1] = 1
+
+    bonds = bonds.unsqueeze(-1)
+
+    # Pocket conditioned feature
+    pocket_feature = (
+        np.zeros(len(token_data)) + const.pocket_contact_info["UNSPECIFIED"]
+    )
+    if inference_binder is not None:
+        assert inference_pocket is not None
+        pocket_residues = set(inference_pocket)
+        for idx, token in enumerate(token_data):
+            if token["asym_id"] in inference_binder:
+                pocket_feature[idx] = const.pocket_contact_info["BINDER"]
+            elif (token["asym_id"], token["res_idx"]) in pocket_residues:
+                pocket_feature[idx] = const.pocket_contact_info["POCKET"]
+            else:
+                pocket_feature[idx] = const.pocket_contact_info["UNSELECTED"]
+    elif (
+        binder_pocket_conditioned_prop > 0.0
+        and random.random() < binder_pocket_conditioned_prop
+    ):
+        # choose as binder a random ligand in the crop, if there are no ligands select a protein chain
+        binder_asym_ids = np.unique(
+            token_data["asym_id"][
+                token_data["mol_type"] == const.chain_type_ids["NONPOLYMER"]
+            ]
+        )
+
+        if len(binder_asym_ids) == 0:
+            if not only_ligand_binder_pocket:
+                binder_asym_ids = np.unique(token_data["asym_id"])
+
+        if len(binder_asym_ids) > 0:
+            pocket_asym_id = random.choice(binder_asym_ids)
+            binder_mask = token_data["asym_id"] == pocket_asym_id
+
+            binder_coords = []
+            for token in token_data:
+                if token["asym_id"] == pocket_asym_id:
+                    binder_coords.append(
+                        data.structure.atoms["coords"][
+                            token["atom_idx"] : token["atom_idx"] + token["atom_num"]
+                        ]
+                    )
+            binder_coords = np.concatenate(binder_coords, axis=0)
+
+            # find the tokens in the pocket
+            token_dist = np.zeros(len(token_data)) + 1000
+            for i, token in enumerate(token_data):
+                if (
+                    token["mol_type"] != const.chain_type_ids["NONPOLYMER"]
+                    and token["asym_id"] != pocket_asym_id
+                    and token["resolved_mask"] == 1
+                ):
+                    token_coords = data.structure.atoms["coords"][
+                        token["atom_idx"] : token["atom_idx"] + token["atom_num"]
+                    ]
+
+                    # find chain and apply chain transformation
+                    for chain in data.structure.chains:
+                        if chain["asym_id"] == token["asym_id"]:
+                            break
+
+                    token_dist[i] = np.min(
+                        np.linalg.norm(
+                            token_coords[:, None, :] - binder_coords[None, :, :],
+                            axis=-1,
+                        )
+                    )
+
+            pocket_mask = token_dist < binder_pocket_cutoff
+
+            if np.sum(pocket_mask) > 0:
+                pocket_feature = (
+                    np.zeros(len(token_data)) + const.pocket_contact_info["UNSELECTED"]
+                )
+                pocket_feature[binder_mask] = const.pocket_contact_info["BINDER"]
+
+                if binder_pocket_sampling_geometric_p > 0.0:
+                    # select a subset of the pocket, according
+                    # to a geometric distribution with one as minimum
+                    pocket_mask = select_subset_from_mask(
+                        pocket_mask, binder_pocket_sampling_geometric_p
+                    )
+
+                pocket_feature[pocket_mask] = const.pocket_contact_info["POCKET"]
+    pocket_feature = from_numpy(pocket_feature).long()
+    pocket_feature = one_hot(pocket_feature, num_classes=len(const.pocket_contact_info))
+
+    # Pad to max tokens if given
+    if max_tokens is not None:
+        pad_len = max_tokens - len(token_data)
+        if pad_len > 0:
+            token_index = pad_dim(token_index, 0, pad_len)
+            residue_index = pad_dim(residue_index, 0, pad_len)
+            asym_id = pad_dim(asym_id, 0, pad_len)
+            entity_id = pad_dim(entity_id, 0, pad_len)
+            sym_id = pad_dim(sym_id, 0, pad_len)
+            mol_type = pad_dim(mol_type, 0, pad_len)
+            res_type = pad_dim(res_type, 0, pad_len)
+            disto_center = pad_dim(disto_center, 0, pad_len)
+            pad_mask = pad_dim(pad_mask, 0, pad_len)
+            resolved_mask = pad_dim(resolved_mask, 0, pad_len)
+            disto_mask = pad_dim(disto_mask, 0, pad_len)
+            pocket_feature = pad_dim(pocket_feature, 0, pad_len)
+
+    token_features = {
+        "token_index": token_index,
+        "residue_index": residue_index,
+        "asym_id": asym_id,
+        "entity_id": entity_id,
+        "sym_id": sym_id,
+        "mol_type": mol_type,
+        "res_type": res_type,
+        "disto_center": disto_center,
+        "token_bonds": bonds,
+        "token_pad_mask": pad_mask,
+        "token_resolved_mask": resolved_mask,
+        "token_disto_mask": disto_mask,
+        "pocket_feature": pocket_feature,
+        "cyclic_period": cyclic_period,
+    }
+    return token_features
+
+
+def process_atom_features(
+    data: Tokenized,
+    atoms_per_window_queries: int = 32,
+    min_dist: float = 2.0,
+    max_dist: float = 22.0,
+    num_bins: int = 64,
+    max_atoms: Optional[int] = None,
+    max_tokens: Optional[int] = None,
+) -> dict[str, Tensor]:
+    """Get the atom features.
+
+    Parameters
+    ----------
+    data : Tokenized
+        The tokenized data.
+    max_atoms : int, optional
+        The maximum number of atoms.
+
+    Returns
+    -------
+    dict[str, Tensor]
+        The atom features.
+
+    """
+    # Filter to tokens' atoms
+    atom_data = []
+    ref_space_uid = []
+    coord_data = []
+    frame_data = []
+    resolved_frame_data = []
+    atom_to_token = []
+    token_to_rep_atom = []  # index on cropped atom table
+    r_set_to_rep_atom = []
+    disto_coords = []
+    atom_idx = 0
+
+    chain_res_ids = {}
+    for token_id, token in enumerate(data.tokens):
+        # Get the chain residue ids
+        chain_idx, res_id = token["asym_id"], token["res_idx"]
+        chain = data.structure.chains[chain_idx]
+
+        if (chain_idx, res_id) not in chain_res_ids:
+            new_idx = len(chain_res_ids)
+            chain_res_ids[(chain_idx, res_id)] = new_idx
+        else:
+            new_idx = chain_res_ids[(chain_idx, res_id)]
+
+        # Map atoms to token indices
+        ref_space_uid.extend([new_idx] * token["atom_num"])
+        atom_to_token.extend([token_id] * token["atom_num"])
+
+        # Add atom data
+        start = token["atom_idx"]
+        end = token["atom_idx"] + token["atom_num"]
+        token_atoms = data.structure.atoms[start:end]
+
+        # Map token to representative atom
+        token_to_rep_atom.append(atom_idx + token["disto_idx"] - start)
+        if (chain["mol_type"] != const.chain_type_ids["NONPOLYMER"]) and token[
+            "resolved_mask"
+        ]:
+            r_set_to_rep_atom.append(atom_idx + token["center_idx"] - start)
+
+        # Get token coordinates
+        token_coords = np.array([token_atoms["coords"]])
+        coord_data.append(token_coords)
+
+        # Get frame data
+        res_type = const.tokens[token["res_type"]]
+
+        if token["atom_num"] < 3 or res_type in ["PAD", "UNK", "-"]:
+            idx_frame_a, idx_frame_b, idx_frame_c = 0, 0, 0
+            mask_frame = False
+        elif (token["mol_type"] == const.chain_type_ids["PROTEIN"]) and (
+            res_type in const.ref_atoms
+        ):
+            idx_frame_a, idx_frame_b, idx_frame_c = (
+                const.ref_atoms[res_type].index("N"),
+                const.ref_atoms[res_type].index("CA"),
+                const.ref_atoms[res_type].index("C"),
+            )
+            mask_frame = (
+                token_atoms["is_present"][idx_frame_a]
+                and token_atoms["is_present"][idx_frame_b]
+                and token_atoms["is_present"][idx_frame_c]
+            )
+        elif (
+            token["mol_type"] == const.chain_type_ids["DNA"]
+            or token["mol_type"] == const.chain_type_ids["RNA"]
+        ) and (res_type in const.ref_atoms):
+            idx_frame_a, idx_frame_b, idx_frame_c = (
+                const.ref_atoms[res_type].index("C1'"),
+                const.ref_atoms[res_type].index("C3'"),
+                const.ref_atoms[res_type].index("C4'"),
+            )
+            mask_frame = (
+                token_atoms["is_present"][idx_frame_a]
+                and token_atoms["is_present"][idx_frame_b]
+                and token_atoms["is_present"][idx_frame_c]
+            )
+        else:
+            idx_frame_a, idx_frame_b, idx_frame_c = 0, 0, 0
+            mask_frame = False
+        frame_data.append(
+            [idx_frame_a + atom_idx, idx_frame_b + atom_idx, idx_frame_c + atom_idx]
+        )
+        resolved_frame_data.append(mask_frame)
+
+        # Get distogram coordinates
+        disto_coords_tok = data.structure.atoms[token["disto_idx"]]["coords"]
+        disto_coords.append(disto_coords_tok)
+
+        # Update atom data. This is technically never used again (we rely on coord_data),
+        # but we update for consistency and to make sure the Atom object has valid, transformed coordinates.
+        token_atoms = token_atoms.copy()
+        token_atoms["coords"] = token_coords[0]  # atom has a copy of first coords
+        atom_data.append(token_atoms)
+        atom_idx += len(token_atoms)
+
+    disto_coords = np.array(disto_coords)
+
+    # Compute distogram
+    t_center = torch.Tensor(disto_coords)
+    t_dists = torch.cdist(t_center, t_center)
+    boundaries = torch.linspace(min_dist, max_dist, num_bins - 1)
+    distogram = (t_dists.unsqueeze(-1) > boundaries).sum(dim=-1).long()
+    disto_target = one_hot(distogram, num_classes=num_bins)
+
+    atom_data = np.concatenate(atom_data)
+    coord_data = np.concatenate(coord_data, axis=1)
+    ref_space_uid = np.array(ref_space_uid)
+
+    # Compute features
+    ref_atom_name_chars = from_numpy(atom_data["name"]).long()
+    ref_element = from_numpy(atom_data["element"]).long()
+    ref_charge = from_numpy(atom_data["charge"])
+    ref_pos = from_numpy(
+        atom_data["conformer"].copy()
+    )  # not sure why I need to copy here..
+    ref_space_uid = from_numpy(ref_space_uid)
+    coords = from_numpy(coord_data.copy())
+    resolved_mask = from_numpy(atom_data["is_present"])
+    pad_mask = torch.ones(len(atom_data), dtype=torch.float)
+    atom_to_token = torch.tensor(atom_to_token, dtype=torch.long)
+    token_to_rep_atom = torch.tensor(token_to_rep_atom, dtype=torch.long)
+    r_set_to_rep_atom = torch.tensor(r_set_to_rep_atom, dtype=torch.long)
+    frame_data, resolved_frame_data = compute_frames_nonpolymer(
+        data,
+        coord_data,
+        atom_data["is_present"],
+        atom_to_token,
+        frame_data,
+        resolved_frame_data,
+    )  # Compute frames for NONPOLYMER tokens
+    frames = from_numpy(frame_data.copy())
+    frame_resolved_mask = from_numpy(resolved_frame_data.copy())
+    # Convert to one-hot
+    ref_atom_name_chars = one_hot(
+        ref_atom_name_chars % num_bins, num_classes=num_bins
+    )  # added for lower case letters
+    ref_element = one_hot(ref_element, num_classes=const.num_elements)
+    atom_to_token = one_hot(atom_to_token, num_classes=token_id + 1)
+    token_to_rep_atom = one_hot(token_to_rep_atom, num_classes=len(atom_data))
+    r_set_to_rep_atom = one_hot(r_set_to_rep_atom, num_classes=len(atom_data))
+
+    # Center the ground truth coordinates
+    center = (coords * resolved_mask[None, :, None]).sum(dim=1)
+    center = center / resolved_mask.sum().clamp(min=1)
+    coords = coords - center[:, None]
+
+    # Apply random roto-translation to the input atoms
+    ref_pos = center_random_augmentation(
+        ref_pos[None], resolved_mask[None], centering=False
+    )[0]
+
+    # Compute padding and apply
+    if max_atoms is not None:
+        assert max_atoms % atoms_per_window_queries == 0
+        pad_len = max_atoms - len(atom_data)
+    else:
+        pad_len = (
+            (len(atom_data) - 1) // atoms_per_window_queries + 1
+        ) * atoms_per_window_queries - len(atom_data)
+
+    if pad_len > 0:
+        pad_mask = pad_dim(pad_mask, 0, pad_len)
+        ref_pos = pad_dim(ref_pos, 0, pad_len)
+        resolved_mask = pad_dim(resolved_mask, 0, pad_len)
+        ref_element = pad_dim(ref_element, 0, pad_len)
+        ref_charge = pad_dim(ref_charge, 0, pad_len)
+        ref_atom_name_chars = pad_dim(ref_atom_name_chars, 0, pad_len)
+        ref_space_uid = pad_dim(ref_space_uid, 0, pad_len)
+        coords = pad_dim(coords, 1, pad_len)
+        atom_to_token = pad_dim(atom_to_token, 0, pad_len)
+        token_to_rep_atom = pad_dim(token_to_rep_atom, 1, pad_len)
+        r_set_to_rep_atom = pad_dim(r_set_to_rep_atom, 1, pad_len)
+
+    if max_tokens is not None:
+        pad_len = max_tokens - token_to_rep_atom.shape[0]
+        if pad_len > 0:
+            atom_to_token = pad_dim(atom_to_token, 1, pad_len)
+            token_to_rep_atom = pad_dim(token_to_rep_atom, 0, pad_len)
+            r_set_to_rep_atom = pad_dim(r_set_to_rep_atom, 0, pad_len)
+            disto_target = pad_dim(pad_dim(disto_target, 0, pad_len), 1, pad_len)
+            frames = pad_dim(frames, 0, pad_len)
+            frame_resolved_mask = pad_dim(frame_resolved_mask, 0, pad_len)
+
+    return {
+        "ref_pos": ref_pos,
+        "atom_resolved_mask": resolved_mask,
+        "ref_element": ref_element,
+        "ref_charge": ref_charge,
+        "ref_atom_name_chars": ref_atom_name_chars,
+        "ref_space_uid": ref_space_uid,
+        "coords": coords,
+        "atom_pad_mask": pad_mask,
+        "atom_to_token": atom_to_token,
+        "token_to_rep_atom": token_to_rep_atom,
+        "r_set_to_rep_atom": r_set_to_rep_atom,
+        "disto_target": disto_target,
+        "frames_idx": frames,
+        "frame_resolved_mask": frame_resolved_mask,
+    }
+
+
+def process_msa_features(
+    data: Tokenized,
+    max_seqs_batch: int,
+    max_seqs: int,
+    max_tokens: Optional[int] = None,
+    pad_to_max_seqs: bool = False,
+) -> dict[str, Tensor]:
+    """Get the MSA features.
+
+    Parameters
+    ----------
+    data : Tokenized
+        The tokenized data.
+    max_seqs : int
+        The maximum number of MSA sequences.
+    max_tokens : int
+        The maximum number of tokens.
+    pad_to_max_seqs : bool
+        Whether to pad to the maximum number of sequences.
+
+    Returns
+    -------
+    dict[str, Tensor]
+        The MSA features.
+
+    """
+    # Created paired MSA
+    msa, deletion, paired = construct_paired_msa(data, max_seqs_batch)
+    msa, deletion, paired = (
+        msa.transpose(1, 0),
+        deletion.transpose(1, 0),
+        paired.transpose(1, 0),
+    )  # (N_MSA, N_RES, N_AA)
+
+    # Prepare features
+    msa = torch.nn.functional.one_hot(msa, num_classes=const.num_tokens)
+    msa_mask = torch.ones_like(msa[:, :, 0])
+    profile = msa.float().mean(dim=0)
+    has_deletion = deletion > 0
+    deletion = np.pi / 2 * np.arctan(deletion / 3)
+    deletion_mean = deletion.mean(axis=0)
+
+    # Pad in the MSA dimension (dim=0)
+    if pad_to_max_seqs:
+        pad_len = max_seqs - msa.shape[0]
+        if pad_len > 0:
+            msa = pad_dim(msa, 0, pad_len, const.token_ids["-"])
+            paired = pad_dim(paired, 0, pad_len)
+            msa_mask = pad_dim(msa_mask, 0, pad_len)
+            has_deletion = pad_dim(has_deletion, 0, pad_len)
+            deletion = pad_dim(deletion, 0, pad_len)
+
+    # Pad in the token dimension (dim=1)
+    if max_tokens is not None:
+        pad_len = max_tokens - msa.shape[1]
+        if pad_len > 0:
+            msa = pad_dim(msa, 1, pad_len, const.token_ids["-"])
+            paired = pad_dim(paired, 1, pad_len)
+            msa_mask = pad_dim(msa_mask, 1, pad_len)
+            has_deletion = pad_dim(has_deletion, 1, pad_len)
+            deletion = pad_dim(deletion, 1, pad_len)
+            profile = pad_dim(profile, 0, pad_len)
+            deletion_mean = pad_dim(deletion_mean, 0, pad_len)
+
+    return {
+        "msa": msa,
+        "msa_paired": paired,
+        "deletion_value": deletion,
+        "has_deletion": has_deletion,
+        "deletion_mean": deletion_mean,
+        "profile": profile,
+        "msa_mask": msa_mask,
+    }
+
+
+def process_symmetry_features(
+    cropped: Tokenized, symmetries: dict
+) -> dict[str, Tensor]:
+    """Get the symmetry features.
+
+    Parameters
+    ----------
+    data : Tokenized
+        The tokenized data.
+
+    Returns
+    -------
+    dict[str, Tensor]
+        The symmetry features.
+
+    """
+    features = get_chain_symmetries(cropped)
+    features.update(get_amino_acids_symmetries(cropped))
+    features.update(get_ligand_symmetries(cropped, symmetries))
+
+    return features
+
+
+def process_residue_constraint_features(
+    data: Tokenized,
+) -> dict[str, Tensor]:
+    residue_constraints = data.residue_constraints
+    if residue_constraints is not None:
+        rdkit_bounds_constraints = residue_constraints.rdkit_bounds_constraints
+        chiral_atom_constraints = residue_constraints.chiral_atom_constraints
+        stereo_bond_constraints = residue_constraints.stereo_bond_constraints
+        planar_bond_constraints = residue_constraints.planar_bond_constraints
+        planar_ring_5_constraints = residue_constraints.planar_ring_5_constraints
+        planar_ring_6_constraints = residue_constraints.planar_ring_6_constraints
+
+        rdkit_bounds_index = torch.tensor(
+            rdkit_bounds_constraints["atom_idxs"].copy(), dtype=torch.long
+        ).T
+        rdkit_bounds_bond_mask = torch.tensor(
+            rdkit_bounds_constraints["is_bond"].copy(), dtype=torch.bool
+        )
+        rdkit_bounds_angle_mask = torch.tensor(
+            rdkit_bounds_constraints["is_angle"].copy(), dtype=torch.bool
+        )
+        rdkit_upper_bounds = torch.tensor(
+            rdkit_bounds_constraints["upper_bound"].copy(), dtype=torch.float
+        )
+        rdkit_lower_bounds = torch.tensor(
+            rdkit_bounds_constraints["lower_bound"].copy(), dtype=torch.float
+        )
+
+        chiral_atom_index = torch.tensor(
+            chiral_atom_constraints["atom_idxs"].copy(), dtype=torch.long
+        ).T
+        chiral_reference_mask = torch.tensor(
+            chiral_atom_constraints["is_reference"].copy(), dtype=torch.bool
+        )
+        chiral_atom_orientations = torch.tensor(
+            chiral_atom_constraints["is_r"].copy(), dtype=torch.bool
+        )
+
+        stereo_bond_index = torch.tensor(
+            stereo_bond_constraints["atom_idxs"].copy(), dtype=torch.long
+        ).T
+        stereo_reference_mask = torch.tensor(
+            stereo_bond_constraints["is_reference"].copy(), dtype=torch.bool
+        )
+        stereo_bond_orientations = torch.tensor(
+            stereo_bond_constraints["is_e"].copy(), dtype=torch.bool
+        )
+
+        planar_bond_index = torch.tensor(
+            planar_bond_constraints["atom_idxs"].copy(), dtype=torch.long
+        ).T
+        planar_ring_5_index = torch.tensor(
+            planar_ring_5_constraints["atom_idxs"].copy(), dtype=torch.long
+        ).T
+        planar_ring_6_index = torch.tensor(
+            planar_ring_6_constraints["atom_idxs"].copy(), dtype=torch.long
+        ).T
+    else:
+        rdkit_bounds_index = torch.empty((2, 0), dtype=torch.long)
+        rdkit_bounds_bond_mask = torch.empty((0,), dtype=torch.bool)
+        rdkit_bounds_angle_mask = torch.empty((0,), dtype=torch.bool)
+        rdkit_upper_bounds = torch.empty((0,), dtype=torch.float)
+        rdkit_lower_bounds = torch.empty((0,), dtype=torch.float)
+        chiral_atom_index = torch.empty(
+            (
+                4,
+                0,
+            ),
+            dtype=torch.long,
+        )
+        chiral_reference_mask = torch.empty((0,), dtype=torch.bool)
+        chiral_atom_orientations = torch.empty((0,), dtype=torch.bool)
+        stereo_bond_index = torch.empty((4, 0), dtype=torch.long)
+        stereo_reference_mask = torch.empty((0,), dtype=torch.bool)
+        stereo_bond_orientations = torch.empty((0,), dtype=torch.bool)
+        planar_bond_index = torch.empty((6, 0), dtype=torch.long)
+        planar_ring_5_index = torch.empty((5, 0), dtype=torch.long)
+        planar_ring_6_index = torch.empty((6, 0), dtype=torch.long)
+
+    return {
+        "rdkit_bounds_index": rdkit_bounds_index,
+        "rdkit_bounds_bond_mask": rdkit_bounds_bond_mask,
+        "rdkit_bounds_angle_mask": rdkit_bounds_angle_mask,
+        "rdkit_upper_bounds": rdkit_upper_bounds,
+        "rdkit_lower_bounds": rdkit_lower_bounds,
+        "chiral_atom_index": chiral_atom_index,
+        "chiral_reference_mask": chiral_reference_mask,
+        "chiral_atom_orientations": chiral_atom_orientations,
+        "stereo_bond_index": stereo_bond_index,
+        "stereo_reference_mask": stereo_reference_mask,
+        "stereo_bond_orientations": stereo_bond_orientations,
+        "planar_bond_index": planar_bond_index,
+        "planar_ring_5_index": planar_ring_5_index,
+        "planar_ring_6_index": planar_ring_6_index,
+    }
+
+
+def process_chain_feature_constraints(
+    data: Tokenized,
+) -> dict[str, Tensor]:
+    structure = data.structure
+    if structure.connections.shape[0] > 0:
+        connected_chain_index, connected_atom_index = [], []
+        for connection in structure.connections:
+            connected_chain_index.append([connection["chain_1"], connection["chain_2"]])
+            connected_atom_index.append([connection["atom_1"], connection["atom_2"]])
+        connected_chain_index = torch.tensor(connected_chain_index, dtype=torch.long).T
+        connected_atom_index = torch.tensor(connected_atom_index, dtype=torch.long).T
+    else:
+        connected_chain_index = torch.empty((2, 0), dtype=torch.long)
+        connected_atom_index = torch.empty((2, 0), dtype=torch.long)
+
+    symmetric_chain_index = []
+    for i, chain_i in enumerate(structure.chains):
+        for j, chain_j in enumerate(structure.chains):
+            if j <= i:
+                continue
+            if chain_i["entity_id"] == chain_j["entity_id"]:
+                symmetric_chain_index.append([i, j])
+    if len(symmetric_chain_index) > 0:
+        symmetric_chain_index = torch.tensor(symmetric_chain_index, dtype=torch.long).T
+    else:
+        symmetric_chain_index = torch.empty((2, 0), dtype=torch.long)
+    return {
+        "connected_chain_index": connected_chain_index,
+        "connected_atom_index": connected_atom_index,
+        "symmetric_chain_index": symmetric_chain_index,
+    }
+
+
+class BoltzFeaturizer:
+    """Boltz featurizer."""
+
+    def process(
+        self,
+        data: Tokenized,
+        training: bool,
+        max_seqs: int = 4096,
+        atoms_per_window_queries: int = 32,
+        min_dist: float = 2.0,
+        max_dist: float = 22.0,
+        num_bins: int = 64,
+        max_tokens: Optional[int] = None,
+        max_atoms: Optional[int] = None,
+        pad_to_max_seqs: bool = False,
+        compute_symmetries: bool = False,
+        symmetries: Optional[dict] = None,
+        binder_pocket_conditioned_prop: Optional[float] = 0.0,
+        binder_pocket_cutoff: Optional[float] = 6.0,
+        binder_pocket_sampling_geometric_p: Optional[float] = 0.0,
+        only_ligand_binder_pocket: Optional[bool] = False,
+        inference_binder: Optional[int] = None,
+        inference_pocket: Optional[list[tuple[int, int]]] = None,
+        compute_constraint_features: bool = False,
+    ) -> dict[str, Tensor]:
+        """Compute features.
+
+        Parameters
+        ----------
+        data : Tokenized
+            The tokenized data.
+        training : bool
+            Whether the model is in training mode.
+        max_tokens : int, optional
+            The maximum number of tokens.
+        max_atoms : int, optional
+            The maximum number of atoms
+        max_seqs : int, optional
+            The maximum number of sequences.
+
+        Returns
+        -------
+        dict[str, Tensor]
+            The features for model training.
+
+        """
+        # Compute random number of sequences
+        if training and max_seqs is not None:
+            max_seqs_batch = np.random.randint(1, max_seqs + 1)  # noqa: NPY002
+        else:
+            max_seqs_batch = max_seqs
+
+        # Compute token features
+        token_features = process_token_features(
+            data,
+            max_tokens,
+            binder_pocket_conditioned_prop,
+            binder_pocket_cutoff,
+            binder_pocket_sampling_geometric_p,
+            only_ligand_binder_pocket,
+            inference_binder=inference_binder,
+            inference_pocket=inference_pocket,
+        )
+
+        # Compute atom features
+        atom_features = process_atom_features(
+            data,
+            atoms_per_window_queries,
+            min_dist,
+            max_dist,
+            num_bins,
+            max_atoms,
+            max_tokens,
+        )
+
+        # Compute MSA features
+        msa_features = process_msa_features(
+            data,
+            max_seqs_batch,
+            max_seqs,
+            max_tokens,
+            pad_to_max_seqs,
+        )
+
+        # Compute symmetry features
+        symmetry_features = {}
+        if compute_symmetries:
+            symmetry_features = process_symmetry_features(data, symmetries)
+
+        # Compute constraint features
+        residue_constraint_features = {}
+        chain_constraint_features = {}
+        if compute_constraint_features:
+            residue_constraint_features = process_residue_constraint_features(data)
+            chain_constraint_features = process_chain_feature_constraints(data)
+
+        return {
+            **token_features,
+            **atom_features,
+            **msa_features,
+            **symmetry_features,
+            **residue_constraint_features,
+            **chain_constraint_features,
+        }
diff --git a/forks/boltz/src/boltz/data/feature/featurizerv2.py b/forks/boltz/src/boltz/data/feature/featurizerv2.py
new file mode 100644
index 00000000..b6bea5e4
--- /dev/null
+++ b/forks/boltz/src/boltz/data/feature/featurizerv2.py
@@ -0,0 +1,2354 @@
+import math
+from typing import Optional
+from collections import deque
+import numba
+import numpy as np
+import numpy.typing as npt
+import rdkit.Chem.Descriptors
+import torch
+from numba import types
+from rdkit.Chem import Mol
+from scipy.spatial.distance import cdist
+from torch import Tensor, from_numpy
+from torch.nn.functional import one_hot
+
+from boltz.data import const
+from boltz.data.mol import (
+    get_amino_acids_symmetries,
+    get_chain_symmetries,
+    get_ligand_symmetries,
+    get_symmetries,
+)
+from boltz.data.pad import pad_dim
+from boltz.data.types import (
+    MSA,
+    MSADeletion,
+    MSAResidue,
+    MSASequence,
+    TemplateInfo,
+    Tokenized,
+)
+from boltz.model.modules.utils import center_random_augmentation
+
+####################################################################################################
+# HELPERS
+####################################################################################################
+
+
+def convert_atom_name(name: str) -> tuple[int, int, int, int]:
+    """Convert an atom name to a standard format.
+
+    Parameters
+    ----------
+    name : str
+        The atom name.
+
+    Returns
+    -------
+    tuple[int, int, int, int]
+        The converted atom name.
+
+    """
+    name = str(name).strip()
+    name = [ord(c) - 32 for c in name]
+    name = name + [0] * (4 - len(name))
+    return tuple(name)
+
+
+def sample_d(
+    min_d: float,
+    max_d: float,
+    n_samples: int,
+    random: np.random.Generator,
+) -> np.ndarray:
+    """Generate samples from a 1/d distribution between min_d and max_d.
+
+    Parameters
+    ----------
+    min_d : float
+        Minimum value of d
+    max_d : float
+        Maximum value of d
+    n_samples : int
+        Number of samples to generate
+    random : numpy.random.Generator
+        Random number generator
+
+    Returns
+    -------
+    numpy.ndarray
+        Array of samples drawn from the distribution
+
+    Notes
+    -----
+    The probability density function is:
+    f(d) = 1/(d * ln(max_d/min_d)) for d in [min_d, max_d]
+
+    The inverse CDF transform is:
+    d = min_d * (max_d/min_d)**u where u ~ Uniform(0,1)
+
+    """
+    # Generate n_samples uniform random numbers in [0, 1]
+    u = random.random(n_samples)
+    # Transform u using the inverse CDF
+    return min_d * (max_d / min_d) ** u
+
+
+def compute_frames_nonpolymer(
+    data: Tokenized,
+    coords,
+    resolved_mask,
+    atom_to_token,
+    frame_data: list,
+    resolved_frame_data: list,
+) -> tuple[list, list]:
+    """Get the frames for non-polymer tokens.
+
+    Parameters
+    ----------
+    data : Tokenized
+        The input data to the model.
+    frame_data : list
+        The frame data.
+    resolved_frame_data : list
+        The resolved frame data.
+
+    Returns
+    -------
+    tuple[list, list]
+        The frame data and resolved frame data.
+
+    """
+    frame_data = np.array(frame_data)
+    resolved_frame_data = np.array(resolved_frame_data)
+    asym_id_token = data.tokens["asym_id"]
+    asym_id_atom = data.tokens["asym_id"][atom_to_token]
+    token_idx = 0
+    atom_idx = 0
+    for id in np.unique(data.tokens["asym_id"]):
+        mask_chain_token = asym_id_token == id
+        mask_chain_atom = asym_id_atom == id
+        num_tokens = mask_chain_token.sum()
+        num_atoms = mask_chain_atom.sum()
+        if (
+            data.tokens[token_idx]["mol_type"] != const.chain_type_ids["NONPOLYMER"]
+            or num_atoms < 3  # noqa: PLR2004
+        ):
+            token_idx += num_tokens
+            atom_idx += num_atoms
+            continue
+        dist_mat = (
+            (
+                coords.reshape(-1, 3)[mask_chain_atom][:, None, :]
+                - coords.reshape(-1, 3)[mask_chain_atom][None, :, :]
+            )
+            ** 2
+        ).sum(-1) ** 0.5
+        resolved_pair = 1 - (
+            resolved_mask[mask_chain_atom][None, :]
+            * resolved_mask[mask_chain_atom][:, None]
+        ).astype(np.float32)
+        resolved_pair[resolved_pair == 1] = math.inf
+        indices = np.argsort(dist_mat + resolved_pair, axis=1)
+        frames = (
+            np.concatenate(
+                [
+                    indices[:, 1:2],
+                    indices[:, 0:1],
+                    indices[:, 2:3],
+                ],
+                axis=1,
+            )
+            + atom_idx
+        )
+        frame_data[token_idx : token_idx + num_atoms, :] = frames
+        resolved_frame_data[token_idx : token_idx + num_atoms] = resolved_mask[
+            frames
+        ].all(axis=1)
+        token_idx += num_tokens
+        atom_idx += num_atoms
+    frames_expanded = coords.reshape(-1, 3)[frame_data]
+
+    mask_collinear = compute_collinear_mask(
+        frames_expanded[:, 1] - frames_expanded[:, 0],
+        frames_expanded[:, 1] - frames_expanded[:, 2],
+    )
+    return frame_data, resolved_frame_data & mask_collinear
+
+
+def compute_collinear_mask(v1, v2):
+    norm1 = np.linalg.norm(v1, axis=1, keepdims=True)
+    norm2 = np.linalg.norm(v2, axis=1, keepdims=True)
+    v1 = v1 / (norm1 + 1e-6)
+    v2 = v2 / (norm2 + 1e-6)
+    mask_angle = np.abs(np.sum(v1 * v2, axis=1)) < 0.9063
+    mask_overlap1 = norm1.reshape(-1) > 1e-2
+    mask_overlap2 = norm2.reshape(-1) > 1e-2
+    return mask_angle & mask_overlap1 & mask_overlap2
+
+
+def dummy_msa(residues: np.ndarray) -> MSA:
+    """Create a dummy MSA for a chain.
+
+    Parameters
+    ----------
+    residues : np.ndarray
+        The residues for the chain.
+
+    Returns
+    -------
+    MSA
+        The dummy MSA.
+
+    """
+    residues = [res["res_type"] for res in residues]
+    deletions = []
+    sequences = [(0, -1, 0, len(residues), 0, 0)]
+    return MSA(
+        residues=np.array(residues, dtype=MSAResidue),
+        deletions=np.array(deletions, dtype=MSADeletion),
+        sequences=np.array(sequences, dtype=MSASequence),
+    )
+
+
+def construct_paired_msa(  # noqa: C901, PLR0915, PLR0912
+    data: Tokenized,
+    random: np.random.Generator,
+    max_seqs: int,
+    max_pairs: int = 8192,
+    max_total: int = 16384,
+    random_subset: bool = False,
+) -> tuple[Tensor, Tensor, Tensor]:
+    """Pair the MSA data.
+
+    Parameters
+    ----------
+    data : Tokenized
+        The input data to the model.
+
+    Returns
+    -------
+    Tensor
+        The MSA data.
+    Tensor
+        The deletion data.
+    Tensor
+        Mask indicating paired sequences.
+
+    """
+    # Get unique chains (ensuring monotonicity in the order)
+    assert np.all(np.diff(data.tokens["asym_id"], n=1) >= 0)
+    chain_ids = np.unique(data.tokens["asym_id"])
+
+    # Get relevant MSA, and create a dummy for chains without
+    msa: dict[int, MSA] = {}
+    for chain_id in chain_ids:
+        # Get input sequence
+        chain = data.structure.chains[chain_id]
+        res_start = chain["res_idx"]
+        res_end = res_start + chain["res_num"]
+        residues = data.structure.residues[res_start:res_end]
+
+        # Check if we have an MSA, and that the
+        # first sequence matches the input sequence
+        if chain_id in data.msa:
+            # Set the MSA
+            msa[chain_id] = data.msa[chain_id]
+
+            # Run length and residue type checks
+            first = data.msa[chain_id].sequences[0]
+            first_start = first["res_start"]
+            first_end = first["res_end"]
+            msa_residues = data.msa[chain_id].residues
+            first_residues = msa_residues[first_start:first_end]
+
+            warning = "Warning: MSA does not match input sequence, creating dummy."
+            if len(residues) == len(first_residues):
+                # If there is a mismatch, check if it is between MET & UNK
+                # If so, replace the first sequence with the input sequence.
+                # Otherwise, replace with a dummy MSA for this chain.
+                mismatches = residues["res_type"] != first_residues["res_type"]
+                if mismatches.sum().item():
+                    idx = np.where(mismatches)[0]
+                    is_met = residues["res_type"][idx] == const.token_ids["MET"]
+                    is_unk = residues["res_type"][idx] == const.token_ids["UNK"]
+                    is_msa_unk = (
+                        first_residues["res_type"][idx] == const.token_ids["UNK"]
+                    )
+                    if (np.all(is_met) and np.all(is_msa_unk)) or np.all(is_unk):
+                        msa_residues[first_start:first_end]["res_type"] = residues[
+                            "res_type"
+                        ]
+                    else:
+                        print(
+                            warning,
+                            "1",
+                            residues["res_type"],
+                            first_residues["res_type"],
+                            data.record.id,
+                        )
+                        msa[chain_id] = dummy_msa(residues)
+            else:
+                print(
+                    warning,
+                    "2",
+                    residues["res_type"],
+                    first_residues["res_type"],
+                    data.record.id,
+                )
+                msa[chain_id] = dummy_msa(residues)
+        else:
+            msa[chain_id] = dummy_msa(residues)
+
+    # Map taxonomies to (chain_id, seq_idx)
+    taxonomy_map: dict[str, list] = {}
+    for chain_id, chain_msa in msa.items():
+        sequences = chain_msa.sequences
+        sequences = sequences[sequences["taxonomy"] != -1]
+        for sequence in sequences:
+            seq_idx = sequence["seq_idx"]
+            taxon = sequence["taxonomy"]
+            taxonomy_map.setdefault(taxon, []).append((chain_id, seq_idx))
+
+    # Remove taxonomies with only one sequence and sort by the
+    # number of chain_id present in each of the taxonomies
+    taxonomy_map = {k: v for k, v in taxonomy_map.items() if len(v) > 1}
+    taxonomy_map = sorted(
+        taxonomy_map.items(),
+        key=lambda x: len({c for c, _ in x[1]}),
+        reverse=True,
+    )
+
+    # Keep track of the sequences available per chain, keeping the original
+    # order of the sequences in the MSA to favor the best matching sequences
+    visited = {(c, s) for c, items in taxonomy_map for s in items}
+    available = {}
+    for c in chain_ids:
+        available[c] = deque(
+            i for i in range(1, len(msa[c].sequences)) if (c, i) not in visited
+        )
+
+    # Create sequence pairs
+    is_paired = []
+    pairing = []
+
+    # Start with the first sequence for each chain
+    is_paired.append({c: 1 for c in chain_ids})
+    pairing.append({c: 0 for c in chain_ids})
+
+    # Then add up to 8191 paired rows
+    for _, pairs in taxonomy_map:
+        # Group occurences by chain_id in case we have multiple
+        # sequences from the same chain and same taxonomy
+        chain_occurences = {}
+        for chain_id, seq_idx in pairs:
+            chain_occurences.setdefault(chain_id, []).append(seq_idx)
+
+        # We create as many pairings as the maximum number of occurences
+        max_occurences = max(len(v) for v in chain_occurences.values())
+        for i in range(max_occurences):
+            row_pairing = {}
+            row_is_paired = {}
+
+            # Add the chains present in the taxonomy
+            for chain_id, seq_idxs in chain_occurences.items():
+                # Roll over the sequence index to maximize diversity
+                idx = i % len(seq_idxs)
+                seq_idx = seq_idxs[idx]
+
+                # Add the sequence to the pairing
+                row_pairing[chain_id] = seq_idx
+                row_is_paired[chain_id] = 1
+
+            # Add any missing chains
+            for chain_id in chain_ids:
+                if chain_id not in row_pairing:
+                    row_is_paired[chain_id] = 0
+                    if available[chain_id]:
+                        # Add the next available sequence
+                        row_pairing[chain_id] = available[chain_id].popleft()
+                    else:
+                        # No more sequences available, we place a gap
+                        row_pairing[chain_id] = -1
+
+            pairing.append(row_pairing)
+            is_paired.append(row_is_paired)
+
+            # Break if we have enough pairs
+            if len(pairing) >= max_pairs:
+                break
+
+        # Break if we have enough pairs
+        if len(pairing) >= max_pairs:
+            break
+
+    # Now add up to 16384 unpaired rows total
+    max_left = max(len(v) for v in available.values())
+    for _ in range(min(max_total - len(pairing), max_left)):
+        row_pairing = {}
+        row_is_paired = {}
+        for chain_id in chain_ids:
+            row_is_paired[chain_id] = 0
+            if available[chain_id]:
+                # Add the next available sequence
+                row_pairing[chain_id] = available[chain_id].popleft()
+            else:
+                # No more sequences available, we place a gap
+                row_pairing[chain_id] = -1
+
+        pairing.append(row_pairing)
+        is_paired.append(row_is_paired)
+
+        # Break if we have enough sequences
+        if len(pairing) >= max_total:
+            break
+
+    # Randomly sample a subset of the pairs
+    # ensuring the first row is always present
+    if random_subset:
+        num_seqs = len(pairing)
+        if num_seqs > max_seqs:
+            indices = random.choice(
+                np.arange(1, num_seqs), size=max_seqs - 1, replace=False
+            )  # noqa: NPY002
+            pairing = [pairing[0]] + [pairing[i] for i in indices]
+            is_paired = [is_paired[0]] + [is_paired[i] for i in indices]
+    else:
+        # Deterministic downsample to max_seqs
+        pairing = pairing[:max_seqs]
+        is_paired = is_paired[:max_seqs]
+
+    # Map (chain_id, seq_idx, res_idx) to deletion
+    deletions = numba.typed.Dict.empty(
+        key_type=numba.types.Tuple(
+            [numba.types.int64, numba.types.int64, numba.types.int64]),
+        value_type=numba.types.int64
+    )
+    for chain_id, chain_msa in msa.items():
+        chain_deletions = chain_msa.deletions
+        for sequence in chain_msa.sequences:
+            seq_idx = sequence["seq_idx"]
+            del_start = sequence["del_start"]
+            del_end = sequence["del_end"]
+            chain_deletions = chain_deletions[del_start:del_end]
+            for deletion_data in chain_deletions:
+                res_idx = deletion_data["res_idx"]
+                deletion_values = deletion_data["deletion"]
+                deletions[(chain_id, seq_idx, res_idx)] = deletion_values
+
+    # Add all the token MSA data
+    msa_data, del_data, paired_data = prepare_msa_arrays(
+        data.tokens, pairing, is_paired, deletions, msa
+    )
+
+    msa_data = torch.tensor(msa_data, dtype=torch.long)
+    del_data = torch.tensor(del_data, dtype=torch.float)
+    paired_data = torch.tensor(paired_data, dtype=torch.float)
+
+    return msa_data, del_data, paired_data
+
+
+def prepare_msa_arrays(
+    tokens,
+    pairing: list[dict[int, int]],
+    is_paired: list[dict[int, int]],
+    deletions: dict[tuple[int, int, int], int],
+    msa: dict[int, MSA],
+) -> tuple[npt.NDArray[np.int64], npt.NDArray[np.int64], npt.NDArray[np.int64]]:
+    """Reshape data to play nicely with numba jit."""
+    token_asym_ids_arr = np.array([t["asym_id"] for t in tokens], dtype=np.int64)
+    token_res_idxs_arr = np.array([t["res_idx"] for t in tokens], dtype=np.int64)
+
+    chain_ids = sorted(msa.keys())
+
+    # chain_ids are not necessarily contiguous (e.g. they might be 0, 24, 25).
+    # This allows us to look up a chain_id by it's index in the chain_ids list.
+    chain_id_to_idx = {chain_id: i for i, chain_id in enumerate(chain_ids)}
+    token_asym_ids_idx_arr = np.array(
+        [chain_id_to_idx[asym_id] for asym_id in token_asym_ids_arr], dtype=np.int64
+    )
+
+    pairing_arr = np.zeros((len(pairing), len(chain_ids)), dtype=np.int64)
+    is_paired_arr = np.zeros((len(is_paired), len(chain_ids)), dtype=np.int64)
+
+    for i, row_pairing in enumerate(pairing):
+        for chain_id in chain_ids:
+            pairing_arr[i, chain_id_to_idx[chain_id]] = row_pairing[chain_id]
+
+    for i, row_is_paired in enumerate(is_paired):
+        for chain_id in chain_ids:
+            is_paired_arr[i, chain_id_to_idx[chain_id]] = row_is_paired[chain_id]
+
+    max_seq_len = max(len(msa[chain_id].sequences) for chain_id in chain_ids)
+
+    # we want res_start from sequences
+    msa_sequences = np.full((len(chain_ids), max_seq_len), -1, dtype=np.int64)
+    for chain_id in chain_ids:
+        for i, seq in enumerate(msa[chain_id].sequences):
+            msa_sequences[chain_id_to_idx[chain_id], i] = seq["res_start"]
+
+    max_residues_len = max(len(msa[chain_id].residues) for chain_id in chain_ids)
+    msa_residues = np.full((len(chain_ids), max_residues_len), -1, dtype=np.int64)
+    for chain_id in chain_ids:
+        residues = msa[chain_id].residues.astype(np.int64)
+        idxs = np.arange(len(residues))
+        chain_idx = chain_id_to_idx[chain_id]
+        msa_residues[chain_idx, idxs] = residues
+
+    return _prepare_msa_arrays_inner(
+        token_asym_ids_arr,
+        token_res_idxs_arr,
+        token_asym_ids_idx_arr,
+        pairing_arr,
+        is_paired_arr,
+        deletions,
+        msa_sequences,
+        msa_residues,
+        const.token_ids["-"],
+    )
+
+
+deletions_dict_type = types.DictType(types.UniTuple(types.int64, 3), types.int64)
+
+
+@numba.njit(
+    [
+        types.Tuple(
+            (
+                types.int64[:, ::1],  # msa_data
+                types.int64[:, ::1],  # del_data
+                types.int64[:, ::1],  # paired_data
+            )
+        )(
+            types.int64[::1],  # token_asym_ids
+            types.int64[::1],  # token_res_idxs
+            types.int64[::1],  # token_asym_ids_idx
+            types.int64[:, ::1],  # pairing
+            types.int64[:, ::1],  # is_paired
+            deletions_dict_type,  # deletions
+            types.int64[:, ::1],  # msa_sequences
+            types.int64[:, ::1],  # msa_residues
+            types.int64,  # gap_token
+        )
+    ],
+    cache=True,
+)
+def _prepare_msa_arrays_inner(
+    token_asym_ids: npt.NDArray[np.int64],
+    token_res_idxs: npt.NDArray[np.int64],
+    token_asym_ids_idx: npt.NDArray[np.int64],
+    pairing: npt.NDArray[np.int64],
+    is_paired: npt.NDArray[np.int64],
+    deletions: dict[tuple[int, int, int], int],
+    msa_sequences: npt.NDArray[np.int64],
+    msa_residues: npt.NDArray[np.int64],
+    gap_token: int,
+) -> tuple[npt.NDArray[np.int64], npt.NDArray[np.int64], npt.NDArray[np.int64]]:
+    n_tokens = len(token_asym_ids)
+    n_pairs = len(pairing)
+    msa_data = np.full((n_tokens, n_pairs), gap_token, dtype=np.int64)
+    paired_data = np.zeros((n_tokens, n_pairs), dtype=np.int64)
+    del_data = np.zeros((n_tokens, n_pairs), dtype=np.int64)
+
+    # Add all the token MSA data
+    for token_idx in range(n_tokens):
+        chain_id_idx = token_asym_ids_idx[token_idx]
+        chain_id = token_asym_ids[token_idx]
+        res_idx = token_res_idxs[token_idx]
+
+        for pair_idx in range(n_pairs):
+            seq_idx = pairing[pair_idx, chain_id_idx]
+            paired_data[token_idx, pair_idx] = is_paired[pair_idx, chain_id_idx]
+
+            # Add residue type
+            if seq_idx != -1:
+                res_start = msa_sequences[chain_id_idx, seq_idx]
+                res_type = msa_residues[chain_id_idx, res_start + res_idx]
+                k = (chain_id, seq_idx, res_idx)
+                if k in deletions:
+                    del_data[token_idx, pair_idx] = deletions[k]
+                msa_data[token_idx, pair_idx] = res_type
+
+    return msa_data, del_data, paired_data
+
+
+####################################################################################################
+# FEATURES
+####################################################################################################
+
+
+def select_subset_from_mask(mask, p, random: np.random.Generator) -> np.ndarray:
+    num_true = np.sum(mask)
+    v = random.geometric(p) + 1
+    k = min(v, num_true)
+
+    true_indices = np.where(mask)[0]
+
+    # Randomly select k indices from the true_indices
+    selected_indices = random.choice(true_indices, size=k, replace=False)
+
+    new_mask = np.zeros_like(mask)
+    new_mask[selected_indices] = 1
+
+    return new_mask
+
+
+def get_range_bin(value: float, range_dict: dict[tuple[float, float], int], default=0):
+    """Get the bin of a value given a range dictionary."""
+    value = float(value)
+    for k, idx in range_dict.items():
+        if k == "other":
+            continue
+        low, high = k
+        if low <= value < high:
+            return idx
+    return default
+
+
+def process_token_features(  # noqa: C901, PLR0915, PLR0912
+    data: Tokenized,
+    random: np.random.Generator,
+    max_tokens: Optional[int] = None,
+    binder_pocket_conditioned_prop: Optional[float] = 0.0,
+    contact_conditioned_prop: Optional[float] = 0.0,
+    binder_pocket_cutoff_min: Optional[float] = 4.0,
+    binder_pocket_cutoff_max: Optional[float] = 20.0,
+    binder_pocket_sampling_geometric_p: Optional[float] = 0.0,
+    only_ligand_binder_pocket: Optional[bool] = False,
+    only_pp_contact: Optional[bool] = False,
+    inference_pocket_constraints: Optional[
+        list[tuple[int, list[tuple[int, int]], float]]
+    ] = False,
+    inference_contact_constraints: Optional[
+        list[tuple[tuple[int, int], tuple[int, int], float]]
+    ] = False,
+    override_method: Optional[str] = None,
+) -> dict[str, Tensor]:
+    """Get the token features.
+
+    Parameters
+    ----------
+    data : Tokenized
+        The input data to the model.
+    max_tokens : int
+        The maximum number of tokens.
+
+    Returns
+    -------
+    dict[str, Tensor]
+        The token features.
+
+    """
+    # Token data
+    token_data = data.tokens
+    token_bonds = data.bonds
+
+    # Token core features
+    token_index = torch.arange(len(token_data), dtype=torch.long)
+    residue_index = from_numpy(token_data["res_idx"]).long()
+    asym_id = from_numpy(token_data["asym_id"]).long()
+    entity_id = from_numpy(token_data["entity_id"]).long()
+    sym_id = from_numpy(token_data["sym_id"]).long()
+    mol_type = from_numpy(token_data["mol_type"]).long()
+    res_type = from_numpy(token_data["res_type"]).long()
+    res_type = one_hot(res_type, num_classes=const.num_tokens)
+    disto_center = from_numpy(token_data["disto_coords"])
+    modified = from_numpy(token_data["modified"]).long()  # float()
+    cyclic_period = from_numpy(token_data["cyclic_period"].copy())
+    affinity_mask = from_numpy(token_data["affinity_mask"]).float()
+
+    ## Conditioning features ##
+    method = (
+        np.zeros(len(token_data))
+        + const.method_types_ids[
+            (
+                "x-ray diffraction"
+                if override_method is None
+                else override_method.lower()
+            )
+        ]
+    )
+    if data.record is not None:
+        if (
+            override_method is None
+            and data.record.structure.method is not None
+            and data.record.structure.method.lower() in const.method_types_ids
+        ):
+            method = (method * 0) + const.method_types_ids[
+                data.record.structure.method.lower()
+            ]
+
+    method_feature = from_numpy(method).long()
+
+    # Token mask features
+    pad_mask = torch.ones(len(token_data), dtype=torch.float)
+    resolved_mask = from_numpy(token_data["resolved_mask"]).float()
+    disto_mask = from_numpy(token_data["disto_mask"]).float()
+
+    # Token bond features
+    if max_tokens is not None:
+        pad_len = max_tokens - len(token_data)
+        num_tokens = max_tokens if pad_len > 0 else len(token_data)
+    else:
+        num_tokens = len(token_data)
+
+    tok_to_idx = {tok["token_idx"]: idx for idx, tok in enumerate(token_data)}
+    bonds = torch.zeros(num_tokens, num_tokens, dtype=torch.float)
+    bonds_type = torch.zeros(num_tokens, num_tokens, dtype=torch.long)
+    for token_bond in token_bonds:
+        token_1 = tok_to_idx[token_bond["token_1"]]
+        token_2 = tok_to_idx[token_bond["token_2"]]
+        bonds[token_1, token_2] = 1
+        bonds[token_2, token_1] = 1
+        bond_type = token_bond["type"]
+        bonds_type[token_1, token_2] = bond_type
+        bonds_type[token_2, token_1] = bond_type
+
+    bonds = bonds.unsqueeze(-1)
+
+    # Pocket conditioned feature
+    contact_conditioning = (
+        np.zeros((len(token_data), len(token_data)))
+        + const.contact_conditioning_info["UNSELECTED"]
+    )
+    contact_threshold = np.zeros((len(token_data), len(token_data)))
+
+    if inference_pocket_constraints is not None:
+        for binder, contacts, max_distance, force in inference_pocket_constraints:
+            binder_mask = token_data["asym_id"] == binder
+
+            for idx, token in enumerate(token_data):
+                if (
+                    token["mol_type"] != const.chain_type_ids["NONPOLYMER"]
+                    and (token["asym_id"], token["res_idx"]) in contacts
+                ) or (
+                    token["mol_type"] == const.chain_type_ids["NONPOLYMER"]
+                    and (token["asym_id"], token["atom_idx"]) in contacts
+                ):
+                    contact_conditioning[binder_mask, idx] = (
+                        const.contact_conditioning_info["BINDER>POCKET"]
+                    )
+                    contact_conditioning[idx, binder_mask] = (
+                        const.contact_conditioning_info["POCKET>BINDER"]
+                    )
+                    contact_threshold[binder_mask, idx] = max_distance
+                    contact_threshold[idx, binder_mask] = max_distance
+
+    if inference_contact_constraints is not None:
+        for token1, token2, max_distance, force in inference_contact_constraints:
+            for idx1, _token1 in enumerate(token_data):
+                if (
+                    _token1["mol_type"] != const.chain_type_ids["NONPOLYMER"]
+                    and (_token1["asym_id"], _token1["res_idx"]) == token1
+                ) or (
+                    _token1["mol_type"] == const.chain_type_ids["NONPOLYMER"]
+                    and (_token1["asym_id"], _token1["atom_idx"]) == token1
+                ):
+                    for idx2, _token2 in enumerate(token_data):
+                        if (
+                            _token2["mol_type"] != const.chain_type_ids["NONPOLYMER"]
+                            and (_token2["asym_id"], _token2["res_idx"]) == token2
+                        ) or (
+                            _token2["mol_type"] == const.chain_type_ids["NONPOLYMER"]
+                            and (_token2["asym_id"], _token2["atom_idx"]) == token2
+                        ):
+                            contact_conditioning[idx1, idx2] = (
+                                const.contact_conditioning_info["CONTACT"]
+                            )
+                            contact_conditioning[idx2, idx1] = (
+                                const.contact_conditioning_info["CONTACT"]
+                            )
+                            contact_threshold[idx1, idx2] = max_distance
+                            contact_threshold[idx2, idx1] = max_distance
+                            break
+                    break
+
+    if binder_pocket_conditioned_prop > 0.0:
+        # choose as binder a random ligand in the crop, if there are no ligands select a protein chain
+        binder_asym_ids = np.unique(
+            token_data["asym_id"][
+                token_data["mol_type"] == const.chain_type_ids["NONPOLYMER"]
+            ]
+        )
+
+        if len(binder_asym_ids) == 0:
+            if not only_ligand_binder_pocket:
+                binder_asym_ids = np.unique(token_data["asym_id"])
+
+        while random.random() < binder_pocket_conditioned_prop:
+            if len(binder_asym_ids) == 0:
+                break
+
+            pocket_asym_id = random.choice(binder_asym_ids)
+            binder_asym_ids = binder_asym_ids[binder_asym_ids != pocket_asym_id]
+
+            binder_pocket_cutoff = sample_d(
+                min_d=binder_pocket_cutoff_min,
+                max_d=binder_pocket_cutoff_max,
+                n_samples=1,
+                random=random,
+            )
+
+            binder_mask = token_data["asym_id"] == pocket_asym_id
+
+            binder_coords = []
+            for token in token_data:
+                if token["asym_id"] == pocket_asym_id:
+                    _coords = data.structure.atoms["coords"][
+                        token["atom_idx"] : token["atom_idx"] + token["atom_num"]
+                    ]
+                    _is_present = data.structure.atoms["is_present"][
+                        token["atom_idx"] : token["atom_idx"] + token["atom_num"]
+                    ]
+                    binder_coords.append(_coords[_is_present])
+            binder_coords = np.concatenate(binder_coords, axis=0)
+
+            # find the tokens in the pocket
+            token_dist = np.zeros(len(token_data)) + 1000
+            for i, token in enumerate(token_data):
+                if (
+                    token["mol_type"] != const.chain_type_ids["NONPOLYMER"]
+                    and token["asym_id"] != pocket_asym_id
+                    and token["resolved_mask"] == 1
+                ):
+                    token_coords = data.structure.atoms["coords"][
+                        token["atom_idx"] : token["atom_idx"] + token["atom_num"]
+                    ]
+                    token_is_present = data.structure.atoms["is_present"][
+                        token["atom_idx"] : token["atom_idx"] + token["atom_num"]
+                    ]
+                    token_coords = token_coords[token_is_present]
+
+                    # find chain and apply chain transformation
+                    for chain in data.structure.chains:
+                        if chain["asym_id"] == token["asym_id"]:
+                            break
+
+                    token_dist[i] = np.min(
+                        np.linalg.norm(
+                            token_coords[:, None, :] - binder_coords[None, :, :],
+                            axis=-1,
+                        )
+                    )
+
+            pocket_mask = token_dist < binder_pocket_cutoff
+
+            if np.sum(pocket_mask) > 0:
+                if binder_pocket_sampling_geometric_p > 0.0:
+                    # select a subset of the pocket, according
+                    # to a geometric distribution with one as minimum
+                    pocket_mask = select_subset_from_mask(
+                        pocket_mask,
+                        binder_pocket_sampling_geometric_p,
+                        random,
+                    )
+
+                contact_conditioning[np.ix_(binder_mask, pocket_mask)] = (
+                    const.contact_conditioning_info["BINDER>POCKET"]
+                )
+                contact_conditioning[np.ix_(pocket_mask, binder_mask)] = (
+                    const.contact_conditioning_info["POCKET>BINDER"]
+                )
+                contact_threshold[np.ix_(binder_mask, pocket_mask)] = (
+                    binder_pocket_cutoff
+                )
+                contact_threshold[np.ix_(pocket_mask, binder_mask)] = (
+                    binder_pocket_cutoff
+                )
+
+    # Contact conditioning feature
+    if contact_conditioned_prop > 0.0:
+        while random.random() < contact_conditioned_prop:
+            contact_cutoff = sample_d(
+                min_d=binder_pocket_cutoff_min,
+                max_d=binder_pocket_cutoff_max,
+                n_samples=1,
+                random=random,
+            )
+            if only_pp_contact:
+                chain_asym_ids = np.unique(
+                    token_data["asym_id"][
+                        token_data["mol_type"] == const.chain_type_ids["PROTEIN"]
+                    ]
+                )
+            else:
+                chain_asym_ids = np.unique(token_data["asym_id"])
+
+            if len(chain_asym_ids) > 1:
+                chain_asym_id = random.choice(chain_asym_ids)
+
+                chain_coords = []
+                for token in token_data:
+                    if token["asym_id"] == chain_asym_id:
+                        _coords = data.structure.atoms["coords"][
+                            token["atom_idx"] : token["atom_idx"] + token["atom_num"]
+                        ]
+                        _is_present = data.structure.atoms["is_present"][
+                            token["atom_idx"] : token["atom_idx"] + token["atom_num"]
+                        ]
+                        chain_coords.append(_coords[_is_present])
+                chain_coords = np.concatenate(chain_coords, axis=0)
+
+                # find contacts in other chains
+                possible_other_chains = []
+                for other_chain_id in chain_asym_ids[chain_asym_ids != chain_asym_id]:
+                    for token in token_data:
+                        if token["asym_id"] == other_chain_id:
+                            _coords = data.structure.atoms["coords"][
+                                token["atom_idx"] : token["atom_idx"]
+                                + token["atom_num"]
+                            ]
+                            _is_present = data.structure.atoms["is_present"][
+                                token["atom_idx"] : token["atom_idx"]
+                                + token["atom_num"]
+                            ]
+                            if _is_present.sum() == 0:
+                                continue
+                            token_coords = _coords[_is_present]
+
+                            # check minimum distance
+                            if (
+                                np.min(cdist(chain_coords, token_coords))
+                                < contact_cutoff
+                            ):
+                                possible_other_chains.append(other_chain_id)
+                                break
+
+                if len(possible_other_chains) > 0:
+                    other_chain_id = random.choice(possible_other_chains)
+
+                    pairs = []
+                    for token_1 in token_data:
+                        if token_1["asym_id"] == chain_asym_id:
+                            _coords = data.structure.atoms["coords"][
+                                token_1["atom_idx"] : token_1["atom_idx"]
+                                + token_1["atom_num"]
+                            ]
+                            _is_present = data.structure.atoms["is_present"][
+                                token_1["atom_idx"] : token_1["atom_idx"]
+                                + token_1["atom_num"]
+                            ]
+                            if _is_present.sum() == 0:
+                                continue
+                            token_1_coords = _coords[_is_present]
+
+                            for token_2 in token_data:
+                                if token_2["asym_id"] == other_chain_id:
+                                    _coords = data.structure.atoms["coords"][
+                                        token_2["atom_idx"] : token_2["atom_idx"]
+                                        + token_2["atom_num"]
+                                    ]
+                                    _is_present = data.structure.atoms["is_present"][
+                                        token_2["atom_idx"] : token_2["atom_idx"]
+                                        + token_2["atom_num"]
+                                    ]
+                                    if _is_present.sum() == 0:
+                                        continue
+                                    token_2_coords = _coords[_is_present]
+
+                                    if (
+                                        np.min(cdist(token_1_coords, token_2_coords))
+                                        < contact_cutoff
+                                    ):
+                                        pairs.append(
+                                            (token_1["token_idx"], token_2["token_idx"])
+                                        )
+
+                    assert len(pairs) > 0
+
+                    pair = random.choice(pairs)
+                    token_1_mask = token_data["token_idx"] == pair[0]
+                    token_2_mask = token_data["token_idx"] == pair[1]
+
+                    contact_conditioning[np.ix_(token_1_mask, token_2_mask)] = (
+                        const.contact_conditioning_info["CONTACT"]
+                    )
+                    contact_conditioning[np.ix_(token_2_mask, token_1_mask)] = (
+                        const.contact_conditioning_info["CONTACT"]
+                    )
+
+            elif not only_pp_contact:
+                # only one chain, find contacts within the chain with minimum residue distance
+                pairs = []
+                for token_1 in token_data:
+                    _coords = data.structure.atoms["coords"][
+                        token_1["atom_idx"] : token_1["atom_idx"] + token_1["atom_num"]
+                    ]
+                    _is_present = data.structure.atoms["is_present"][
+                        token_1["atom_idx"] : token_1["atom_idx"] + token_1["atom_num"]
+                    ]
+                    if _is_present.sum() == 0:
+                        continue
+                    token_1_coords = _coords[_is_present]
+
+                    for token_2 in token_data:
+                        if np.abs(token_1["res_idx"] - token_2["res_idx"]) <= 8:
+                            continue
+
+                        _coords = data.structure.atoms["coords"][
+                            token_2["atom_idx"] : token_2["atom_idx"]
+                            + token_2["atom_num"]
+                        ]
+                        _is_present = data.structure.atoms["is_present"][
+                            token_2["atom_idx"] : token_2["atom_idx"]
+                            + token_2["atom_num"]
+                        ]
+                        if _is_present.sum() == 0:
+                            continue
+                        token_2_coords = _coords[_is_present]
+
+                        if (
+                            np.min(cdist(token_1_coords, token_2_coords))
+                            < contact_cutoff
+                        ):
+                            pairs.append((token_1["token_idx"], token_2["token_idx"]))
+
+                if len(pairs) > 0:
+                    pair = random.choice(pairs)
+                    token_1_mask = token_data["token_idx"] == pair[0]
+                    token_2_mask = token_data["token_idx"] == pair[1]
+
+                    contact_conditioning[np.ix_(token_1_mask, token_2_mask)] = (
+                        const.contact_conditioning_info["CONTACT"]
+                    )
+                    contact_conditioning[np.ix_(token_2_mask, token_1_mask)] = (
+                        const.contact_conditioning_info["CONTACT"]
+                    )
+
+    if np.all(contact_conditioning == const.contact_conditioning_info["UNSELECTED"]):
+        contact_conditioning = (
+            contact_conditioning
+            - const.contact_conditioning_info["UNSELECTED"]
+            + const.contact_conditioning_info["UNSPECIFIED"]
+        )
+    contact_conditioning = from_numpy(contact_conditioning).long()
+    contact_conditioning = one_hot(
+        contact_conditioning, num_classes=len(const.contact_conditioning_info)
+    )
+    contact_threshold = from_numpy(contact_threshold).float()
+
+    # compute cyclic polymer mask
+    cyclic_ids = {}
+    for idx_chain, asym_id_iter in enumerate(data.structure.chains["asym_id"]):
+        for connection in data.structure.bonds:
+            if (
+                idx_chain == connection["chain_1"] == connection["chain_2"]
+                and data.structure.chains[connection["chain_1"]]["res_num"] > 2
+                and connection["res_1"]
+                != connection["res_2"]  # Avoid same residue bonds!
+            ):
+                if (
+                    data.structure.chains[connection["chain_1"]]["res_num"]
+                    == (connection["res_2"] + 1)
+                    and connection["res_1"] == 0
+                ) or (
+                    data.structure.chains[connection["chain_1"]]["res_num"]
+                    == (connection["res_1"] + 1)
+                    and connection["res_2"] == 0
+                ):
+                    cyclic_ids[asym_id_iter] = data.structure.chains[
+                        connection["chain_1"]
+                    ]["res_num"]
+    cyclic = from_numpy(
+        np.array(
+            [
+                (cyclic_ids[asym_id_iter] if asym_id_iter in cyclic_ids else 0)
+                for asym_id_iter in token_data["asym_id"]
+            ]
+        )
+    ).float()
+
+    # cyclic period is either computed from the bonds or given as input flag
+    cyclic_period = torch.maximum(cyclic, cyclic_period)
+
+    # Pad to max tokens if given
+    if max_tokens is not None:
+        pad_len = max_tokens - len(token_data)
+        if pad_len > 0:
+            token_index = pad_dim(token_index, 0, pad_len)
+            residue_index = pad_dim(residue_index, 0, pad_len)
+            asym_id = pad_dim(asym_id, 0, pad_len)
+            entity_id = pad_dim(entity_id, 0, pad_len)
+            sym_id = pad_dim(sym_id, 0, pad_len)
+            mol_type = pad_dim(mol_type, 0, pad_len)
+            res_type = pad_dim(res_type, 0, pad_len)
+            disto_center = pad_dim(disto_center, 0, pad_len)
+            pad_mask = pad_dim(pad_mask, 0, pad_len)
+            resolved_mask = pad_dim(resolved_mask, 0, pad_len)
+            disto_mask = pad_dim(disto_mask, 0, pad_len)
+            contact_conditioning = pad_dim(contact_conditioning, 0, pad_len)
+            contact_conditioning = pad_dim(contact_conditioning, 1, pad_len)
+            contact_threshold = pad_dim(contact_threshold, 0, pad_len)
+            contact_threshold = pad_dim(contact_threshold, 1, pad_len)
+            method_feature = pad_dim(method_feature, 0, pad_len)
+            modified = pad_dim(modified, 0, pad_len)
+            cyclic_period = pad_dim(cyclic_period, 0, pad_len)
+            affinity_mask = pad_dim(affinity_mask, 0, pad_len)
+
+    token_features = {
+        "token_index": token_index,
+        "residue_index": residue_index,
+        "asym_id": asym_id,
+        "entity_id": entity_id,
+        "sym_id": sym_id,
+        "mol_type": mol_type,
+        "res_type": res_type,
+        "disto_center": disto_center,
+        "token_bonds": bonds,
+        "type_bonds": bonds_type,
+        "token_pad_mask": pad_mask,
+        "token_resolved_mask": resolved_mask,
+        "token_disto_mask": disto_mask,
+        "contact_conditioning": contact_conditioning,
+        "contact_threshold": contact_threshold,
+        "method_feature": method_feature,
+        "modified": modified,
+        "cyclic_period": cyclic_period,
+        "affinity_token_mask": affinity_mask,
+    }
+
+    return token_features
+
+
+def process_atom_features(
+    data: Tokenized,
+    random: np.random.Generator,
+    ensemble_features: dict,
+    molecules: dict[str, Mol],
+    atoms_per_window_queries: int = 32,
+    min_dist: float = 2.0,
+    max_dist: float = 22.0,
+    num_bins: int = 64,
+    max_atoms: Optional[int] = None,
+    max_tokens: Optional[int] = None,
+    disto_use_ensemble: Optional[bool] = False,
+    override_bfactor: bool = False,
+    compute_frames: bool = False,
+    override_coords: Optional[Tensor] = None,
+    bfactor_md_correction: bool = False,
+) -> dict[str, Tensor]:
+    """Get the atom features.
+
+    Parameters
+    ----------
+    data : Tokenized
+        The input to the model.
+    max_atoms : int, optional
+        The maximum number of atoms.
+
+    Returns
+    -------
+    dict[str, Tensor]
+        The atom features.
+
+    """
+    # Filter to tokens' atoms
+    atom_data = []
+    atom_name = []
+    atom_element = []
+    atom_charge = []
+    atom_conformer = []
+    atom_chirality = []
+    ref_space_uid = []
+    coord_data = []
+    if compute_frames:
+        frame_data = []
+        resolved_frame_data = []
+    atom_to_token = []
+    token_to_rep_atom = []  # index on cropped atom table
+    r_set_to_rep_atom = []
+    disto_coords_ensemble = []
+    backbone_feat_index = []
+    token_to_center_atom = []
+
+    e_offsets = data.structure.ensemble["atom_coord_idx"]
+    atom_idx = 0
+
+    # Start atom idx in full atom table for structures chosen. Up to num_ensembles points.
+    ensemble_atom_starts = [
+        data.structure.ensemble[idx]["atom_coord_idx"]
+        for idx in ensemble_features["ensemble_ref_idxs"]
+    ]
+
+    # Set unk chirality id
+    unk_chirality = const.chirality_type_ids[const.unk_chirality_type]
+
+    chain_res_ids = {}
+    res_index_to_conf_id = {}
+    for token_id, token in enumerate(data.tokens):
+        # Get the chain residue ids
+        chain_idx, res_id = token["asym_id"], token["res_idx"]
+        chain = data.structure.chains[chain_idx]
+
+        if (chain_idx, res_id) not in chain_res_ids:
+            new_idx = len(chain_res_ids)
+            chain_res_ids[(chain_idx, res_id)] = new_idx
+        else:
+            new_idx = chain_res_ids[(chain_idx, res_id)]
+
+        # Get the molecule and conformer
+        mol = molecules[token["res_name"]]
+        atom_name_to_ref = {a.GetProp("name"): a for a in mol.GetAtoms()}
+
+        # Sample a random conformer
+        if (chain_idx, res_id) not in res_index_to_conf_id:
+            conf_ids = [int(conf.GetId()) for conf in mol.GetConformers()]
+            conf_id = int(random.choice(conf_ids))
+            res_index_to_conf_id[(chain_idx, res_id)] = conf_id
+
+        conf_id = res_index_to_conf_id[(chain_idx, res_id)]
+        conformer = mol.GetConformer(conf_id)
+
+        # Map atoms to token indices
+        ref_space_uid.extend([new_idx] * token["atom_num"])
+        atom_to_token.extend([token_id] * token["atom_num"])
+
+        # Add atom data
+        start = token["atom_idx"]
+        end = token["atom_idx"] + token["atom_num"]
+        token_atoms = data.structure.atoms[start:end]
+
+        # Add atom ref data
+        # element, charge, conformer, chirality
+        token_atom_name = np.array([convert_atom_name(a["name"]) for a in token_atoms])
+        token_atoms_ref = np.array([atom_name_to_ref[a["name"]] for a in token_atoms])
+        token_atoms_element = np.array([a.GetAtomicNum() for a in token_atoms_ref])
+        token_atoms_charge = np.array([a.GetFormalCharge() for a in token_atoms_ref])
+        token_atoms_conformer = np.array(
+            [
+                (
+                    conformer.GetAtomPosition(a.GetIdx()).x,
+                    conformer.GetAtomPosition(a.GetIdx()).y,
+                    conformer.GetAtomPosition(a.GetIdx()).z,
+                )
+                for a in token_atoms_ref
+            ]
+        )
+        token_atoms_chirality = np.array(
+            [
+                const.chirality_type_ids.get(a.GetChiralTag().name, unk_chirality)
+                for a in token_atoms_ref
+            ]
+        )
+
+        # Map token to representative atom
+        token_to_rep_atom.append(atom_idx + token["disto_idx"] - start)
+        token_to_center_atom.append(atom_idx + token["center_idx"] - start)
+        if (chain["mol_type"] != const.chain_type_ids["NONPOLYMER"]) and token[
+            "resolved_mask"
+        ]:
+            r_set_to_rep_atom.append(atom_idx + token["center_idx"] - start)
+
+        if chain["mol_type"] == const.chain_type_ids["PROTEIN"]:
+            backbone_index = [
+                (
+                    const.protein_backbone_atom_index[atom_name] + 1
+                    if atom_name in const.protein_backbone_atom_index
+                    else 0
+                )
+                for atom_name in token_atoms["name"]
+            ]
+        elif (
+            chain["mol_type"] == const.chain_type_ids["DNA"]
+            or chain["mol_type"] == const.chain_type_ids["RNA"]
+        ):
+            backbone_index = [
+                (
+                    const.nucleic_backbone_atom_index[atom_name]
+                    + 1
+                    + len(const.protein_backbone_atom_index)
+                    if atom_name in const.nucleic_backbone_atom_index
+                    else 0
+                )
+                for atom_name in token_atoms["name"]
+            ]
+        else:
+            backbone_index = [0] * token["atom_num"]
+        backbone_feat_index.extend(backbone_index)
+
+        # Get token coordinates across sampled ensembles  and apply transforms
+        token_coords = np.array(
+            [
+                data.structure.coords[
+                    ensemble_atom_start + start : ensemble_atom_start + end
+                ]["coords"]
+                for ensemble_atom_start in ensemble_atom_starts
+            ]
+        )
+        coord_data.append(token_coords)
+
+        if compute_frames:
+            # Get frame data
+            res_type = const.tokens[token["res_type"]]
+            res_name = str(token["res_name"])
+
+            if token["atom_num"] < 3 or res_type in ["PAD", "UNK", "-"]:
+                idx_frame_a, idx_frame_b, idx_frame_c = 0, 0, 0
+                mask_frame = False
+            elif (token["mol_type"] == const.chain_type_ids["PROTEIN"]) and (
+                res_name in const.ref_atoms
+            ):
+                idx_frame_a, idx_frame_b, idx_frame_c = (
+                    const.ref_atoms[res_name].index("N"),
+                    const.ref_atoms[res_name].index("CA"),
+                    const.ref_atoms[res_name].index("C"),
+                )
+                mask_frame = (
+                    token_atoms["is_present"][idx_frame_a]
+                    and token_atoms["is_present"][idx_frame_b]
+                    and token_atoms["is_present"][idx_frame_c]
+                )
+            elif (
+                token["mol_type"] == const.chain_type_ids["DNA"]
+                or token["mol_type"] == const.chain_type_ids["RNA"]
+            ) and (res_name in const.ref_atoms):
+                idx_frame_a, idx_frame_b, idx_frame_c = (
+                    const.ref_atoms[res_name].index("C1'"),
+                    const.ref_atoms[res_name].index("C3'"),
+                    const.ref_atoms[res_name].index("C4'"),
+                )
+                mask_frame = (
+                    token_atoms["is_present"][idx_frame_a]
+                    and token_atoms["is_present"][idx_frame_b]
+                    and token_atoms["is_present"][idx_frame_c]
+                )
+            elif token["mol_type"] == const.chain_type_ids["PROTEIN"]:
+                # Try to look for the atom nams in the modified residue
+                is_ca = token_atoms["name"] == "CA"
+                idx_frame_a = is_ca.argmax()
+                ca_present = (
+                    token_atoms[idx_frame_a]["is_present"] if is_ca.any() else False
+                )
+
+                is_n = token_atoms["name"] == "N"
+                idx_frame_b = is_n.argmax()
+                n_present = (
+                    token_atoms[idx_frame_b]["is_present"] if is_n.any() else False
+                )
+
+                is_c = token_atoms["name"] == "C"
+                idx_frame_c = is_c.argmax()
+                c_present = (
+                    token_atoms[idx_frame_c]["is_present"] if is_c.any() else False
+                )
+                mask_frame = ca_present and n_present and c_present
+
+            elif (token["mol_type"] == const.chain_type_ids["DNA"]) or (
+                token["mol_type"] == const.chain_type_ids["RNA"]
+            ):
+                # Try to look for the atom nams in the modified residue
+                is_c1 = token_atoms["name"] == "C1'"
+                idx_frame_a = is_c1.argmax()
+                c1_present = (
+                    token_atoms[idx_frame_a]["is_present"] if is_c1.any() else False
+                )
+
+                is_c3 = token_atoms["name"] == "C3'"
+                idx_frame_b = is_c3.argmax()
+                c3_present = (
+                    token_atoms[idx_frame_b]["is_present"] if is_c3.any() else False
+                )
+
+                is_c4 = token_atoms["name"] == "C4'"
+                idx_frame_c = is_c4.argmax()
+                c4_present = (
+                    token_atoms[idx_frame_c]["is_present"] if is_c4.any() else False
+                )
+                mask_frame = c1_present and c3_present and c4_present
+            else:
+                idx_frame_a, idx_frame_b, idx_frame_c = 0, 0, 0
+                mask_frame = False
+            frame_data.append(
+                [
+                    idx_frame_a + atom_idx,
+                    idx_frame_b + atom_idx,
+                    idx_frame_c + atom_idx,
+                ]
+            )
+            resolved_frame_data.append(mask_frame)
+
+        # Get distogram coordinates
+        disto_coords_ensemble_tok = data.structure.coords[
+            e_offsets + token["disto_idx"]
+        ]["coords"]
+        disto_coords_ensemble.append(disto_coords_ensemble_tok)
+
+        # Update atom data. This is technically never used again (we rely on coord_data),
+        # but we update for consistency and to make sure the Atom object has valid, transformed coordinates.
+        token_atoms = token_atoms.copy()
+        token_atoms["coords"] = token_coords[
+            0
+        ]  # atom has a copy of first coords in ensemble
+        atom_data.append(token_atoms)
+        atom_name.append(token_atom_name)
+        atom_element.append(token_atoms_element)
+        atom_charge.append(token_atoms_charge)
+        atom_conformer.append(token_atoms_conformer)
+        atom_chirality.append(token_atoms_chirality)
+        atom_idx += len(token_atoms)
+
+    disto_coords_ensemble = np.array(disto_coords_ensemble)  # (N_TOK, N_ENS, 3)
+
+    # Compute ensemble distogram
+    L = len(data.tokens)
+
+    if disto_use_ensemble:
+        # Use all available structures to create distogram
+        idx_list = range(disto_coords_ensemble.shape[1])
+    else:
+        # Only use a sampled structures to create distogram
+        idx_list = ensemble_features["ensemble_ref_idxs"]
+
+    # Create distogram
+    disto_target = torch.zeros(L, L, len(idx_list), num_bins)  # TODO1
+
+    # disto_target = torch.zeros(L, L, num_bins)
+    for i, e_idx in enumerate(idx_list):
+        t_center = torch.Tensor(disto_coords_ensemble[:, e_idx, :])
+        t_dists = torch.cdist(t_center, t_center)
+        boundaries = torch.linspace(min_dist, max_dist, num_bins - 1)
+        distogram = (t_dists.unsqueeze(-1) > boundaries).sum(dim=-1).long()
+        # disto_target += one_hot(distogram, num_classes=num_bins)
+        disto_target[:, :, i, :] = one_hot(distogram, num_classes=num_bins)  # TODO1
+
+    # Normalize distogram
+    # disto_target = disto_target / disto_target.sum(-1)[..., None]  # remove TODO1
+    atom_data = np.concatenate(atom_data)
+    atom_name = np.concatenate(atom_name)
+    atom_element = np.concatenate(atom_element)
+    atom_charge = np.concatenate(atom_charge)
+    atom_conformer = np.concatenate(atom_conformer)
+    atom_chirality = np.concatenate(atom_chirality)
+    coord_data = np.concatenate(coord_data, axis=1)
+    ref_space_uid = np.array(ref_space_uid)
+
+    # Compute features
+    disto_coords_ensemble = from_numpy(disto_coords_ensemble)
+    disto_coords_ensemble = disto_coords_ensemble[
+        :, ensemble_features["ensemble_ref_idxs"]
+    ].permute(1, 0, 2)
+    backbone_feat_index = from_numpy(np.asarray(backbone_feat_index)).long()
+    ref_atom_name_chars = from_numpy(atom_name).long()
+    ref_element = from_numpy(atom_element).long()
+    ref_charge = from_numpy(atom_charge).float()
+    ref_pos = from_numpy(atom_conformer).float()
+    ref_space_uid = from_numpy(ref_space_uid)
+    ref_chirality = from_numpy(atom_chirality).long()
+    coords = from_numpy(coord_data.copy())
+    resolved_mask = from_numpy(atom_data["is_present"])
+    pad_mask = torch.ones(len(atom_data), dtype=torch.float)
+    atom_to_token = torch.tensor(atom_to_token, dtype=torch.long)
+    token_to_rep_atom = torch.tensor(token_to_rep_atom, dtype=torch.long)
+    r_set_to_rep_atom = torch.tensor(r_set_to_rep_atom, dtype=torch.long)
+    token_to_center_atom = torch.tensor(token_to_center_atom, dtype=torch.long)
+    bfactor = from_numpy(atom_data["bfactor"].copy())
+    plddt = from_numpy(atom_data["plddt"].copy())
+    if override_bfactor:
+        bfactor = bfactor * 0.0
+
+    if bfactor_md_correction and data.record.structure.method.lower() == "md":
+        # MD bfactor was computed as RMSF
+        # Convert to b-factor
+        bfactor = 8 * (np.pi**2) * (bfactor**2)
+
+    # We compute frames within ensemble
+    if compute_frames:
+        frames = []
+        frame_resolved_mask = []
+        for i in range(coord_data.shape[0]):
+            frame_data_, resolved_frame_data_ = compute_frames_nonpolymer(
+                data,
+                coord_data[i],
+                atom_data["is_present"],
+                atom_to_token,
+                frame_data,
+                resolved_frame_data,
+            )  # Compute frames for NONPOLYMER tokens
+            frames.append(frame_data_.copy())
+            frame_resolved_mask.append(resolved_frame_data_.copy())
+        frames = from_numpy(np.stack(frames))  # (N_ENS, N_TOK, 3)
+        frame_resolved_mask = from_numpy(np.stack(frame_resolved_mask))
+
+    # Convert to one-hot
+    backbone_feat_index = one_hot(
+        backbone_feat_index,
+        num_classes=1
+        + len(const.protein_backbone_atom_index)
+        + len(const.nucleic_backbone_atom_index),
+    )
+    ref_atom_name_chars = one_hot(ref_atom_name_chars, num_classes=64)
+    ref_element = one_hot(ref_element, num_classes=const.num_elements)
+    atom_to_token = one_hot(atom_to_token, num_classes=token_id + 1)
+    token_to_rep_atom = one_hot(token_to_rep_atom, num_classes=len(atom_data))
+    r_set_to_rep_atom = one_hot(r_set_to_rep_atom, num_classes=len(atom_data))
+    token_to_center_atom = one_hot(token_to_center_atom, num_classes=len(atom_data))
+
+    # Center the ground truth coordinates
+    center = (coords * resolved_mask[None, :, None]).sum(dim=1)
+    center = center / resolved_mask.sum().clamp(min=1)
+    coords = coords - center[:, None]
+
+    if isinstance(override_coords, Tensor):
+        coords = override_coords.unsqueeze(0)
+
+    # Apply random roto-translation to the input conformers
+    for i in range(torch.max(ref_space_uid)):
+        included = ref_space_uid == i
+        if torch.sum(included) > 0 and torch.any(resolved_mask[included]):
+            ref_pos[included] = center_random_augmentation(
+                ref_pos[included][None], resolved_mask[included][None], centering=True
+            )[0]
+
+    # Compute padding and apply
+    if max_atoms is not None:
+        assert max_atoms % atoms_per_window_queries == 0
+        pad_len = max_atoms - len(atom_data)
+    else:
+        pad_len = (
+            (len(atom_data) - 1) // atoms_per_window_queries + 1
+        ) * atoms_per_window_queries - len(atom_data)
+
+    if pad_len > 0:
+        pad_mask = pad_dim(pad_mask, 0, pad_len)
+        ref_pos = pad_dim(ref_pos, 0, pad_len)
+        resolved_mask = pad_dim(resolved_mask, 0, pad_len)
+        ref_atom_name_chars = pad_dim(ref_atom_name_chars, 0, pad_len)
+        ref_element = pad_dim(ref_element, 0, pad_len)
+        ref_charge = pad_dim(ref_charge, 0, pad_len)
+        ref_chirality = pad_dim(ref_chirality, 0, pad_len)
+        backbone_feat_index = pad_dim(backbone_feat_index, 0, pad_len)
+        ref_space_uid = pad_dim(ref_space_uid, 0, pad_len)
+        coords = pad_dim(coords, 1, pad_len)
+        atom_to_token = pad_dim(atom_to_token, 0, pad_len)
+        token_to_rep_atom = pad_dim(token_to_rep_atom, 1, pad_len)
+        token_to_center_atom = pad_dim(token_to_center_atom, 1, pad_len)
+        r_set_to_rep_atom = pad_dim(r_set_to_rep_atom, 1, pad_len)
+        bfactor = pad_dim(bfactor, 0, pad_len)
+        plddt = pad_dim(plddt, 0, pad_len)
+
+    if max_tokens is not None:
+        pad_len = max_tokens - token_to_rep_atom.shape[0]
+        if pad_len > 0:
+            atom_to_token = pad_dim(atom_to_token, 1, pad_len)
+            token_to_rep_atom = pad_dim(token_to_rep_atom, 0, pad_len)
+            r_set_to_rep_atom = pad_dim(r_set_to_rep_atom, 0, pad_len)
+            token_to_center_atom = pad_dim(token_to_center_atom, 0, pad_len)
+            disto_target = pad_dim(pad_dim(disto_target, 0, pad_len), 1, pad_len)
+            disto_coords_ensemble = pad_dim(disto_coords_ensemble, 1, pad_len)
+
+            if compute_frames:
+                frames = pad_dim(frames, 1, pad_len)
+                frame_resolved_mask = pad_dim(frame_resolved_mask, 1, pad_len)
+
+    atom_features = {
+        "ref_pos": ref_pos,
+        "atom_resolved_mask": resolved_mask,
+        "ref_atom_name_chars": ref_atom_name_chars,
+        "ref_element": ref_element,
+        "ref_charge": ref_charge,
+        "ref_chirality": ref_chirality,
+        "atom_backbone_feat": backbone_feat_index,
+        "ref_space_uid": ref_space_uid,
+        "coords": coords,
+        "atom_pad_mask": pad_mask,
+        "atom_to_token": atom_to_token,
+        "token_to_rep_atom": token_to_rep_atom,
+        "r_set_to_rep_atom": r_set_to_rep_atom,
+        "token_to_center_atom": token_to_center_atom,
+        "disto_target": disto_target,
+        "disto_coords_ensemble": disto_coords_ensemble,
+        "bfactor": bfactor,
+        "plddt": plddt,
+    }
+
+    if compute_frames:
+        atom_features["frames_idx"] = frames
+        atom_features["frame_resolved_mask"] = frame_resolved_mask
+
+    return atom_features
+
+
+def process_msa_features(
+    data: Tokenized,
+    random: np.random.Generator,
+    max_seqs_batch: int,
+    max_seqs: int,
+    max_tokens: Optional[int] = None,
+    pad_to_max_seqs: bool = False,
+    msa_sampling: bool = False,
+    affinity: bool = False,
+) -> dict[str, Tensor]:
+    """Get the MSA features.
+
+    Parameters
+    ----------
+    data : Tokenized
+        The input to the model.
+    random : np.random.Generator
+        The random number generator.
+    max_seqs : int
+        The maximum number of MSA sequences.
+    max_tokens : int
+        The maximum number of tokens.
+    pad_to_max_seqs : bool
+        Whether to pad to the maximum number of sequences.
+    msa_sampling : bool
+        Whether to sample the MSA.
+
+    Returns
+    -------
+    dict[str, Tensor]
+        The MSA features.
+
+    """
+    # Created paired MSA
+    msa, deletion, paired = construct_paired_msa(
+        data=data,
+        random=random,
+        max_seqs=max_seqs_batch,
+        random_subset=msa_sampling,
+    )
+    msa, deletion, paired = (
+        msa.transpose(1, 0),
+        deletion.transpose(1, 0),
+        paired.transpose(1, 0),
+    )  # (N_MSA, N_RES, N_AA)
+
+    # Prepare features
+    assert torch.all(msa >= 0) and torch.all(msa < const.num_tokens)
+    msa_one_hot = torch.nn.functional.one_hot(msa, num_classes=const.num_tokens)
+    msa_mask = torch.ones_like(msa)
+    profile = msa_one_hot.float().mean(dim=0)
+    has_deletion = deletion > 0
+    deletion = np.pi / 2 * np.arctan(deletion / 3)
+    deletion_mean = deletion.mean(axis=0)
+
+    # Pad in the MSA dimension (dim=0)
+    if pad_to_max_seqs:
+        pad_len = max_seqs - msa.shape[0]
+        if pad_len > 0:
+            msa = pad_dim(msa, 0, pad_len, const.token_ids["-"])
+            paired = pad_dim(paired, 0, pad_len)
+            msa_mask = pad_dim(msa_mask, 0, pad_len)
+            has_deletion = pad_dim(has_deletion, 0, pad_len)
+            deletion = pad_dim(deletion, 0, pad_len)
+
+    # Pad in the token dimension (dim=1)
+    if max_tokens is not None:
+        pad_len = max_tokens - msa.shape[1]
+        if pad_len > 0:
+            msa = pad_dim(msa, 1, pad_len, const.token_ids["-"])
+            paired = pad_dim(paired, 1, pad_len)
+            msa_mask = pad_dim(msa_mask, 1, pad_len)
+            has_deletion = pad_dim(has_deletion, 1, pad_len)
+            deletion = pad_dim(deletion, 1, pad_len)
+            profile = pad_dim(profile, 0, pad_len)
+            deletion_mean = pad_dim(deletion_mean, 0, pad_len)
+    if affinity:
+        return {
+            "deletion_mean_affinity": deletion_mean,
+            "profile_affinity": profile,
+        }
+    else:
+        return {
+            "msa": msa,
+            "msa_paired": paired,
+            "deletion_value": deletion,
+            "has_deletion": has_deletion,
+            "deletion_mean": deletion_mean,
+            "profile": profile,
+            "msa_mask": msa_mask,
+        }
+
+
+def load_dummy_templates_features(tdim: int, num_tokens: int) -> dict:
+    """Load dummy templates for v2."""
+    # Allocate features
+    res_type = np.zeros((tdim, num_tokens), dtype=np.int64)
+    frame_rot = np.zeros((tdim, num_tokens, 3, 3), dtype=np.float32)
+    frame_t = np.zeros((tdim, num_tokens, 3), dtype=np.float32)
+    cb_coords = np.zeros((tdim, num_tokens, 3), dtype=np.float32)
+    ca_coords = np.zeros((tdim, num_tokens, 3), dtype=np.float32)
+    frame_mask = np.zeros((tdim, num_tokens), dtype=np.float32)
+    cb_mask = np.zeros((tdim, num_tokens), dtype=np.float32)
+    template_mask = np.zeros((tdim, num_tokens), dtype=np.float32)
+    query_to_template = np.zeros((tdim, num_tokens), dtype=np.int64)
+    visibility_ids = np.zeros((tdim, num_tokens), dtype=np.float32)
+
+    # Convert to one-hot
+    res_type = torch.from_numpy(res_type)
+    res_type = one_hot(res_type, num_classes=const.num_tokens)
+
+    return {
+        "template_restype": res_type,
+        "template_frame_rot": torch.from_numpy(frame_rot),
+        "template_frame_t": torch.from_numpy(frame_t),
+        "template_cb": torch.from_numpy(cb_coords),
+        "template_ca": torch.from_numpy(ca_coords),
+        "template_mask_cb": torch.from_numpy(cb_mask),
+        "template_mask_frame": torch.from_numpy(frame_mask),
+        "template_mask": torch.from_numpy(template_mask),
+        "query_to_template": torch.from_numpy(query_to_template),
+        "visibility_ids": torch.from_numpy(visibility_ids),
+    }
+
+
+def compute_template_features(
+    query_tokens: Tokenized,
+    tmpl_tokens: list[dict],
+    num_tokens: int,
+) -> dict:
+    """Compute the template features."""
+    # Allocate features
+    res_type = np.zeros((num_tokens,), dtype=np.int64)
+    frame_rot = np.zeros((num_tokens, 3, 3), dtype=np.float32)
+    frame_t = np.zeros((num_tokens, 3), dtype=np.float32)
+    cb_coords = np.zeros((num_tokens, 3), dtype=np.float32)
+    ca_coords = np.zeros((num_tokens, 3), dtype=np.float32)
+    frame_mask = np.zeros((num_tokens,), dtype=np.float32)
+    cb_mask = np.zeros((num_tokens,), dtype=np.float32)
+    template_mask = np.zeros((num_tokens,), dtype=np.float32)
+    query_to_template = np.zeros((num_tokens,), dtype=np.int64)
+    visibility_ids = np.zeros((num_tokens,), dtype=np.float32)
+
+    # Now create features per token
+    asym_id_to_pdb_id = {}
+
+    for token_dict in tmpl_tokens:
+        idx = token_dict["q_idx"]
+        pdb_id = token_dict["pdb_id"]
+        token = token_dict["token"]
+        query_token = query_tokens.tokens[idx]
+        asym_id_to_pdb_id[query_token["asym_id"]] = pdb_id
+        res_type[idx] = token["res_type"]
+        frame_rot[idx] = token["frame_rot"].reshape(3, 3)
+        frame_t[idx] = token["frame_t"]
+        cb_coords[idx] = token["disto_coords"]
+        ca_coords[idx] = token["center_coords"]
+        cb_mask[idx] = token["disto_mask"]
+        frame_mask[idx] = token["frame_mask"]
+        template_mask[idx] = 1.0
+
+    # Set visibility_id for templated chains
+    for asym_id, pdb_id in asym_id_to_pdb_id.items():
+        indices = (query_tokens.tokens["asym_id"] == asym_id).nonzero()
+        visibility_ids[indices] = pdb_id
+
+    # Set visibility for non templated chain + olygomerics
+    for asym_id in np.unique(query_tokens.structure.chains["asym_id"]):
+        if asym_id not in asym_id_to_pdb_id:
+            # We hack the chain id to be negative to not overlap with the above
+            indices = (query_tokens.tokens["asym_id"] == asym_id).nonzero()
+            visibility_ids[indices] = -1 - asym_id
+
+    # Convert to one-hot
+    res_type = torch.from_numpy(res_type)
+    res_type = one_hot(res_type, num_classes=const.num_tokens)
+
+    return {
+        "template_restype": res_type,
+        "template_frame_rot": torch.from_numpy(frame_rot),
+        "template_frame_t": torch.from_numpy(frame_t),
+        "template_cb": torch.from_numpy(cb_coords),
+        "template_ca": torch.from_numpy(ca_coords),
+        "template_mask_cb": torch.from_numpy(cb_mask),
+        "template_mask_frame": torch.from_numpy(frame_mask),
+        "template_mask": torch.from_numpy(template_mask),
+        "query_to_template": torch.from_numpy(query_to_template),
+        "visibility_ids": torch.from_numpy(visibility_ids),
+    }
+
+
+def process_template_features(
+    data: Tokenized,
+    max_tokens: int,
+) -> dict[str, torch.Tensor]:
+    """Load the given input data.
+
+    Parameters
+    ----------
+    data : Tokenized
+        The input to the model.
+    max_tokens : int
+        The maximum number of tokens.
+
+    Returns
+    -------
+    dict[str, torch.Tensor]
+        The loaded template features.
+
+    """
+    # Group templates by name
+    name_to_templates: dict[str, list[TemplateInfo]] = {}
+    for template_info in data.record.templates:
+        name_to_templates.setdefault(template_info.name, []).append(template_info)
+
+    # Map chain name to asym_id
+    chain_name_to_asym_id = {}
+    for chain in data.structure.chains:
+        chain_name_to_asym_id[chain["name"]] = chain["asym_id"]
+
+    # Compute the offset
+    template_features = []
+    for template_id, (template_name, templates) in enumerate(name_to_templates.items()):
+        row_tokens = []
+        template_structure = data.templates[template_name]
+        template_tokens = data.template_tokens[template_name]
+        tmpl_chain_name_to_asym_id = {}
+        for chain in template_structure.chains:
+            tmpl_chain_name_to_asym_id[chain["name"]] = chain["asym_id"]
+
+        for template in templates:
+            offset = template.template_st - template.query_st
+
+            # Get query and template tokens to map residues
+            query_tokens = data.tokens
+            chain_id = chain_name_to_asym_id[template.query_chain]
+            q_tokens = query_tokens[query_tokens["asym_id"] == chain_id]
+            q_indices = dict(zip(q_tokens["res_idx"], q_tokens["token_idx"]))
+
+            # Get the template tokens at the query residues
+            chain_id = tmpl_chain_name_to_asym_id[template.template_chain]
+            toks = template_tokens[template_tokens["asym_id"] == chain_id]
+            toks = [t for t in toks if t["res_idx"] - offset in q_indices]
+            for t in toks:
+                q_idx = q_indices[t["res_idx"] - offset]
+                row_tokens.append(
+                    {
+                        "token": t,
+                        "pdb_id": template_id,
+                        "q_idx": q_idx,
+                    }
+                )
+
+        # Compute template features for each row
+        row_features = compute_template_features(data, row_tokens, max_tokens)
+        row_features["template_force"] = torch.tensor(template.force)
+        row_features["template_force_threshold"] = torch.tensor(
+            template.threshold if template.threshold is not None else float("inf"),
+            dtype=torch.float32,
+        )
+        template_features.append(row_features)
+
+    # Stack each feature
+    out = {}
+    for k in template_features[0]:
+        out[k] = torch.stack([f[k] for f in template_features])
+    return out
+
+
+def process_symmetry_features(
+    cropped: Tokenized, symmetries: dict
+) -> dict[str, Tensor]:
+    """Get the symmetry features.
+
+    Parameters
+    ----------
+    data : Tokenized
+        The input to the model.
+
+    Returns
+    -------
+    dict[str, Tensor]
+        The symmetry features.
+
+    """
+    features = get_chain_symmetries(cropped)
+    features.update(get_amino_acids_symmetries(cropped))
+    features.update(get_ligand_symmetries(cropped, symmetries))
+
+    return features
+
+
+def process_ensemble_features(
+    data: Tokenized,
+    random: np.random.Generator,
+    num_ensembles: int,
+    ensemble_sample_replacement: bool,
+    fix_single_ensemble: bool,
+) -> dict[str, Tensor]:
+    """Get the ensemble features.
+
+    Parameters
+    ----------
+    data : Tokenized
+        The input to the model.
+    random : np.random.Generator
+        The random number generator.
+    num_ensembles : int
+        The maximum number of ensembles to sample.
+    ensemble_sample_replacement : bool
+        Whether to sample with replacement.
+
+    Returns
+    -------
+    dict[str, Tensor]
+        The ensemble features.
+
+    """
+    assert num_ensembles > 0, "Number of conformers sampled must be greater than 0."
+
+    # Number of available conformers in the structure
+    # s_ensemble_num = min(len(cropped.structure.ensemble), 24)  # Limit to 24 conformers DEBUG: TODO: remove !
+    s_ensemble_num = len(data.structure.ensemble)
+
+    if fix_single_ensemble:
+        # Always take the first conformer for train and validation
+        assert num_ensembles == 1, (
+            "Number of conformers sampled must be 1 with fix_single_ensemble=True."
+        )
+        ensemble_ref_idxs = np.array([0])
+    else:
+        if ensemble_sample_replacement:
+            # Used in training
+            ensemble_ref_idxs = random.integers(0, s_ensemble_num, (num_ensembles,))
+        else:
+            # Used in validation
+            if s_ensemble_num < num_ensembles:
+                # Take all available conformers
+                ensemble_ref_idxs = np.arange(0, s_ensemble_num)
+            else:
+                # Sample without replacement
+                ensemble_ref_idxs = random.choice(
+                    s_ensemble_num, num_ensembles, replace=False
+                )
+
+    ensemble_features = {
+        "ensemble_ref_idxs": torch.Tensor(ensemble_ref_idxs).long(),
+    }
+
+    return ensemble_features
+
+
+def process_residue_constraint_features(data: Tokenized) -> dict[str, Tensor]:
+    residue_constraints = data.residue_constraints
+    if residue_constraints is not None:
+        rdkit_bounds_constraints = residue_constraints.rdkit_bounds_constraints
+        chiral_atom_constraints = residue_constraints.chiral_atom_constraints
+        stereo_bond_constraints = residue_constraints.stereo_bond_constraints
+        planar_bond_constraints = residue_constraints.planar_bond_constraints
+        planar_ring_5_constraints = residue_constraints.planar_ring_5_constraints
+        planar_ring_6_constraints = residue_constraints.planar_ring_6_constraints
+
+        rdkit_bounds_index = torch.tensor(
+            rdkit_bounds_constraints["atom_idxs"].copy(), dtype=torch.long
+        ).T
+        rdkit_bounds_bond_mask = torch.tensor(
+            rdkit_bounds_constraints["is_bond"].copy(), dtype=torch.bool
+        )
+        rdkit_bounds_angle_mask = torch.tensor(
+            rdkit_bounds_constraints["is_angle"].copy(), dtype=torch.bool
+        )
+        rdkit_upper_bounds = torch.tensor(
+            rdkit_bounds_constraints["upper_bound"].copy(), dtype=torch.float
+        )
+        rdkit_lower_bounds = torch.tensor(
+            rdkit_bounds_constraints["lower_bound"].copy(), dtype=torch.float
+        )
+
+        chiral_atom_index = torch.tensor(
+            chiral_atom_constraints["atom_idxs"].copy(), dtype=torch.long
+        ).T
+        chiral_reference_mask = torch.tensor(
+            chiral_atom_constraints["is_reference"].copy(), dtype=torch.bool
+        )
+        chiral_atom_orientations = torch.tensor(
+            chiral_atom_constraints["is_r"].copy(), dtype=torch.bool
+        )
+
+        stereo_bond_index = torch.tensor(
+            stereo_bond_constraints["atom_idxs"].copy(), dtype=torch.long
+        ).T
+        stereo_reference_mask = torch.tensor(
+            stereo_bond_constraints["is_reference"].copy(), dtype=torch.bool
+        )
+        stereo_bond_orientations = torch.tensor(
+            stereo_bond_constraints["is_e"].copy(), dtype=torch.bool
+        )
+
+        planar_bond_index = torch.tensor(
+            planar_bond_constraints["atom_idxs"].copy(), dtype=torch.long
+        ).T
+        planar_ring_5_index = torch.tensor(
+            planar_ring_5_constraints["atom_idxs"].copy(), dtype=torch.long
+        ).T
+        planar_ring_6_index = torch.tensor(
+            planar_ring_6_constraints["atom_idxs"].copy(), dtype=torch.long
+        ).T
+    else:
+        rdkit_bounds_index = torch.empty((2, 0), dtype=torch.long)
+        rdkit_bounds_bond_mask = torch.empty((0,), dtype=torch.bool)
+        rdkit_bounds_angle_mask = torch.empty((0,), dtype=torch.bool)
+        rdkit_upper_bounds = torch.empty((0,), dtype=torch.float)
+        rdkit_lower_bounds = torch.empty((0,), dtype=torch.float)
+        chiral_atom_index = torch.empty(
+            (
+                4,
+                0,
+            ),
+            dtype=torch.long,
+        )
+        chiral_reference_mask = torch.empty((0,), dtype=torch.bool)
+        chiral_atom_orientations = torch.empty((0,), dtype=torch.bool)
+        stereo_bond_index = torch.empty((4, 0), dtype=torch.long)
+        stereo_reference_mask = torch.empty((0,), dtype=torch.bool)
+        stereo_bond_orientations = torch.empty((0,), dtype=torch.bool)
+        planar_bond_index = torch.empty((6, 0), dtype=torch.long)
+        planar_ring_5_index = torch.empty((5, 0), dtype=torch.long)
+        planar_ring_6_index = torch.empty((6, 0), dtype=torch.long)
+
+    return {
+        "rdkit_bounds_index": rdkit_bounds_index,
+        "rdkit_bounds_bond_mask": rdkit_bounds_bond_mask,
+        "rdkit_bounds_angle_mask": rdkit_bounds_angle_mask,
+        "rdkit_upper_bounds": rdkit_upper_bounds,
+        "rdkit_lower_bounds": rdkit_lower_bounds,
+        "chiral_atom_index": chiral_atom_index,
+        "chiral_reference_mask": chiral_reference_mask,
+        "chiral_atom_orientations": chiral_atom_orientations,
+        "stereo_bond_index": stereo_bond_index,
+        "stereo_reference_mask": stereo_reference_mask,
+        "stereo_bond_orientations": stereo_bond_orientations,
+        "planar_bond_index": planar_bond_index,
+        "planar_ring_5_index": planar_ring_5_index,
+        "planar_ring_6_index": planar_ring_6_index,
+    }
+
+
+def process_chain_feature_constraints(data: Tokenized) -> dict[str, Tensor]:
+    structure = data.structure
+    if structure.bonds.shape[0] > 0:
+        connected_chain_index, connected_atom_index = [], []
+        for connection in structure.bonds:
+            if connection["chain_1"] == connection["chain_2"]:
+                continue
+            connected_chain_index.append([connection["chain_1"], connection["chain_2"]])
+            connected_atom_index.append([connection["atom_1"], connection["atom_2"]])
+        if len(connected_chain_index) > 0:
+            connected_chain_index = torch.tensor(
+                connected_chain_index, dtype=torch.long
+            ).T
+            connected_atom_index = torch.tensor(
+                connected_atom_index, dtype=torch.long
+            ).T
+        else:
+            connected_chain_index = torch.empty((2, 0), dtype=torch.long)
+            connected_atom_index = torch.empty((2, 0), dtype=torch.long)
+    else:
+        connected_chain_index = torch.empty((2, 0), dtype=torch.long)
+        connected_atom_index = torch.empty((2, 0), dtype=torch.long)
+
+    symmetric_chain_index = []
+    for i, chain_i in enumerate(structure.chains):
+        for j, chain_j in enumerate(structure.chains):
+            if j <= i:
+                continue
+            if chain_i["entity_id"] == chain_j["entity_id"]:
+                symmetric_chain_index.append([i, j])
+    if len(symmetric_chain_index) > 0:
+        symmetric_chain_index = torch.tensor(symmetric_chain_index, dtype=torch.long).T
+    else:
+        symmetric_chain_index = torch.empty((2, 0), dtype=torch.long)
+    return {
+        "connected_chain_index": connected_chain_index,
+        "connected_atom_index": connected_atom_index,
+        "symmetric_chain_index": symmetric_chain_index,
+    }
+
+
+def process_contact_feature_constraints(
+    data: Tokenized,
+    inference_pocket_constraints: list[tuple[int, list[tuple[int, int]], float]],
+    inference_contact_constraints: list[tuple[tuple[int, int], tuple[int, int], float]],
+):
+    token_data = data.tokens
+    union_idx = 0
+    pair_index, union_index, negation_mask, thresholds = [], [], [], []
+    for binder, contacts, max_distance, force in inference_pocket_constraints:
+        if not force:
+            continue
+
+        binder_chain = data.structure.chains[binder]
+        for token in token_data:
+            if (
+                token["mol_type"] != const.chain_type_ids["NONPOLYMER"]
+                and (token["asym_id"], token["res_idx"]) in contacts
+            ) or (
+                token["mol_type"] == const.chain_type_ids["NONPOLYMER"]
+                and (token["asym_id"], token["atom_idx"]) in contacts
+            ):
+                atom_idx_pairs = torch.cartesian_prod(
+                    torch.arange(
+                        binder_chain["atom_idx"],
+                        binder_chain["atom_idx"] + binder_chain["atom_num"],
+                    ),
+                    torch.arange(
+                        token["atom_idx"], token["atom_idx"] + token["atom_num"]
+                    ),
+                ).T
+                pair_index.append(atom_idx_pairs)
+                union_index.append(torch.full((atom_idx_pairs.shape[1],), union_idx))
+                negation_mask.append(
+                    torch.ones((atom_idx_pairs.shape[1],), dtype=torch.bool)
+                )
+                thresholds.append(torch.full((atom_idx_pairs.shape[1],), max_distance))
+                union_idx += 1
+
+    for token1, token2, max_distance, force in inference_contact_constraints:
+        if not force:
+            continue
+
+        for idx1, _token1 in enumerate(token_data):
+            if (
+                _token1["mol_type"] != const.chain_type_ids["NONPOLYMER"]
+                and (_token1["asym_id"], _token1["res_idx"]) == token1
+            ) or (
+                _token1["mol_type"] == const.chain_type_ids["NONPOLYMER"]
+                and (_token1["asym_id"], _token1["atom_idx"]) == token1
+            ):
+                for idx2, _token2 in enumerate(token_data):
+                    if (
+                        _token2["mol_type"] != const.chain_type_ids["NONPOLYMER"]
+                        and (_token2["asym_id"], _token2["res_idx"]) == token2
+                    ) or (
+                        _token2["mol_type"] == const.chain_type_ids["NONPOLYMER"]
+                        and (_token2["asym_id"], _token2["atom_idx"]) == token2
+                    ):
+                        atom_idx_pairs = torch.cartesian_prod(
+                            torch.arange(
+                                _token1["atom_idx"],
+                                _token1["atom_idx"] + _token1["atom_num"],
+                            ),
+                            torch.arange(
+                                _token2["atom_idx"],
+                                _token2["atom_idx"] + _token2["atom_num"],
+                            ),
+                        ).T
+                        pair_index.append(atom_idx_pairs)
+                        union_index.append(
+                            torch.full((atom_idx_pairs.shape[1],), union_idx)
+                        )
+                        negation_mask.append(
+                            torch.ones((atom_idx_pairs.shape[1],), dtype=torch.bool)
+                        )
+                        thresholds.append(
+                            torch.full((atom_idx_pairs.shape[1],), max_distance)
+                        )
+                        union_idx += 1
+                        break
+                break
+
+    if len(pair_index) > 0:
+        pair_index = torch.cat(pair_index, dim=1)
+        union_index = torch.cat(union_index)
+        negation_mask = torch.cat(negation_mask)
+        thresholds = torch.cat(thresholds)
+    else:
+        pair_index = torch.empty((2, 0), dtype=torch.long)
+        union_index = torch.empty((0,), dtype=torch.long)
+        negation_mask = torch.empty((0,), dtype=torch.bool)
+        thresholds = torch.empty((0,), dtype=torch.float32)
+
+    return {
+        "contact_pair_index": pair_index,
+        "contact_union_index": union_index,
+        "contact_negation_mask": negation_mask,
+        "contact_thresholds": thresholds,
+    }
+
+
+class Boltz2Featurizer:
+    """Boltz2 featurizer."""
+
+    def process(
+        self,
+        data: Tokenized,
+        random: np.random.Generator,
+        molecules: dict[str, Mol],
+        training: bool,
+        max_seqs: int,
+        atoms_per_window_queries: int = 32,
+        min_dist: float = 2.0,
+        max_dist: float = 22.0,
+        num_bins: int = 64,
+        num_ensembles: int = 1,
+        ensemble_sample_replacement: bool = False,
+        disto_use_ensemble: Optional[bool] = False,
+        fix_single_ensemble: Optional[bool] = True,
+        max_tokens: Optional[int] = None,
+        max_atoms: Optional[int] = None,
+        pad_to_max_seqs: bool = False,
+        compute_symmetries: bool = False,
+        binder_pocket_conditioned_prop: Optional[float] = 0.0,
+        contact_conditioned_prop: Optional[float] = 0.0,
+        binder_pocket_cutoff_min: Optional[float] = 4.0,
+        binder_pocket_cutoff_max: Optional[float] = 20.0,
+        binder_pocket_sampling_geometric_p: Optional[float] = 0.0,
+        only_ligand_binder_pocket: Optional[bool] = False,
+        only_pp_contact: Optional[bool] = False,
+        single_sequence_prop: Optional[float] = 0.0,
+        msa_sampling: bool = False,
+        override_bfactor: float = False,
+        override_method: Optional[str] = None,
+        compute_frames: bool = False,
+        override_coords: Optional[Tensor] = None,
+        bfactor_md_correction: bool = False,
+        compute_constraint_features: bool = False,
+        inference_pocket_constraints: Optional[
+            list[tuple[int, list[tuple[int, int]], float]]
+        ] = None,
+        inference_contact_constraints: Optional[
+            list[tuple[tuple[int, int], tuple[int, int], float]]
+        ] = None,
+        compute_affinity: bool = False,
+    ) -> dict[str, Tensor]:
+        """Compute features.
+
+        Parameters
+        ----------
+        data : Tokenized
+            The input to the model.
+        training : bool
+            Whether the model is in training mode.
+        max_tokens : int, optional
+            The maximum number of tokens.
+        max_atoms : int, optional
+            The maximum number of atoms
+        max_seqs : int, optional
+            The maximum number of sequences.
+
+        Returns
+        -------
+        dict[str, Tensor]
+            The features for model training.
+
+        """
+        # Compute random number of sequences
+        if training and max_seqs is not None:
+            if random.random() > single_sequence_prop:
+                max_seqs_batch = random.integers(1, max_seqs + 1)
+            else:
+                max_seqs_batch = 1
+        else:
+            max_seqs_batch = max_seqs
+
+        # Compute ensemble features
+        ensemble_features = process_ensemble_features(
+            data=data,
+            random=random,
+            num_ensembles=num_ensembles,
+            ensemble_sample_replacement=ensemble_sample_replacement,
+            fix_single_ensemble=fix_single_ensemble,
+        )
+
+        # Compute token features
+        token_features = process_token_features(
+            data=data,
+            random=random,
+            max_tokens=max_tokens,
+            binder_pocket_conditioned_prop=binder_pocket_conditioned_prop,
+            contact_conditioned_prop=contact_conditioned_prop,
+            binder_pocket_cutoff_min=binder_pocket_cutoff_min,
+            binder_pocket_cutoff_max=binder_pocket_cutoff_max,
+            binder_pocket_sampling_geometric_p=binder_pocket_sampling_geometric_p,
+            only_ligand_binder_pocket=only_ligand_binder_pocket,
+            only_pp_contact=only_pp_contact,
+            override_method=override_method,
+            inference_pocket_constraints=inference_pocket_constraints,
+            inference_contact_constraints=inference_contact_constraints,
+        )
+
+        # Compute atom features
+        atom_features = process_atom_features(
+            data=data,
+            random=random,
+            molecules=molecules,
+            ensemble_features=ensemble_features,
+            atoms_per_window_queries=atoms_per_window_queries,
+            min_dist=min_dist,
+            max_dist=max_dist,
+            num_bins=num_bins,
+            max_atoms=max_atoms,
+            max_tokens=max_tokens,
+            disto_use_ensemble=disto_use_ensemble,
+            override_bfactor=override_bfactor,
+            compute_frames=compute_frames,
+            override_coords=override_coords,
+            bfactor_md_correction=bfactor_md_correction,
+        )
+
+        # Compute MSA features
+        msa_features = process_msa_features(
+            data=data,
+            random=random,
+            max_seqs_batch=max_seqs_batch,
+            max_seqs=max_seqs,
+            max_tokens=max_tokens,
+            pad_to_max_seqs=pad_to_max_seqs,
+            msa_sampling=training and msa_sampling,
+        )
+
+        # Compute MSA features
+        msa_features_affinity = {}
+        if compute_affinity:
+            msa_features_affinity = process_msa_features(
+                data=data,
+                random=random,
+                max_seqs_batch=1,
+                max_seqs=1,
+                max_tokens=max_tokens,
+                pad_to_max_seqs=pad_to_max_seqs,
+                msa_sampling=training and msa_sampling,
+                affinity=True,
+            )
+
+        # Compute affinity ligand Molecular Weight
+        ligand_to_mw = {}
+        if compute_affinity:
+            ligand_to_mw["affinity_mw"] = data.record.affinity.mw
+
+        # Compute template features
+        num_tokens = data.tokens.shape[0] if max_tokens is None else max_tokens
+        if data.templates:
+            template_features = process_template_features(
+                data=data,
+                max_tokens=num_tokens,
+            )
+        else:
+            template_features = load_dummy_templates_features(
+                tdim=1,
+                num_tokens=num_tokens,
+            )
+
+        # Compute symmetry features
+        symmetry_features = {}
+        if compute_symmetries:
+            symmetries = get_symmetries(molecules)
+            symmetry_features = process_symmetry_features(data, symmetries)
+
+        # Compute constraint features
+        residue_constraint_features = {}
+        chain_constraint_features = {}
+        contact_constraint_features = {}
+        if compute_constraint_features:
+            residue_constraint_features = process_residue_constraint_features(data)
+            chain_constraint_features = process_chain_feature_constraints(data)
+            contact_constraint_features = process_contact_feature_constraints(
+                data=data,
+                inference_pocket_constraints=inference_pocket_constraints if inference_pocket_constraints else [],
+                inference_contact_constraints=inference_contact_constraints if inference_contact_constraints else [],
+            )
+
+        return {
+            **token_features,
+            **atom_features,
+            **msa_features,
+            **msa_features_affinity,
+            **template_features,
+            **symmetry_features,
+            **ensemble_features,
+            **residue_constraint_features,
+            **chain_constraint_features,
+            **contact_constraint_features,
+            **ligand_to_mw,
+        }
diff --git a/forks/boltz/src/boltz/data/feature/symmetry.py b/forks/boltz/src/boltz/data/feature/symmetry.py
new file mode 100644
index 00000000..abde5977
--- /dev/null
+++ b/forks/boltz/src/boltz/data/feature/symmetry.py
@@ -0,0 +1,602 @@
+import itertools
+import pickle
+import random
+from pathlib import Path
+
+import numpy as np
+import torch
+
+from boltz.data import const
+from boltz.data.pad import pad_dim
+from boltz.model.loss.confidence import lddt_dist
+from boltz.model.loss.validation import weighted_minimum_rmsd_single
+
+
+def convert_atom_name(name: str) -> tuple[int, int, int, int]:
+    """Convert an atom name to a standard format.
+
+    Parameters
+    ----------
+    name : str
+        The atom name.
+
+    Returns
+    -------
+    Tuple[int, int, int, int]
+        The converted atom name.
+
+    """
+    name = name.strip()
+    name = [ord(c) - 32 for c in name]
+    name = name + [0] * (4 - len(name))
+    return tuple(name)
+
+
+def get_symmetries(path: str) -> dict:
+    """Create a dictionary for the ligand symmetries.
+
+    Parameters
+    ----------
+    path : str
+        The path to the ligand symmetries.
+
+    Returns
+    -------
+    dict
+        The ligand symmetries.
+
+    """
+    with Path(path).open("rb") as f:
+        data: dict = pickle.load(f)  # noqa: S301
+
+    symmetries = {}
+    for key, mol in data.items():
+        try:
+            serialized_sym = bytes.fromhex(mol.GetProp("symmetries"))
+            sym = pickle.loads(serialized_sym)  # noqa: S301
+            atom_names = []
+            for atom in mol.GetAtoms():
+                # Get atom name
+                atom_name = convert_atom_name(atom.GetProp("name"))
+                atom_names.append(atom_name)
+
+            symmetries[key] = (sym, atom_names)
+        except Exception:  # noqa: BLE001, PERF203, S110
+            pass
+
+    return symmetries
+
+
+def compute_symmetry_idx_dictionary(data):
+    # Compute the symmetry index dictionary
+    total_count = 0
+    all_coords = []
+    for i, chain in enumerate(data.chains):
+        chain.start_idx = total_count
+        for j, token in enumerate(chain.tokens):
+            token.start_idx = total_count - chain.start_idx
+            all_coords.extend(
+                [[atom.coords.x, atom.coords.y, atom.coords.z] for atom in token.atoms]
+            )
+            total_count += len(token.atoms)
+    return all_coords
+
+
+def get_current_idx_list(data):
+    idx = []
+    for chain in data.chains:
+        if chain.in_crop:
+            for token in chain.tokens:
+                if token.in_crop:
+                    idx.extend(
+                        [
+                            chain.start_idx + token.start_idx + i
+                            for i in range(len(token.atoms))
+                        ]
+                    )
+    return idx
+
+
+def all_different_after_swap(l):
+    final = [s[-1] for s in l]
+    return len(final) == len(set(final))
+
+
+def minimum_symmetry_coords(
+    coords: torch.Tensor,
+    feats: dict,
+    index_batch: int,
+    **args_rmsd,
+):
+    all_coords = feats["all_coords"][index_batch].unsqueeze(0).to(coords)
+    all_resolved_mask = (
+        feats["all_resolved_mask"][index_batch].to(coords).to(torch.bool)
+    )
+    crop_to_all_atom_map = (
+        feats["crop_to_all_atom_map"][index_batch].to(coords).to(torch.long)
+    )
+    chain_symmetries = feats["chain_symmetries"][index_batch]
+    amino_acids_symmetries = feats["amino_acids_symmetries"][index_batch]
+    ligand_symmetries = feats["ligand_symmetries"][index_batch]
+
+    # Check best symmetry on chain swap
+    best_true_coords = None
+    best_rmsd = float("inf")
+    best_align_weights = None
+    for c in chain_symmetries:
+        true_all_coords = all_coords.clone()
+        true_all_resolved_mask = all_resolved_mask.clone()
+        for start1, end1, start2, end2, chainidx1, chainidx2 in c:
+            true_all_coords[:, start1:end1] = all_coords[:, start2:end2]
+            true_all_resolved_mask[start1:end1] = all_resolved_mask[start2:end2]
+        true_coords = true_all_coords[:, crop_to_all_atom_map]
+        true_resolved_mask = true_all_resolved_mask[crop_to_all_atom_map]
+        true_coords = pad_dim(true_coords, 1, coords.shape[1] - true_coords.shape[1])
+        true_resolved_mask = pad_dim(
+            true_resolved_mask,
+            0,
+            coords.shape[1] - true_resolved_mask.shape[0],
+        )
+        try:
+            rmsd, aligned_coords, align_weights = weighted_minimum_rmsd_single(
+                coords,
+                true_coords,
+                atom_mask=true_resolved_mask,
+                atom_to_token=feats["atom_to_token"][index_batch : index_batch + 1],
+                mol_type=feats["mol_type"][index_batch : index_batch + 1],
+                **args_rmsd,
+            )
+        except:
+            print("Warning: error in rmsd computation inside symmetry code")
+            continue
+        rmsd = rmsd.item()
+
+        if rmsd < best_rmsd:
+            best_rmsd = rmsd
+            best_true_coords = aligned_coords
+            best_align_weights = align_weights
+            best_true_resolved_mask = true_resolved_mask
+
+    # atom symmetries (nucleic acid and protein residues), resolved greedily without recomputing alignment
+    true_coords = best_true_coords.clone()
+    true_resolved_mask = best_true_resolved_mask.clone()
+    for symmetric_amino in amino_acids_symmetries:
+        for c in symmetric_amino:
+            # starting from greedy best, try to swap the atoms
+            new_true_coords = true_coords.clone()
+            new_true_resolved_mask = true_resolved_mask.clone()
+            for i, j in c:
+                new_true_coords[:, i] = true_coords[:, j]
+                new_true_resolved_mask[i] = true_resolved_mask[j]
+
+            # compute squared distance, for efficiency we do not recompute the alignment
+            best_mse_loss = torch.sum(
+                ((coords - best_true_coords) ** 2).sum(dim=-1)
+                * best_align_weights
+                * best_true_resolved_mask,
+                dim=-1,
+            ) / torch.sum(best_align_weights * best_true_resolved_mask, dim=-1)
+            new_mse_loss = torch.sum(
+                ((coords - new_true_coords) ** 2).sum(dim=-1)
+                * best_align_weights
+                * new_true_resolved_mask,
+                dim=-1,
+            ) / torch.sum(best_align_weights * new_true_resolved_mask, dim=-1)
+
+            if best_mse_loss > new_mse_loss:
+                best_true_coords = new_true_coords
+                best_true_resolved_mask = new_true_resolved_mask
+
+        # greedily update best coordinates after each amino acid
+        true_coords = best_true_coords.clone()
+        true_resolved_mask = best_true_resolved_mask.clone()
+
+    # Recomputing alignment
+    rmsd, true_coords, best_align_weights = weighted_minimum_rmsd_single(
+        coords,
+        true_coords,
+        atom_mask=true_resolved_mask,
+        atom_to_token=feats["atom_to_token"][index_batch : index_batch + 1],
+        mol_type=feats["mol_type"][index_batch : index_batch + 1],
+        **args_rmsd,
+    )
+    best_rmsd = rmsd.item()
+
+    # atom symmetries (ligand and non-standard), resolved greedily recomputing alignment
+    for symmetric_ligand in ligand_symmetries:
+        for c in symmetric_ligand:
+            new_true_coords = true_coords.clone()
+            new_true_resolved_mask = true_resolved_mask.clone()
+            for i, j in c:
+                new_true_coords[:, j] = true_coords[:, i]
+                new_true_resolved_mask[j] = true_resolved_mask[i]
+            try:
+                # TODO if this is too slow maybe we can get away with not recomputing alignment
+                rmsd, aligned_coords, align_weights = weighted_minimum_rmsd_single(
+                    coords,
+                    new_true_coords,
+                    atom_mask=new_true_resolved_mask,
+                    atom_to_token=feats["atom_to_token"][index_batch : index_batch + 1],
+                    mol_type=feats["mol_type"][index_batch : index_batch + 1],
+                    **args_rmsd,
+                )
+            except Exception as e:
+                raise e
+                print(e)
+                continue
+            rmsd = rmsd.item()
+            if rmsd < best_rmsd:
+                best_true_coords = aligned_coords
+                best_rmsd = rmsd
+                best_true_resolved_mask = new_true_resolved_mask
+
+        true_coords = best_true_coords.clone()
+        true_resolved_mask = best_true_resolved_mask.clone()
+
+    return best_true_coords, best_rmsd, best_true_resolved_mask.unsqueeze(0)
+
+
+def minimum_lddt_symmetry_coords(
+    coords: torch.Tensor,
+    feats: dict,
+    index_batch: int,
+    **args_rmsd,
+):
+    all_coords = feats["all_coords"][index_batch].unsqueeze(0).to(coords)
+    all_resolved_mask = (
+        feats["all_resolved_mask"][index_batch].to(coords).to(torch.bool)
+    )
+    crop_to_all_atom_map = (
+        feats["crop_to_all_atom_map"][index_batch].to(coords).to(torch.long)
+    )
+    chain_symmetries = feats["chain_symmetries"][index_batch]
+    amino_acids_symmetries = feats["amino_acids_symmetries"][index_batch]
+    ligand_symmetries = feats["ligand_symmetries"][index_batch]
+
+    dmat_predicted = torch.cdist(
+        coords[:, : len(crop_to_all_atom_map)], coords[:, : len(crop_to_all_atom_map)]
+    )
+
+    # Check best symmetry on chain swap
+    best_true_coords = None
+    best_lddt = 0
+    for c in chain_symmetries:
+        true_all_coords = all_coords.clone()
+        true_all_resolved_mask = all_resolved_mask.clone()
+        for start1, end1, start2, end2, chainidx1, chainidx2 in c:
+            true_all_coords[:, start1:end1] = all_coords[:, start2:end2]
+            true_all_resolved_mask[start1:end1] = all_resolved_mask[start2:end2]
+        true_coords = true_all_coords[:, crop_to_all_atom_map]
+        true_resolved_mask = true_all_resolved_mask[crop_to_all_atom_map]
+        dmat_true = torch.cdist(true_coords, true_coords)
+        pair_mask = (
+            true_resolved_mask[:, None]
+            * true_resolved_mask[None, :]
+            * (1 - torch.eye(len(true_resolved_mask))).to(true_resolved_mask)
+        )
+
+        lddt = lddt_dist(
+            dmat_predicted, dmat_true, pair_mask, cutoff=15.0, per_atom=False
+        )[0]
+        lddt = lddt.item()
+
+        if lddt > best_lddt:
+            best_lddt = lddt
+            best_true_coords = true_coords
+            best_true_resolved_mask = true_resolved_mask
+
+    # atom symmetries (nucleic acid and protein residues), resolved greedily without recomputing alignment
+    true_coords = best_true_coords.clone()
+    true_resolved_mask = best_true_resolved_mask.clone()
+    for symmetric_amino_or_lig in amino_acids_symmetries + ligand_symmetries:
+        for c in symmetric_amino_or_lig:
+            # starting from greedy best, try to swap the atoms
+            new_true_coords = true_coords.clone()
+            new_true_resolved_mask = true_resolved_mask.clone()
+            indices = []
+            for i, j in c:
+                new_true_coords[:, i] = true_coords[:, j]
+                new_true_resolved_mask[i] = true_resolved_mask[j]
+                indices.append(i)
+
+            indices = (
+                torch.from_numpy(np.asarray(indices)).to(new_true_coords.device).long()
+            )
+
+            pred_coords_subset = coords[:, : len(crop_to_all_atom_map)][:, indices]
+            true_coords_subset = true_coords[:, indices]
+            new_true_coords_subset = new_true_coords[:, indices]
+
+            sub_dmat_pred = torch.cdist(
+                coords[:, : len(crop_to_all_atom_map)], pred_coords_subset
+            )
+            sub_dmat_true = torch.cdist(true_coords, true_coords_subset)
+            sub_dmat_new_true = torch.cdist(new_true_coords, new_true_coords_subset)
+
+            sub_true_pair_lddt = (
+                true_resolved_mask[:, None] * true_resolved_mask[None, indices]
+            )
+            sub_true_pair_lddt[indices] = (
+                sub_true_pair_lddt[indices]
+                * (1 - torch.eye(len(indices))).to(sub_true_pair_lddt).bool()
+            )
+
+            sub_new_true_pair_lddt = (
+                new_true_resolved_mask[:, None] * new_true_resolved_mask[None, indices]
+            )
+            sub_new_true_pair_lddt[indices] = (
+                sub_new_true_pair_lddt[indices]
+                * (1 - torch.eye(len(indices))).to(sub_true_pair_lddt).bool()
+            )
+
+            lddt = lddt_dist(
+                sub_dmat_pred,
+                sub_dmat_true,
+                sub_true_pair_lddt,
+                cutoff=15.0,
+                per_atom=False,
+            )[0]
+            new_lddt = lddt_dist(
+                sub_dmat_pred,
+                sub_dmat_new_true,
+                sub_new_true_pair_lddt,
+                cutoff=15.0,
+                per_atom=False,
+            )[0]
+
+            if new_lddt > lddt:
+                best_true_coords = new_true_coords
+                best_true_resolved_mask = new_true_resolved_mask
+
+        # greedily update best coordinates after each amino acid
+        true_coords = best_true_coords.clone()
+        true_resolved_mask = best_true_resolved_mask.clone()
+
+    # Recomputing alignment
+    true_coords = pad_dim(true_coords, 1, coords.shape[1] - true_coords.shape[1])
+    true_resolved_mask = pad_dim(
+        true_resolved_mask,
+        0,
+        coords.shape[1] - true_resolved_mask.shape[0],
+    )
+
+    try:
+        rmsd, true_coords, _ = weighted_minimum_rmsd_single(
+            coords,
+            true_coords,
+            atom_mask=true_resolved_mask,
+            atom_to_token=feats["atom_to_token"][index_batch : index_batch + 1],
+            mol_type=feats["mol_type"][index_batch : index_batch + 1],
+            **args_rmsd,
+        )
+        best_rmsd = rmsd.item()
+    except Exception as e:
+        print("Failed proper RMSD computation, returning inf. Error: ", e)
+        best_rmsd = 1000
+
+    return true_coords, best_rmsd, true_resolved_mask.unsqueeze(0)
+
+
+def compute_all_coords_mask(structure):
+    # Compute all coords, crop mask and add start_idx to structure
+    total_count = 0
+    all_coords = []
+    all_coords_crop_mask = []
+    all_resolved_mask = []
+    for i, chain in enumerate(structure.chains):
+        chain.start_idx = total_count
+        for j, token in enumerate(chain.tokens):
+            token.start_idx = total_count - chain.start_idx
+            all_coords.extend(
+                [[atom.coords.x, atom.coords.y, atom.coords.z] for atom in token.atoms]
+            )
+            all_coords_crop_mask.extend(
+                [token.in_crop for _ in range(len(token.atoms))]
+            )
+            all_resolved_mask.extend(
+                [token.is_present for _ in range(len(token.atoms))]
+            )
+            total_count += len(token.atoms)
+    if len(all_coords_crop_mask) != len(all_resolved_mask):
+        pass
+    return all_coords, all_coords_crop_mask, all_resolved_mask
+
+
+def get_chain_symmetries(cropped, max_n_symmetries=100):
+    # get all coordinates and resolved mask
+    structure = cropped.structure
+    all_coords = []
+    all_resolved_mask = []
+    original_atom_idx = []
+    chain_atom_idx = []
+    chain_atom_num = []
+    chain_in_crop = []
+    chain_asym_id = []
+    new_atom_idx = 0
+
+    for chain in structure.chains:
+        atom_idx, atom_num = (
+            chain["atom_idx"],
+            chain["atom_num"],
+        )
+
+        # compute coordinates and resolved mask
+        resolved_mask = structure.atoms["is_present"][atom_idx : atom_idx + atom_num]
+
+        # ensemble_atom_starts = [structure.ensemble[idx]["atom_coord_idx"] for idx in cropped.ensemble_ref_idxs]
+        # coords = np.array(
+        #    [structure.coords[ensemble_atom_start + atom_idx: ensemble_atom_start + atom_idx + atom_num]["coords"] for
+        #     ensemble_atom_start in ensemble_atom_starts])
+
+        coords = structure.atoms["coords"][atom_idx : atom_idx + atom_num]
+
+        in_crop = False
+        for token in cropped.tokens:
+            if token["asym_id"] == chain["asym_id"]:
+                in_crop = True
+                break
+
+        all_coords.append(coords)
+        all_resolved_mask.append(resolved_mask)
+        original_atom_idx.append(atom_idx)
+        chain_atom_idx.append(new_atom_idx)
+        chain_atom_num.append(atom_num)
+        chain_in_crop.append(in_crop)
+        chain_asym_id.append(chain["asym_id"])
+
+        new_atom_idx += atom_num
+
+    # Compute backmapping from token to all coords
+    crop_to_all_atom_map = []
+    for token in cropped.tokens:
+        chain_idx = chain_asym_id.index(token["asym_id"])
+        start = (
+            chain_atom_idx[chain_idx] - original_atom_idx[chain_idx] + token["atom_idx"]
+        )
+        crop_to_all_atom_map.append(np.arange(start, start + token["atom_num"]))
+
+    # Compute the symmetries between chains
+    swaps = []
+    for i, chain in enumerate(structure.chains):
+        start = chain_atom_idx[i]
+        end = start + chain_atom_num[i]
+        if chain_in_crop[i]:
+            possible_swaps = []
+            for j, chain2 in enumerate(structure.chains):
+                start2 = chain_atom_idx[j]
+                end2 = start2 + chain_atom_num[j]
+                if (
+                    chain["entity_id"] == chain2["entity_id"]
+                    and end - start == end2 - start2
+                ):
+                    possible_swaps.append((start, end, start2, end2, i, j))
+            swaps.append(possible_swaps)
+    combinations = itertools.product(*swaps)
+    # to avoid combinatorial explosion, bound the number of combinations even considered
+    combinations = list(itertools.islice(combinations, max_n_symmetries * 10))
+    # filter for all chains getting a different assignment
+    combinations = [c for c in combinations if all_different_after_swap(c)]
+
+    if len(combinations) > max_n_symmetries:
+        combinations = random.sample(combinations, max_n_symmetries)
+
+    if len(combinations) == 0:
+        combinations.append([])
+
+    features = {}
+    features["all_coords"] = torch.Tensor(
+        np.concatenate(all_coords, axis=0)
+    )  # axis=1 with ensemble
+
+    features["all_resolved_mask"] = torch.Tensor(
+        np.concatenate(all_resolved_mask, axis=0)
+    )
+    features["crop_to_all_atom_map"] = torch.Tensor(
+        np.concatenate(crop_to_all_atom_map, axis=0)
+    )
+    features["chain_symmetries"] = combinations
+
+    return features
+
+
+def get_amino_acids_symmetries(cropped):
+    # Compute standard amino-acids symmetries
+    swaps = []
+    start_index_crop = 0
+    for token in cropped.tokens:
+        symmetries = const.ref_symmetries.get(const.tokens[token["res_type"]], [])
+        if len(symmetries) > 0:
+            residue_swaps = []
+            for sym in symmetries:
+                sym_new_idx = [
+                    (i + start_index_crop, j + start_index_crop) for i, j in sym
+                ]
+                residue_swaps.append(sym_new_idx)
+            swaps.append(residue_swaps)
+        start_index_crop += token["atom_num"]
+
+    features = {"amino_acids_symmetries": swaps}
+    return features
+
+
+def get_ligand_symmetries(cropped, symmetries):
+    # Compute ligand and non-standard amino-acids symmetries
+    structure = cropped.structure
+
+    added_molecules = {}
+    index_mols = []
+    atom_count = 0
+    for token in cropped.tokens:
+        # check if molecule is already added by identifying it through asym_id and res_idx
+        atom_count += token["atom_num"]
+        mol_id = (token["asym_id"], token["res_idx"])
+        if mol_id in added_molecules.keys():
+            added_molecules[mol_id] += token["atom_num"]
+            continue
+        added_molecules[mol_id] = token["atom_num"]
+
+        # get the molecule type and indices
+        residue_idx = token["res_idx"] + structure.chains[token["asym_id"]]["res_idx"]
+        mol_name = structure.residues[residue_idx]["name"]
+        atom_idx = structure.residues[residue_idx]["atom_idx"]
+        mol_atom_names = structure.atoms[
+            atom_idx : atom_idx + structure.residues[residue_idx]["atom_num"]
+        ]["name"]
+        mol_atom_names = [tuple(m) for m in mol_atom_names]
+        if mol_name not in const.ref_symmetries.keys():
+            index_mols.append(
+                (mol_name, atom_count - token["atom_num"], mol_id, mol_atom_names)
+            )
+
+    # for each molecule, get the symmetries
+    molecule_symmetries = []
+    for mol_name, start_mol, mol_id, mol_atom_names in index_mols:
+        if not mol_name in symmetries:
+            continue
+        else:
+            swaps = []
+            syms_ccd, mol_atom_names_ccd = symmetries[mol_name]
+            # Get indices of mol_atom_names_ccd that are in mol_atom_names
+            ccd_to_valid_ids = {
+                mol_atom_names_ccd.index(name): i
+                for i, name in enumerate(mol_atom_names)
+            }
+            ccd_valid_ids = set(ccd_to_valid_ids.keys())
+
+            syms = []
+            # Get syms
+            for sym_ccd in syms_ccd:
+                sym_dict = {}
+                bool_add = True
+                for i, j in enumerate(sym_ccd):
+                    if i in ccd_valid_ids:
+                        if j in ccd_valid_ids:
+                            i_true = ccd_to_valid_ids[i]
+                            j_true = ccd_to_valid_ids[j]
+                            sym_dict[i_true] = j_true
+                        else:
+                            bool_add = False
+                            break
+                if bool_add:
+                    syms.append([sym_dict[i] for i in range(len(ccd_valid_ids))])
+
+            for sym in syms:
+                if len(sym) != added_molecules[mol_id]:
+                    raise Exception(
+                        f"Symmetry length mismatch {len(sym)} {added_molecules[mol_id]}"
+                    )
+                # assert (
+                #     len(sym) == added_molecules[mol_id]
+                # ), f"Symmetry length mismatch {len(sym)} {added_molecules[mol_id]}"
+                sym_new_idx = []
+                for i, j in enumerate(sym):
+                    if i != int(j):
+                        sym_new_idx.append((i + start_mol, int(j) + start_mol))
+                if len(sym_new_idx) > 0:
+                    swaps.append(sym_new_idx)
+            if len(swaps) > 0:
+                molecule_symmetries.append(swaps)
+
+    features = {"ligand_symmetries": molecule_symmetries}
+
+    return features
diff --git a/forks/boltz/src/boltz/data/filter/__init__.py b/forks/boltz/src/boltz/data/filter/__init__.py
new file mode 100644
index 00000000..e69de29b
diff --git a/forks/boltz/src/boltz/data/filter/dynamic/__init__.py b/forks/boltz/src/boltz/data/filter/dynamic/__init__.py
new file mode 100644
index 00000000..e69de29b
diff --git a/forks/boltz/src/boltz/data/filter/dynamic/date.py b/forks/boltz/src/boltz/data/filter/dynamic/date.py
new file mode 100644
index 00000000..d7a9f08f
--- /dev/null
+++ b/forks/boltz/src/boltz/data/filter/dynamic/date.py
@@ -0,0 +1,76 @@
+from datetime import datetime
+from typing import Literal
+
+from boltz.data.types import Record
+from boltz.data.filter.dynamic.filter import DynamicFilter
+
+
+class DateFilter(DynamicFilter):
+    """A filter that filters complexes based on their date.
+
+    The date can be the deposition, release, or revision date.
+    If the date is not available, the previous date is used.
+
+    If no date is available, the complex is rejected.
+
+    """
+
+    def __init__(
+        self,
+        date: str,
+        ref: Literal["deposited", "revised", "released"],
+    ) -> None:
+        """Initialize the filter.
+
+        Parameters
+        ----------
+        date : str, optional
+            The maximum date of PDB entries to filter
+        ref : Literal["deposited", "revised", "released"]
+            The reference date to use.
+
+        """
+        self.filter_date = datetime.fromisoformat(date)
+        self.ref = ref
+
+        if ref not in ["deposited", "revised", "released"]:
+            msg = (
+                "Invalid reference date. Must be ",
+                "deposited, revised, or released",
+            )
+            raise ValueError(msg)
+
+    def filter(self, record: Record) -> bool:
+        """Filter a record based on its date.
+
+        Parameters
+        ----------
+        record : Record
+            The record to filter.
+
+        Returns
+        -------
+        bool
+            Whether the record should be filtered.
+
+        """
+        structure = record.structure
+
+        if self.ref == "deposited":
+            date = structure.deposited
+        elif self.ref == "released":
+            date = structure.released
+            if not date:
+                date = structure.deposited
+        elif self.ref == "revised":
+            date = structure.revised
+            if not date and structure.released:
+                date = structure.released
+            elif not date:
+                date = structure.deposited
+
+        if date is None or date == "":
+            return False
+
+        date = datetime.fromisoformat(date)
+        return date <= self.filter_date
diff --git a/forks/boltz/src/boltz/data/filter/dynamic/filter.py b/forks/boltz/src/boltz/data/filter/dynamic/filter.py
new file mode 100644
index 00000000..0060922c
--- /dev/null
+++ b/forks/boltz/src/boltz/data/filter/dynamic/filter.py
@@ -0,0 +1,24 @@
+from abc import ABC, abstractmethod
+
+from boltz.data.types import Record
+
+
+class DynamicFilter(ABC):
+    """Base class for data filters."""
+
+    @abstractmethod
+    def filter(self, record: Record) -> bool:
+        """Filter a data record.
+
+        Parameters
+        ----------
+        record : Record
+            The object to consider filtering in / out.
+
+        Returns
+        -------
+        bool
+            True if the data passes the filter, False otherwise.
+
+        """
+        raise NotImplementedError
diff --git a/forks/boltz/src/boltz/data/filter/dynamic/max_residues.py b/forks/boltz/src/boltz/data/filter/dynamic/max_residues.py
new file mode 100644
index 00000000..b8397d40
--- /dev/null
+++ b/forks/boltz/src/boltz/data/filter/dynamic/max_residues.py
@@ -0,0 +1,37 @@
+from boltz.data.types import Record
+from boltz.data.filter.dynamic.filter import DynamicFilter
+
+
+class MaxResiduesFilter(DynamicFilter):
+    """A filter that filters structures based on their size."""
+
+    def __init__(self, min_residues: int = 1, max_residues: int = 500) -> None:
+        """Initialize the filter.
+
+        Parameters
+        ----------
+        min_chains : int
+            The minimum number of chains allowed.
+        max_chains : int
+            The maximum number of chains allowed.
+
+        """
+        self.min_residues = min_residues
+        self.max_residues = max_residues
+
+    def filter(self, record: Record) -> bool:
+        """Filter structures based on their resolution.
+
+        Parameters
+        ----------
+        record : Record
+            The record to filter.
+
+        Returns
+        -------
+        bool
+            Whether the record should be filtered.
+
+        """
+        num_residues = sum(chain.num_residues for chain in record.chains)
+        return num_residues <= self.max_residues and num_residues >= self.min_residues
diff --git a/forks/boltz/src/boltz/data/filter/dynamic/resolution.py b/forks/boltz/src/boltz/data/filter/dynamic/resolution.py
new file mode 100644
index 00000000..8096d6aa
--- /dev/null
+++ b/forks/boltz/src/boltz/data/filter/dynamic/resolution.py
@@ -0,0 +1,34 @@
+from boltz.data.types import Record
+from boltz.data.filter.dynamic.filter import DynamicFilter
+
+
+class ResolutionFilter(DynamicFilter):
+    """A filter that filters complexes based on their resolution."""
+
+    def __init__(self, resolution: float = 9.0) -> None:
+        """Initialize the filter.
+
+        Parameters
+        ----------
+        resolution : float, optional
+            The maximum allowed resolution.
+
+        """
+        self.resolution = resolution
+
+    def filter(self, record: Record) -> bool:
+        """Filter complexes based on their resolution.
+
+        Parameters
+        ----------
+        record : Record
+            The record to filter.
+
+        Returns
+        -------
+        bool
+            Whether the record should be filtered.
+
+        """
+        structure = record.structure
+        return structure.resolution <= self.resolution
diff --git a/forks/boltz/src/boltz/data/filter/dynamic/size.py b/forks/boltz/src/boltz/data/filter/dynamic/size.py
new file mode 100644
index 00000000..8d1094ed
--- /dev/null
+++ b/forks/boltz/src/boltz/data/filter/dynamic/size.py
@@ -0,0 +1,38 @@
+from boltz.data.types import Record
+from boltz.data.filter.dynamic.filter import DynamicFilter
+
+
+class SizeFilter(DynamicFilter):
+    """A filter that filters structures based on their size."""
+
+    def __init__(self, min_chains: int = 1, max_chains: int = 300) -> None:
+        """Initialize the filter.
+
+        Parameters
+        ----------
+        min_chains : int
+            The minimum number of chains allowed.
+        max_chains : int
+            The maximum number of chains allowed.
+
+        """
+        self.min_chains = min_chains
+        self.max_chains = max_chains
+
+    def filter(self, record: Record) -> bool:
+        """Filter structures based on their resolution.
+
+        Parameters
+        ----------
+        record : Record
+            The record to filter.
+
+        Returns
+        -------
+        bool
+            Whether the record should be filtered.
+
+        """
+        num_chains = record.structure.num_chains
+        num_valid = sum(1 for chain in record.chains if chain.valid)
+        return num_chains <= self.max_chains and num_valid >= self.min_chains
diff --git a/forks/boltz/src/boltz/data/filter/dynamic/subset.py b/forks/boltz/src/boltz/data/filter/dynamic/subset.py
new file mode 100644
index 00000000..53e12607
--- /dev/null
+++ b/forks/boltz/src/boltz/data/filter/dynamic/subset.py
@@ -0,0 +1,42 @@
+from pathlib import Path
+
+from boltz.data.types import Record
+from boltz.data.filter.dynamic.filter import DynamicFilter
+
+
+class SubsetFilter(DynamicFilter):
+    """Filter a data record based on a subset of the data."""
+
+    def __init__(self, subset: str, reverse: bool = False) -> None:
+        """Initialize the filter.
+
+        Parameters
+        ----------
+        subset : str
+            The subset of data to consider, one per line.
+
+        """
+        with Path(subset).open("r") as f:
+            subset = f.read().splitlines()
+
+        self.subset = {s.lower() for s in subset}
+        self.reverse = reverse
+
+    def filter(self, record: Record) -> bool:
+        """Filter a data record.
+
+        Parameters
+        ----------
+        record : Record
+            The object to consider filtering in / out.
+
+        Returns
+        -------
+        bool
+            True if the data passes the filter, False otherwise.
+
+        """
+        if self.reverse:
+            return record.id.lower() not in self.subset
+        else:  # noqa: RET505
+            return record.id.lower() in self.subset
diff --git a/forks/boltz/src/boltz/data/filter/static/__init__.py b/forks/boltz/src/boltz/data/filter/static/__init__.py
new file mode 100644
index 00000000..e69de29b
diff --git a/forks/boltz/src/boltz/data/filter/static/filter.py b/forks/boltz/src/boltz/data/filter/static/filter.py
new file mode 100644
index 00000000..2967e4ea
--- /dev/null
+++ b/forks/boltz/src/boltz/data/filter/static/filter.py
@@ -0,0 +1,26 @@
+from abc import ABC, abstractmethod
+
+import numpy as np
+
+from boltz.data.types import Structure
+
+
+class StaticFilter(ABC):
+    """Base class for structure filters."""
+
+    @abstractmethod
+    def filter(self, structure: Structure) -> np.ndarray:
+        """Filter chains in a structure.
+
+        Parameters
+        ----------
+        structure : Structure
+            The structure to filter chains from.
+
+        Returns
+        -------
+        np.ndarray
+            The chains to keep, as a boolean mask.
+
+        """
+        raise NotImplementedError
diff --git a/forks/boltz/src/boltz/data/filter/static/ligand.py b/forks/boltz/src/boltz/data/filter/static/ligand.py
new file mode 100644
index 00000000..5cceb068
--- /dev/null
+++ b/forks/boltz/src/boltz/data/filter/static/ligand.py
@@ -0,0 +1,37 @@
+import numpy as np
+
+from boltz.data import const
+from boltz.data.filter.static.filter import StaticFilter
+from boltz.data.types import Structure
+
+
+class ExcludedLigands(StaticFilter):
+    """Filter excluded ligands."""
+
+    def filter(self, structure: Structure) -> np.ndarray:
+        """Filter excluded ligands.
+
+        Parameters
+        ----------
+        structure : Structure
+            The structure to filter chains from.
+
+        Returns
+        -------
+        np.ndarray
+            The chains to keep, as a boolean mask.
+
+        """
+        valid = np.ones(len(structure.chains), dtype=bool)
+
+        for i, chain in enumerate(structure.chains):
+            if chain["mol_type"] != const.chain_type_ids["NONPOLYMER"]:
+                continue
+
+            res_start = chain["res_idx"]
+            res_end = res_start + chain["res_num"]
+            residues = structure.residues[res_start:res_end]
+            if any(res["name"] in const.ligand_exclusion for res in residues):
+                valid[i] = 0
+
+        return valid
diff --git a/forks/boltz/src/boltz/data/filter/static/polymer.py b/forks/boltz/src/boltz/data/filter/static/polymer.py
new file mode 100644
index 00000000..e7e12827
--- /dev/null
+++ b/forks/boltz/src/boltz/data/filter/static/polymer.py
@@ -0,0 +1,299 @@
+import itertools
+from dataclasses import dataclass
+
+import numpy as np
+from sklearn.neighbors import KDTree
+
+from boltz.data import const
+from boltz.data.filter.static.filter import StaticFilter
+from boltz.data.types import Structure
+
+
+class MinimumLengthFilter(StaticFilter):
+    """Filter polymers based on their length.
+
+    We use the number of resolved residues when considering
+    the minimum, and the sequence length for the maximum.
+
+    """
+
+    def __init__(self, min_len: int = 4, max_len: int = 5000) -> None:
+        """Initialize the filter.
+
+        Parameters
+        ----------
+        min_len : float, optional
+            The minimum allowed length.
+        max_len : float, optional
+            The maximum allowed length.
+
+        """
+        self._min = min_len
+        self._max = max_len
+
+    def filter(self, structure: Structure) -> np.ndarray:
+        """Filter a chains based on their length.
+
+        Parameters
+        ----------
+        structure : Structure
+            The structure to filter chains from.
+
+        Returns
+        -------
+        np.ndarray
+            The chains to keep, as a boolean mask.
+
+        """
+        valid = np.ones(len(structure.chains), dtype=bool)
+
+        for i, chain in enumerate(structure.chains):
+            if chain["mol_type"] == const.chain_type_ids["NONPOLYMER"]:
+                continue
+
+            res_start = chain["res_idx"]
+            res_end = res_start + chain["res_num"]
+            residues = structure.residues[res_start:res_end]
+            resolved = residues["is_present"].sum()
+
+            if (resolved < self._min) or (resolved > self._max):
+                valid[i] = 0
+
+        return valid
+
+
+class UnknownFilter(StaticFilter):
+    """Filter proteins with all unknown residues."""
+
+    def filter(self, structure: Structure) -> np.ndarray:
+        """Filter proteins with all unknown residues.
+
+        Parameters
+        ----------
+        structure : Structure
+            The structure to filter chains from.
+
+        Returns
+        -------
+        np.ndarray
+            The chains to keep, as a boolean mask.
+
+        """
+        valid = np.ones(len(structure.chains), dtype=bool)
+        unk_toks = {
+            const.chain_type_ids["PROTEIN"]: const.unk_token_ids["PROTEIN"],
+            const.chain_type_ids["DNA"]: const.unk_token_ids["DNA"],
+            const.chain_type_ids["RNA"]: const.unk_token_ids["RNA"],
+        }
+
+        for i, chain in enumerate(structure.chains):
+            if chain["mol_type"] == const.chain_type_ids["NONPOLYMER"]:
+                continue
+
+            res_start = chain["res_idx"]
+            res_end = res_start + chain["res_num"]
+            residues = structure.residues[res_start:res_end]
+
+            unk_id = unk_toks[chain["mol_type"]]
+            if np.all(residues["res_type"] == unk_id):
+                valid[i] = 0
+
+        return valid
+
+
+class ConsecutiveCA(StaticFilter):
+    """Filter proteins with consecutive CA atoms above a threshold."""
+
+    def __init__(self, max_dist: int = 10.0) -> None:
+        """Initialize the filter.
+
+        Parameters
+        ----------
+        max_dist : float, optional
+            The maximum allowed distance.
+
+        """
+        self._max_dist = max_dist
+
+    def filter(self, structure: Structure) -> np.ndarray:
+        """Filter protein if consecutive CA atoms above a threshold.
+
+        Parameters
+        ----------
+        structure : Structure
+            The structure to filter chains from.
+
+        Returns
+        -------
+        np.ndarray
+            The chains to keep, as a boolean mask.
+
+        """
+        valid = np.ones(len(structure.chains), dtype=bool)
+
+        # Remove chain if consecutive CA atoms are above threshold
+        for i, chain in enumerate(structure.chains):
+            # Skip non-protein chains
+            if chain["mol_type"] != const.chain_type_ids["PROTEIN"]:
+                continue
+
+            # Get residues
+            res_start = chain["res_idx"]
+            res_end = res_start + chain["res_num"]
+            residues = structure.residues[res_start:res_end]
+
+            # Get c-alphas
+            ca_ids = residues["atom_center"]
+            ca_atoms = structure.atoms[ca_ids]
+
+            res_valid = residues["is_present"]
+            ca_valid = ca_atoms["is_present"] & res_valid
+            ca_coords = ca_atoms["coords"]
+
+            # Compute distances between consecutive atoms
+            dist = np.linalg.norm(ca_coords[1:] - ca_coords[:-1], axis=1)
+            dist = dist > self._max_dist
+            dist = dist[ca_valid[1:] & ca_valid[:-1]]
+
+            # Remove the chain if any valid pair is above threshold
+            if np.any(dist):
+                valid[i] = 0
+
+        return valid
+
+
+@dataclass(frozen=True)
+class Clash:
+    """A clash between two chains."""
+
+    chain: int
+    other: int
+    num_atoms: int
+    num_clashes: int
+
+
+class ClashingChainsFilter(StaticFilter):
+    """A filter that filters clashing chains.
+
+    Clashing chains are defined as those with >30% of atoms
+    within 1.7 Å of an atom in another chain. If two chains
+    are clashing with each other, the chain with the greater
+    percentage of clashing atoms will be removed. If the same
+    fraction of atoms are clashing, the chain with fewer total
+    atoms is removed. If the chains have the same number of
+    atoms, then the chain with the larger chain id is removed.
+
+    """
+
+    def __init__(self, dist: float = 1.7, freq: float = 0.3) -> None:
+        """Initialize the filter.
+
+        Parameters
+        ----------
+        dist : float, optional
+            The maximum distance for a clash.
+        freq : float, optional
+            The maximum allowed frequency of clashes.
+
+        """
+        self._dist = dist
+        self._freq = freq
+
+    def filter(self, structure: Structure) -> np.ndarray:  # noqa: PLR0912, C901
+        """Filter out clashing chains.
+
+        Parameters
+        ----------
+        structure : Structure
+            The structure to filter chains from.
+
+        Returns
+        -------
+        np.ndarray
+            The chains to keep, as a boolean mask.
+
+        """
+        num_chains = len(structure.chains)
+        if num_chains < 2:  # noqa: PLR2004
+            return np.ones(num_chains, dtype=bool)
+
+        # Get unique chain pairs
+        pairs = itertools.combinations(range(num_chains), 2)
+
+        # Compute clashes
+        clashes: list[Clash] = []
+        for i, j in pairs:
+            # Get the chains
+            c1 = structure.chains[i]
+            c2 = structure.chains[j]
+
+            # Get the atoms from each chain
+            c1_start = c1["atom_idx"]
+            c2_start = c2["atom_idx"]
+            c1_end = c1_start + c1["atom_num"]
+            c2_end = c2_start + c2["atom_num"]
+
+            atoms1 = structure.atoms[c1_start:c1_end]
+            atoms2 = structure.atoms[c2_start:c2_end]
+            atoms1 = atoms1[atoms1["is_present"]]
+            atoms2 = atoms2[atoms2["is_present"]]
+
+            # Skip if either chain has no atoms
+            if len(atoms1) == 0 or len(atoms2) == 0:
+                continue
+
+            # Compute the number of clashes
+            # Compute the distance matrix
+            tree = KDTree(atoms1["coords"], metric="euclidean")
+            query = tree.query_radius(atoms2["coords"], self._dist)
+
+            c2_clashes = sum(len(neighbors) > 0 for neighbors in query)
+            c1_clashes = len(set(itertools.chain.from_iterable(query)))
+
+            # Save results
+            if (c1_clashes / len(atoms1)) > self._freq:
+                clashes.append(Clash(i, j, len(atoms1), c1_clashes))
+            if (c2_clashes / len(atoms2)) > self._freq:
+                clashes.append(Clash(j, i, len(atoms2), c2_clashes))
+
+        # Compute indices to clash map
+        removed = set()
+        ids_to_clash = {(c.chain, c.other): c for c in clashes}
+
+        # Filter out chains according to ruleset
+        for clash in clashes:
+            # If either is already removed, skip
+            if clash.chain in removed or clash.other in removed:
+                continue
+
+            # Check if the two chains clash with each other
+            other_clash = ids_to_clash.get((clash.other, clash.chain))
+            if other_clash is not None:
+                # Remove the chain with the most clashes
+                clash1_freq = clash.num_clashes / clash.num_atoms
+                clash2_freq = other_clash.num_clashes / other_clash.num_atoms
+                if clash1_freq > clash2_freq:
+                    removed.add(clash.chain)
+                elif clash1_freq < clash2_freq:
+                    removed.add(clash.other)
+
+                # If same, remove the chain with fewer atoms
+                elif clash.num_atoms < other_clash.num_atoms:
+                    removed.add(clash.chain)
+                elif clash.num_atoms > other_clash.num_atoms:
+                    removed.add(clash.other)
+
+                # If same, remove the chain with the larger chain id
+                else:
+                    removed.add(max(clash.chain, clash.other))
+
+            # Otherwise, just remove the chain directly
+            else:
+                removed.add(clash.chain)
+
+        # Remove the chains
+        valid = np.ones(len(structure.chains), dtype=bool)
+        for i in removed:
+            valid[i] = 0
+
+        return valid
diff --git a/forks/boltz/src/boltz/data/module/__init__.py b/forks/boltz/src/boltz/data/module/__init__.py
new file mode 100644
index 00000000..e69de29b
diff --git a/forks/boltz/src/boltz/data/module/inference.py b/forks/boltz/src/boltz/data/module/inference.py
new file mode 100644
index 00000000..b09a6afc
--- /dev/null
+++ b/forks/boltz/src/boltz/data/module/inference.py
@@ -0,0 +1,310 @@
+from pathlib import Path
+from typing import Optional
+
+import numpy as np
+import pytorch_lightning as pl
+import torch
+from torch import Tensor
+from torch.utils.data import DataLoader
+
+from boltz.data import const
+from boltz.data.feature.featurizer import BoltzFeaturizer
+from boltz.data.pad import pad_to_max
+from boltz.data.tokenize.boltz import BoltzTokenizer
+from boltz.data.types import (
+    MSA,
+    Connection,
+    Input,
+    Manifest,
+    Record,
+    ResidueConstraints,
+    Structure,
+)
+
+
+def load_input(
+    record: Record,
+    target_dir: Path,
+    msa_dir: Path,
+    constraints_dir: Optional[Path] = None,
+) -> Input:
+    """Load the given input data.
+
+    Parameters
+    ----------
+    record : Record
+        The record to load.
+    target_dir : Path
+        The path to the data directory.
+    msa_dir : Path
+        The path to msa directory.
+
+    Returns
+    -------
+    Input
+        The loaded input.
+
+    """
+    # Load the structure
+    structure = np.load(target_dir / f"{record.id}.npz")
+    structure = Structure(
+        atoms=structure["atoms"],
+        bonds=structure["bonds"],
+        residues=structure["residues"],
+        chains=structure["chains"],
+        connections=structure["connections"].astype(Connection),
+        interfaces=structure["interfaces"],
+        mask=structure["mask"],
+    )
+
+    msas = {}
+    for chain in record.chains:
+        msa_id = chain.msa_id
+        # Load the MSA for this chain, if any
+        if msa_id != -1:
+            msa = np.load(msa_dir / f"{msa_id}.npz")
+            msas[chain.chain_id] = MSA(**msa)
+
+    residue_constraints = None
+    if constraints_dir is not None:
+        residue_constraints = ResidueConstraints.load(
+            constraints_dir / f"{record.id}.npz"
+        )
+
+    return Input(structure, msas, record, residue_constraints)
+
+
+def collate(data: list[dict[str, Tensor]]) -> dict[str, Tensor]:
+    """Collate the data.
+
+    Parameters
+    ----------
+    data : List[Dict[str, Tensor]]
+        The data to collate.
+
+    Returns
+    -------
+    Dict[str, Tensor]
+        The collated data.
+
+    """
+    # Get the keys
+    keys = data[0].keys()
+
+    # Collate the data
+    collated = {}
+    for key in keys:
+        values = [d[key] for d in data]
+
+        if key not in [
+            "all_coords",
+            "all_resolved_mask",
+            "crop_to_all_atom_map",
+            "chain_symmetries",
+            "amino_acids_symmetries",
+            "ligand_symmetries",
+            "record",
+        ]:
+            # Check if all have the same shape
+            shape = values[0].shape
+            if not all(v.shape == shape for v in values):
+                values, _ = pad_to_max(values, 0)
+            else:
+                values = torch.stack(values, dim=0)
+
+        # Stack the values
+        collated[key] = values
+
+    return collated
+
+
+class PredictionDataset(torch.utils.data.Dataset):
+    """Base iterable dataset."""
+
+    def __init__(
+        self,
+        manifest: Manifest,
+        target_dir: Path,
+        msa_dir: Path,
+        constraints_dir: Optional[Path] = None,
+    ) -> None:
+        """Initialize the training dataset.
+
+        Parameters
+        ----------
+        manifest : Manifest
+            The manifest to load data from.
+        target_dir : Path
+            The path to the target directory.
+        msa_dir : Path
+            The path to the msa directory.
+
+        """
+        super().__init__()
+        self.manifest = manifest
+        self.target_dir = target_dir
+        self.msa_dir = msa_dir
+        self.constraints_dir = constraints_dir
+        self.tokenizer = BoltzTokenizer()
+        self.featurizer = BoltzFeaturizer()
+
+    def __getitem__(self, idx: int) -> dict:
+        """Get an item from the dataset.
+
+        Returns
+        -------
+        Dict[str, Tensor]
+            The sampled data features.
+
+        """
+        # Get a sample from the dataset
+        record = self.manifest.records[idx]
+
+        # Get the structure
+        try:
+            input_data = load_input(
+                record,
+                self.target_dir,
+                self.msa_dir,
+                self.constraints_dir,
+            )
+        except Exception as e:  # noqa: BLE001
+            print(f"Failed to load input for {record.id} with error {e}. Skipping.")  # noqa: T201
+            return self.__getitem__(0)
+
+        # Tokenize structure
+        try:
+            tokenized = self.tokenizer.tokenize(input_data)
+        except Exception as e:  # noqa: BLE001
+            print(f"Tokenizer failed on {record.id} with error {e}. Skipping.")  # noqa: T201
+            return self.__getitem__(0)
+
+        # Inference specific options
+        options = record.inference_options
+        if options is None or len(options.pocket_constraints) == 0:
+            binder, pocket = None, None
+        else:
+            binder, pocket = (
+                options.pocket_constraints[0][0],
+                options.pocket_constraints[0][1],
+            )
+
+        # Compute features
+        try:
+            features = self.featurizer.process(
+                tokenized,
+                training=False,
+                max_atoms=None,
+                max_tokens=None,
+                max_seqs=const.max_msa_seqs,
+                pad_to_max_seqs=False,
+                symmetries={},
+                compute_symmetries=False,
+                inference_binder=binder,
+                inference_pocket=pocket,
+                compute_constraint_features=True,
+            )
+        except Exception as e:  # noqa: BLE001
+            print(f"Featurizer failed on {record.id} with error {e}. Skipping.")  # noqa: T201
+            return self.__getitem__(0)
+
+        features["record"] = record
+        return features
+
+    def __len__(self) -> int:
+        """Get the length of the dataset.
+
+        Returns
+        -------
+        int
+            The length of the dataset.
+
+        """
+        return len(self.manifest.records)
+
+
+class BoltzInferenceDataModule(pl.LightningDataModule):
+    """DataModule for Boltz inference."""
+
+    def __init__(
+        self,
+        manifest: Manifest,
+        target_dir: Path,
+        msa_dir: Path,
+        num_workers: int,
+        constraints_dir: Optional[Path] = None,
+    ) -> None:
+        """Initialize the DataModule.
+
+        Parameters
+        ----------
+        config : DataConfig
+            The data configuration.
+
+        """
+        super().__init__()
+        self.num_workers = num_workers
+        self.manifest = manifest
+        self.target_dir = target_dir
+        self.msa_dir = msa_dir
+        self.constraints_dir = constraints_dir
+
+    def predict_dataloader(self) -> DataLoader:
+        """Get the training dataloader.
+
+        Returns
+        -------
+        DataLoader
+            The training dataloader.
+
+        """
+        dataset = PredictionDataset(
+            manifest=self.manifest,
+            target_dir=self.target_dir,
+            msa_dir=self.msa_dir,
+            constraints_dir=self.constraints_dir,
+        )
+        return DataLoader(
+            dataset,
+            batch_size=1,
+            num_workers=self.num_workers,
+            pin_memory=True,
+            shuffle=False,
+            collate_fn=collate,
+        )
+
+    def transfer_batch_to_device(
+        self,
+        batch: dict,
+        device: torch.device,
+        dataloader_idx: int,  # noqa: ARG002
+    ) -> dict:
+        """Transfer a batch to the given device.
+
+        Parameters
+        ----------
+        batch : Dict
+            The batch to transfer.
+        device : torch.device
+            The device to transfer to.
+        dataloader_idx : int
+            The dataloader index.
+
+        Returns
+        -------
+        np.Any
+            The transferred batch.
+
+        """
+        for key in batch:
+            if key not in [
+                "all_coords",
+                "all_resolved_mask",
+                "crop_to_all_atom_map",
+                "chain_symmetries",
+                "amino_acids_symmetries",
+                "ligand_symmetries",
+                "record",
+            ]:
+                batch[key] = batch[key].to(device)
+        return batch
diff --git a/forks/boltz/src/boltz/data/module/inferencev2.py b/forks/boltz/src/boltz/data/module/inferencev2.py
new file mode 100644
index 00000000..590297d2
--- /dev/null
+++ b/forks/boltz/src/boltz/data/module/inferencev2.py
@@ -0,0 +1,433 @@
+import pickle
+from pathlib import Path
+from typing import Optional
+
+import numpy as np
+import pytorch_lightning as pl
+import torch
+from torch import Tensor
+from torch.utils.data import DataLoader
+
+from boltz.data import const
+from boltz.data.crop.affinity import AffinityCropper
+from boltz.data.feature.featurizerv2 import Boltz2Featurizer
+from boltz.data.mol import load_canonicals, load_molecules
+from boltz.data.pad import pad_to_max
+from boltz.data.tokenize.boltz2 import Boltz2Tokenizer
+from boltz.data.types import (
+    MSA,
+    Input,
+    Manifest,
+    Record,
+    ResidueConstraints,
+    StructureV2,
+)
+
+
+def load_input(
+    record: Record,
+    target_dir: Path,
+    msa_dir: Path,
+    constraints_dir: Optional[Path] = None,
+    template_dir: Optional[Path] = None,
+    extra_mols_dir: Optional[Path] = None,
+    affinity: bool = False,
+) -> Input:
+    """Load the given input data.
+
+    Parameters
+    ----------
+    record : Record
+        The record to load.
+    target_dir : Path
+        The path to the data directory.
+    msa_dir : Path
+        The path to msa directory.
+    constraints_dir : Optional[Path]
+        The path to the constraints directory.
+    template_dir : Optional[Path]
+        The path to the template directory.
+    extra_mols_dir : Optional[Path]
+        The path to the extra molecules directory.
+    affinity : bool
+        Whether to load the affinity data.
+
+    Returns
+    -------
+    Input
+        The loaded input.
+
+    """
+    # Load the structure
+    if affinity:
+        structure = StructureV2.load(
+            target_dir / record.id / f"pre_affinity_{record.id}.npz"
+        )
+    else:
+        structure = StructureV2.load(target_dir / f"{record.id}.npz")
+
+    msas = {}
+    for chain in record.chains:
+        msa_id = chain.msa_id
+        # Load the MSA for this chain, if any
+        if msa_id != -1:
+            msa = MSA.load(msa_dir / f"{msa_id}.npz")
+            msas[chain.chain_id] = msa
+
+    # Load templates
+    templates = None
+    if record.templates and template_dir is not None:
+        templates = {}
+        for template_info in record.templates:
+            template_id = template_info.name
+            template_path = template_dir / f"{record.id}_{template_id}.npz"
+            template = StructureV2.load(template_path)
+            templates[template_id] = template
+
+    # Load residue constraints
+    residue_constraints = None
+    if constraints_dir is not None:
+        residue_constraints = ResidueConstraints.load(
+            constraints_dir / f"{record.id}.npz"
+        )
+
+    # Load extra molecules
+    extra_mols = {}
+    if extra_mols_dir is not None:
+        extra_mol_path = extra_mols_dir / f"{record.id}.pkl"
+        if extra_mol_path.exists():
+            with extra_mol_path.open("rb") as f:
+                extra_mols = pickle.load(f)  # noqa: S301
+
+    return Input(
+        structure,
+        msas,
+        record=record,
+        residue_constraints=residue_constraints,
+        templates=templates,
+        extra_mols=extra_mols,
+    )
+
+
+def collate(data: list[dict[str, Tensor]]) -> dict[str, Tensor]:
+    """Collate the data.
+
+    Parameters
+    ----------
+    data : List[Dict[str, Tensor]]
+        The data to collate.
+
+    Returns
+    -------
+    Dict[str, Tensor]
+        The collated data.
+
+    """
+    # Get the keys
+    keys = data[0].keys()
+
+    # Collate the data
+    collated = {}
+    for key in keys:
+        values = [d[key] for d in data]
+
+        if key not in [
+            "all_coords",
+            "all_resolved_mask",
+            "crop_to_all_atom_map",
+            "chain_symmetries",
+            "amino_acids_symmetries",
+            "ligand_symmetries",
+            "record",
+            "affinity_mw",
+        ]:
+            # Check if all have the same shape
+            shape = values[0].shape
+            if not all(v.shape == shape for v in values):
+                values, _ = pad_to_max(values, 0)
+            else:
+                values = torch.stack(values, dim=0)
+
+        # Stack the values
+        collated[key] = values
+
+    return collated
+
+
+class PredictionDataset(torch.utils.data.Dataset):
+    """Base iterable dataset."""
+
+    def __init__(
+        self,
+        manifest: Manifest,
+        target_dir: Path,
+        msa_dir: Path,
+        mol_dir: Path,
+        constraints_dir: Optional[Path] = None,
+        template_dir: Optional[Path] = None,
+        extra_mols_dir: Optional[Path] = None,
+        override_method: Optional[str] = None,
+        affinity: bool = False,
+    ) -> None:
+        """Initialize the training dataset.
+
+        Parameters
+        ----------
+        manifest : Manifest
+            The manifest to load data from.
+        target_dir : Path
+            The path to the target directory.
+        msa_dir : Path
+            The path to the msa directory.
+        mol_dir : Path
+            The path to the moldir.
+        constraints_dir : Optional[Path]
+            The path to the constraints directory.
+        template_dir : Optional[Path]
+            The path to the template directory.
+
+        """
+        super().__init__()
+        self.manifest = manifest
+        self.target_dir = target_dir
+        self.msa_dir = msa_dir
+        self.mol_dir = mol_dir
+        self.constraints_dir = constraints_dir
+        self.template_dir = template_dir
+        self.tokenizer = Boltz2Tokenizer()
+        self.featurizer = Boltz2Featurizer()
+        self.canonicals = load_canonicals(self.mol_dir)
+        self.extra_mols_dir = extra_mols_dir
+        self.override_method = override_method
+        self.affinity = affinity
+        if self.affinity:
+            self.cropper = AffinityCropper()
+
+    def __getitem__(self, idx: int) -> dict:
+        """Get an item from the dataset.
+
+        Returns
+        -------
+        Dict[str, Tensor]
+            The sampled data features.
+
+        """
+        # Get record
+        record = self.manifest.records[idx]
+
+        # Finalize input data
+        input_data = load_input(
+            record=record,
+            target_dir=self.target_dir,
+            msa_dir=self.msa_dir,
+            constraints_dir=self.constraints_dir,
+            template_dir=self.template_dir,
+            extra_mols_dir=self.extra_mols_dir,
+            affinity=self.affinity,
+        )
+
+        # Tokenize structure
+        try:
+            tokenized = self.tokenizer.tokenize(input_data)
+        except Exception as e:  # noqa: BLE001
+            print(  # noqa: T201
+                f"Tokenizer failed on {record.id} with error {e}. Skipping."
+            )
+            return self.__getitem__(0)
+
+        if self.affinity:
+            try:
+                tokenized = self.cropper.crop(
+                    tokenized,
+                    max_tokens=256,
+                    max_atoms=2048,
+                )
+            except Exception as e:  # noqa: BLE001
+                print(f"Cropper failed on {record.id} with error {e}. Skipping.")  # noqa: T201
+                return self.__getitem__(0)
+
+        # Load conformers
+        try:
+            molecules = {}
+            molecules.update(self.canonicals)
+            molecules.update(input_data.extra_mols)
+            mol_names = set(tokenized.tokens["res_name"].tolist())
+            mol_names = mol_names - set(molecules.keys())
+            molecules.update(load_molecules(self.mol_dir, mol_names))
+        except Exception as e:  # noqa: BLE001
+            print(f"Molecule loading failed for {record.id} with error {e}. Skipping.")
+            return self.__getitem__(0)
+
+        # Inference specific options
+        options = record.inference_options
+        if options is None:
+            pocket_constraints, contact_constraints = None, None
+        else:
+            pocket_constraints, contact_constraints = (
+                options.pocket_constraints,
+                options.contact_constraints,
+            )
+
+        # Get random seed
+        seed = 42
+        random = np.random.default_rng(seed)
+
+        # Compute features
+        try:
+            features = self.featurizer.process(
+                tokenized,
+                molecules=molecules,
+                random=random,
+                training=False,
+                max_atoms=None,
+                max_tokens=None,
+                max_seqs=const.max_msa_seqs,
+                pad_to_max_seqs=False,
+                single_sequence_prop=0.0,
+                compute_frames=True,
+                inference_pocket_constraints=pocket_constraints,
+                inference_contact_constraints=contact_constraints,
+                compute_constraint_features=True,
+                override_method=self.override_method,
+                compute_affinity=self.affinity,
+            )
+        except Exception as e:  # noqa: BLE001
+            import traceback
+
+            traceback.print_exc()
+            print(f"Featurizer failed on {record.id} with error {e}. Skipping.")  # noqa: T201
+            return self.__getitem__(0)
+
+        # Add record
+        features["record"] = record
+        return features
+
+    def __len__(self) -> int:
+        """Get the length of the dataset.
+
+        Returns
+        -------
+        int
+            The length of the dataset.
+
+        """
+        return len(self.manifest.records)
+
+
+class Boltz2InferenceDataModule(pl.LightningDataModule):
+    """DataModule for Boltz2 inference."""
+
+    def __init__(
+        self,
+        manifest: Manifest,
+        target_dir: Path,
+        msa_dir: Path,
+        mol_dir: Path,
+        num_workers: int,
+        constraints_dir: Optional[Path] = None,
+        template_dir: Optional[Path] = None,
+        extra_mols_dir: Optional[Path] = None,
+        override_method: Optional[str] = None,
+        affinity: bool = False,
+    ) -> None:
+        """Initialize the DataModule.
+
+        Parameters
+        ----------
+        manifest : Manifest
+            The manifest to load data from.
+        target_dir : Path
+            The path to the target directory.
+        msa_dir : Path
+            The path to the msa directory.
+        mol_dir : Path
+            The path to the moldir.
+        num_workers : int
+            The number of workers to use.
+        constraints_dir : Optional[Path]
+            The path to the constraints directory.
+        template_dir : Optional[Path]
+            The path to the template directory.
+        extra_mols_dir : Optional[Path]
+            The path to the extra molecules directory.
+        override_method : Optional[str]
+            The method to override.
+
+        """
+        super().__init__()
+        self.num_workers = num_workers
+        self.manifest = manifest
+        self.target_dir = target_dir
+        self.msa_dir = msa_dir
+        self.mol_dir = mol_dir
+        self.constraints_dir = constraints_dir
+        self.template_dir = template_dir
+        self.extra_mols_dir = extra_mols_dir
+        self.override_method = override_method
+        self.affinity = affinity
+
+    def predict_dataloader(self) -> DataLoader:
+        """Get the training dataloader.
+
+        Returns
+        -------
+        DataLoader
+            The training dataloader.
+
+        """
+        dataset = PredictionDataset(
+            manifest=self.manifest,
+            target_dir=self.target_dir,
+            msa_dir=self.msa_dir,
+            mol_dir=self.mol_dir,
+            constraints_dir=self.constraints_dir,
+            template_dir=self.template_dir,
+            extra_mols_dir=self.extra_mols_dir,
+            override_method=self.override_method,
+            affinity=self.affinity,
+        )
+        return DataLoader(
+            dataset,
+            batch_size=1,
+            num_workers=self.num_workers,
+            pin_memory=True,
+            shuffle=False,
+            collate_fn=collate,
+        )
+
+    def transfer_batch_to_device(
+        self,
+        batch: dict,
+        device: torch.device,
+        dataloader_idx: int,  # noqa: ARG002
+    ) -> dict:
+        """Transfer a batch to the given device.
+
+        Parameters
+        ----------
+        batch : Dict
+            The batch to transfer.
+        device : torch.device
+            The device to transfer to.
+        dataloader_idx : int
+            The dataloader index.
+
+        Returns
+        -------
+        np.Any
+            The transferred batch.
+
+        """
+        for key in batch:
+            if key not in [
+                "all_coords",
+                "all_resolved_mask",
+                "crop_to_all_atom_map",
+                "chain_symmetries",
+                "amino_acids_symmetries",
+                "ligand_symmetries",
+                "record",
+                "affinity_mw",
+            ]:
+                batch[key] = batch[key].to(device)
+        return batch
diff --git a/forks/boltz/src/boltz/data/module/training.py b/forks/boltz/src/boltz/data/module/training.py
new file mode 100644
index 00000000..36583b6c
--- /dev/null
+++ b/forks/boltz/src/boltz/data/module/training.py
@@ -0,0 +1,687 @@
+from dataclasses import dataclass
+from pathlib import Path
+from typing import Optional
+
+import numpy as np
+import pytorch_lightning as pl
+import torch
+from torch import Tensor
+from torch.utils.data import DataLoader
+
+from boltz.data.crop.cropper import Cropper
+from boltz.data.feature.featurizer import BoltzFeaturizer
+from boltz.data.feature.symmetry import get_symmetries
+from boltz.data.filter.dynamic.filter import DynamicFilter
+from boltz.data.pad import pad_to_max
+from boltz.data.sample.sampler import Sample, Sampler
+from boltz.data.tokenize.tokenizer import Tokenizer
+from boltz.data.types import MSA, Connection, Input, Manifest, Record, Structure
+
+
+@dataclass
+class DatasetConfig:
+    """Dataset configuration."""
+
+    target_dir: str
+    msa_dir: str
+    prob: float
+    sampler: Sampler
+    cropper: Cropper
+    filters: Optional[list] = None
+    split: Optional[str] = None
+    manifest_path: Optional[str] = None
+
+
+@dataclass
+class DataConfig:
+    """Data configuration."""
+
+    datasets: list[DatasetConfig]
+    filters: list[DynamicFilter]
+    featurizer: BoltzFeaturizer
+    tokenizer: Tokenizer
+    max_atoms: int
+    max_tokens: int
+    max_seqs: int
+    samples_per_epoch: int
+    batch_size: int
+    num_workers: int
+    random_seed: int
+    pin_memory: bool
+    symmetries: str
+    atoms_per_window_queries: int
+    min_dist: float
+    max_dist: float
+    num_bins: int
+    overfit: Optional[int] = None
+    pad_to_max_tokens: bool = False
+    pad_to_max_atoms: bool = False
+    pad_to_max_seqs: bool = False
+    crop_validation: bool = False
+    return_train_symmetries: bool = False
+    return_val_symmetries: bool = True
+    train_binder_pocket_conditioned_prop: float = 0.0
+    val_binder_pocket_conditioned_prop: float = 0.0
+    binder_pocket_cutoff: float = 6.0
+    binder_pocket_sampling_geometric_p: float = 0.0
+    val_batch_size: int = 1
+    compute_constraint_features: bool = False
+
+
+@dataclass
+class Dataset:
+    """Data holder."""
+
+    target_dir: Path
+    msa_dir: Path
+    manifest: Manifest
+    prob: float
+    sampler: Sampler
+    cropper: Cropper
+    tokenizer: Tokenizer
+    featurizer: BoltzFeaturizer
+
+
+def load_input(record: Record, target_dir: Path, msa_dir: Path) -> Input:
+    """Load the given input data.
+
+    Parameters
+    ----------
+    record : Record
+        The record to load.
+    target_dir : Path
+        The path to the data directory.
+    msa_dir : Path
+        The path to msa directory.
+
+    Returns
+    -------
+    Input
+        The loaded input.
+
+    """
+    # Load the structure
+    structure = np.load(target_dir / "structures" / f"{record.id}.npz")
+
+    # In order to add cyclic_period to chains if it does not exist
+    # Extract the chains array
+    chains = structure["chains"]
+    # Check if the field exists
+    if "cyclic_period" not in chains.dtype.names:
+        # Create a new dtype with the additional field
+        new_dtype = chains.dtype.descr + [("cyclic_period", "i4")]
+        # Create a new array with the new dtype
+        new_chains = np.empty(chains.shape, dtype=new_dtype)
+        # Copy over existing fields
+        for name in chains.dtype.names:
+            new_chains[name] = chains[name]
+        # Set the new field to 0
+        new_chains["cyclic_period"] = 0
+        # Replace old chains array with new one
+        chains = new_chains
+
+    structure = Structure(
+        atoms=structure["atoms"],
+        bonds=structure["bonds"],
+        residues=structure["residues"],
+        chains=chains,  # chains var accounting for missing cyclic_period
+        connections=structure["connections"].astype(Connection),
+        interfaces=structure["interfaces"],
+        mask=structure["mask"],
+    )
+
+    msas = {}
+    for chain in record.chains:
+        msa_id = chain.msa_id
+        # Load the MSA for this chain, if any
+        if msa_id != -1 and msa_id != "":
+            msa = np.load(msa_dir / f"{msa_id}.npz")
+            msas[chain.chain_id] = MSA(**msa)
+
+    return Input(structure, msas)
+
+
+def collate(data: list[dict[str, Tensor]]) -> dict[str, Tensor]:
+    """Collate the data.
+
+    Parameters
+    ----------
+    data : list[dict[str, Tensor]]
+        The data to collate.
+
+    Returns
+    -------
+    dict[str, Tensor]
+        The collated data.
+
+    """
+    # Get the keys
+    keys = data[0].keys()
+
+    # Collate the data
+    collated = {}
+    for key in keys:
+        values = [d[key] for d in data]
+
+        if key not in [
+            "all_coords",
+            "all_resolved_mask",
+            "crop_to_all_atom_map",
+            "chain_symmetries",
+            "amino_acids_symmetries",
+            "ligand_symmetries",
+        ]:
+            # Check if all have the same shape
+            shape = values[0].shape
+            if not all(v.shape == shape for v in values):
+                values, _ = pad_to_max(values, 0)
+            else:
+                values = torch.stack(values, dim=0)
+
+        # Stack the values
+        collated[key] = values
+
+    return collated
+
+
+class TrainingDataset(torch.utils.data.Dataset):
+    """Base iterable dataset."""
+
+    def __init__(
+        self,
+        datasets: list[Dataset],
+        samples_per_epoch: int,
+        symmetries: dict,
+        max_atoms: int,
+        max_tokens: int,
+        max_seqs: int,
+        pad_to_max_atoms: bool = False,
+        pad_to_max_tokens: bool = False,
+        pad_to_max_seqs: bool = False,
+        atoms_per_window_queries: int = 32,
+        min_dist: float = 2.0,
+        max_dist: float = 22.0,
+        num_bins: int = 64,
+        overfit: Optional[int] = None,
+        binder_pocket_conditioned_prop: Optional[float] = 0.0,
+        binder_pocket_cutoff: Optional[float] = 6.0,
+        binder_pocket_sampling_geometric_p: Optional[float] = 0.0,
+        return_symmetries: Optional[bool] = False,
+        compute_constraint_features: bool = False,
+    ) -> None:
+        """Initialize the training dataset."""
+        super().__init__()
+        self.datasets = datasets
+        self.probs = [d.prob for d in datasets]
+        self.samples_per_epoch = samples_per_epoch
+        self.symmetries = symmetries
+        self.max_tokens = max_tokens
+        self.max_seqs = max_seqs
+        self.max_atoms = max_atoms
+        self.pad_to_max_tokens = pad_to_max_tokens
+        self.pad_to_max_atoms = pad_to_max_atoms
+        self.pad_to_max_seqs = pad_to_max_seqs
+        self.atoms_per_window_queries = atoms_per_window_queries
+        self.min_dist = min_dist
+        self.max_dist = max_dist
+        self.num_bins = num_bins
+        self.binder_pocket_conditioned_prop = binder_pocket_conditioned_prop
+        self.binder_pocket_cutoff = binder_pocket_cutoff
+        self.binder_pocket_sampling_geometric_p = binder_pocket_sampling_geometric_p
+        self.return_symmetries = return_symmetries
+        self.compute_constraint_features = compute_constraint_features
+        self.samples = []
+        for dataset in datasets:
+            records = dataset.manifest.records
+            if overfit is not None:
+                records = records[:overfit]
+            iterator = dataset.sampler.sample(records, np.random)
+            self.samples.append(iterator)
+
+    def __getitem__(self, idx: int) -> dict[str, Tensor]:
+        """Get an item from the dataset.
+
+        Parameters
+        ----------
+        idx : int
+            The data index.
+
+        Returns
+        -------
+        dict[str, Tensor]
+            The sampled data features.
+
+        """
+        # Pick a random dataset
+        dataset_idx = np.random.choice(
+            len(self.datasets),
+            p=self.probs,
+        )
+        dataset = self.datasets[dataset_idx]
+
+        # Get a sample from the dataset
+        sample: Sample = next(self.samples[dataset_idx])
+
+        # Get the structure
+        try:
+            input_data = load_input(sample.record, dataset.target_dir, dataset.msa_dir)
+        except Exception as e:
+            print(
+                f"Failed to load input for {sample.record.id} with error {e}. Skipping."
+            )
+            return self.__getitem__(idx)
+
+        # Tokenize structure
+        try:
+            tokenized = dataset.tokenizer.tokenize(input_data)
+        except Exception as e:
+            print(f"Tokenizer failed on {sample.record.id} with error {e}. Skipping.")
+            return self.__getitem__(idx)
+
+        # Compute crop
+        try:
+            if self.max_tokens is not None:
+                tokenized = dataset.cropper.crop(
+                    tokenized,
+                    max_atoms=self.max_atoms,
+                    max_tokens=self.max_tokens,
+                    random=np.random,
+                    chain_id=sample.chain_id,
+                    interface_id=sample.interface_id,
+                )
+        except Exception as e:
+            print(f"Cropper failed on {sample.record.id} with error {e}. Skipping.")
+            return self.__getitem__(idx)
+
+        # Check if there are tokens
+        if len(tokenized.tokens) == 0:
+            msg = "No tokens in cropped structure."
+            raise ValueError(msg)
+
+        # Compute features
+        try:
+            features = dataset.featurizer.process(
+                tokenized,
+                training=True,
+                max_atoms=self.max_atoms if self.pad_to_max_atoms else None,
+                max_tokens=self.max_tokens if self.pad_to_max_tokens else None,
+                max_seqs=self.max_seqs,
+                pad_to_max_seqs=self.pad_to_max_seqs,
+                symmetries=self.symmetries,
+                atoms_per_window_queries=self.atoms_per_window_queries,
+                min_dist=self.min_dist,
+                max_dist=self.max_dist,
+                num_bins=self.num_bins,
+                compute_symmetries=self.return_symmetries,
+                binder_pocket_conditioned_prop=self.binder_pocket_conditioned_prop,
+                binder_pocket_cutoff=self.binder_pocket_cutoff,
+                binder_pocket_sampling_geometric_p=self.binder_pocket_sampling_geometric_p,
+                compute_constraint_features=self.compute_constraint_features,
+            )
+        except Exception as e:
+            print(f"Featurizer failed on {sample.record.id} with error {e}. Skipping.")
+            return self.__getitem__(idx)
+
+        return features
+
+    def __len__(self) -> int:
+        """Get the length of the dataset.
+
+        Returns
+        -------
+        int
+            The length of the dataset.
+
+        """
+        return self.samples_per_epoch
+
+
+class ValidationDataset(torch.utils.data.Dataset):
+    """Base iterable dataset."""
+
+    def __init__(
+        self,
+        datasets: list[Dataset],
+        seed: int,
+        symmetries: dict,
+        max_atoms: Optional[int] = None,
+        max_tokens: Optional[int] = None,
+        max_seqs: Optional[int] = None,
+        pad_to_max_atoms: bool = False,
+        pad_to_max_tokens: bool = False,
+        pad_to_max_seqs: bool = False,
+        atoms_per_window_queries: int = 32,
+        min_dist: float = 2.0,
+        max_dist: float = 22.0,
+        num_bins: int = 64,
+        overfit: Optional[int] = None,
+        crop_validation: bool = False,
+        return_symmetries: Optional[bool] = False,
+        binder_pocket_conditioned_prop: Optional[float] = 0.0,
+        binder_pocket_cutoff: Optional[float] = 6.0,
+        compute_constraint_features: bool = False,
+    ) -> None:
+        """Initialize the validation dataset."""
+        super().__init__()
+        self.datasets = datasets
+        self.max_atoms = max_atoms
+        self.max_tokens = max_tokens
+        self.max_seqs = max_seqs
+        self.seed = seed
+        self.symmetries = symmetries
+        self.random = np.random if overfit else np.random.RandomState(self.seed)
+        self.pad_to_max_tokens = pad_to_max_tokens
+        self.pad_to_max_atoms = pad_to_max_atoms
+        self.pad_to_max_seqs = pad_to_max_seqs
+        self.overfit = overfit
+        self.crop_validation = crop_validation
+        self.atoms_per_window_queries = atoms_per_window_queries
+        self.min_dist = min_dist
+        self.max_dist = max_dist
+        self.num_bins = num_bins
+        self.return_symmetries = return_symmetries
+        self.binder_pocket_conditioned_prop = binder_pocket_conditioned_prop
+        self.binder_pocket_cutoff = binder_pocket_cutoff
+        self.compute_constraint_features = compute_constraint_features
+
+    def __getitem__(self, idx: int) -> dict[str, Tensor]:
+        """Get an item from the dataset.
+
+        Parameters
+        ----------
+        idx : int
+            The data index.
+
+        Returns
+        -------
+        dict[str, Tensor]
+            The sampled data features.
+
+        """
+        # Pick dataset based on idx
+        for dataset in self.datasets:
+            size = len(dataset.manifest.records)
+            if self.overfit is not None:
+                size = min(size, self.overfit)
+            if idx < size:
+                break
+            idx -= size
+
+        # Get a sample from the dataset
+        record = dataset.manifest.records[idx]
+
+        # Get the structure
+        try:
+            input_data = load_input(record, dataset.target_dir, dataset.msa_dir)
+        except Exception as e:
+            print(f"Failed to load input for {record.id} with error {e}. Skipping.")
+            return self.__getitem__(0)
+
+        # Tokenize structure
+        try:
+            tokenized = dataset.tokenizer.tokenize(input_data)
+        except Exception as e:
+            print(f"Tokenizer failed on {record.id} with error {e}. Skipping.")
+            return self.__getitem__(0)
+
+        # Compute crop
+        try:
+            if self.crop_validation and (self.max_tokens is not None):
+                tokenized = dataset.cropper.crop(
+                    tokenized,
+                    max_tokens=self.max_tokens,
+                    random=self.random,
+                    max_atoms=self.max_atoms,
+                )
+        except Exception as e:
+            print(f"Cropper failed on {record.id} with error {e}. Skipping.")
+            return self.__getitem__(0)
+
+        # Check if there are tokens
+        if len(tokenized.tokens) == 0:
+            msg = "No tokens in cropped structure."
+            raise ValueError(msg)
+
+        # Compute features
+        try:
+            pad_atoms = self.crop_validation and self.pad_to_max_atoms
+            pad_tokens = self.crop_validation and self.pad_to_max_tokens
+
+            features = dataset.featurizer.process(
+                tokenized,
+                training=False,
+                max_atoms=self.max_atoms if pad_atoms else None,
+                max_tokens=self.max_tokens if pad_tokens else None,
+                max_seqs=self.max_seqs,
+                pad_to_max_seqs=self.pad_to_max_seqs,
+                symmetries=self.symmetries,
+                atoms_per_window_queries=self.atoms_per_window_queries,
+                min_dist=self.min_dist,
+                max_dist=self.max_dist,
+                num_bins=self.num_bins,
+                compute_symmetries=self.return_symmetries,
+                binder_pocket_conditioned_prop=self.binder_pocket_conditioned_prop,
+                binder_pocket_cutoff=self.binder_pocket_cutoff,
+                binder_pocket_sampling_geometric_p=1.0,  # this will only sample a single pocket token
+                only_ligand_binder_pocket=True,
+                compute_constraint_features=self.compute_constraint_features,
+            )
+        except Exception as e:
+            print(f"Featurizer failed on {record.id} with error {e}. Skipping.")
+            return self.__getitem__(0)
+
+        return features
+
+    def __len__(self) -> int:
+        """Get the length of the dataset.
+
+        Returns
+        -------
+        int
+            The length of the dataset.
+
+        """
+        if self.overfit is not None:
+            length = sum(len(d.manifest.records[: self.overfit]) for d in self.datasets)
+        else:
+            length = sum(len(d.manifest.records) for d in self.datasets)
+
+        return length
+
+
+class BoltzTrainingDataModule(pl.LightningDataModule):
+    """DataModule for boltz."""
+
+    def __init__(self, cfg: DataConfig) -> None:
+        """Initialize the DataModule.
+
+        Parameters
+        ----------
+        config : DataConfig
+            The data configuration.
+
+        """
+        super().__init__()
+        self.cfg = cfg
+
+        assert self.cfg.val_batch_size == 1, "Validation only works with batch size=1."
+
+        # Load symmetries
+        symmetries = get_symmetries(cfg.symmetries)
+
+        # Load datasets
+        train: list[Dataset] = []
+        val: list[Dataset] = []
+
+        for data_config in cfg.datasets:
+            # Set target_dir
+            target_dir = Path(data_config.target_dir)
+            msa_dir = Path(data_config.msa_dir)
+
+            # Load manifest
+            if data_config.manifest_path is not None:
+                path = Path(data_config.manifest_path)
+            else:
+                path = target_dir / "manifest.json"
+            manifest: Manifest = Manifest.load(path)
+
+            # Split records if given
+            if data_config.split is not None:
+                with Path(data_config.split).open("r") as f:
+                    split = {x.lower() for x in f.read().splitlines()}
+
+                train_records = []
+                val_records = []
+                for record in manifest.records:
+                    if record.id.lower() in split:
+                        val_records.append(record)
+                    else:
+                        train_records.append(record)
+            else:
+                train_records = manifest.records
+                val_records = []
+
+            # Filter training records
+            train_records = [
+                record
+                for record in train_records
+                if all(f.filter(record) for f in cfg.filters)
+            ]
+            # Filter training records
+            if data_config.filters is not None:
+                train_records = [
+                    record
+                    for record in train_records
+                    if all(f.filter(record) for f in data_config.filters)
+                ]
+
+            # Create train dataset
+            train_manifest = Manifest(train_records)
+            train.append(
+                Dataset(
+                    target_dir,
+                    msa_dir,
+                    train_manifest,
+                    data_config.prob,
+                    data_config.sampler,
+                    data_config.cropper,
+                    cfg.tokenizer,
+                    cfg.featurizer,
+                )
+            )
+
+            # Create validation dataset
+            if val_records:
+                val_manifest = Manifest(val_records)
+                val.append(
+                    Dataset(
+                        target_dir,
+                        msa_dir,
+                        val_manifest,
+                        data_config.prob,
+                        data_config.sampler,
+                        data_config.cropper,
+                        cfg.tokenizer,
+                        cfg.featurizer,
+                    )
+                )
+
+        # Print dataset sizes
+        for dataset in train:
+            dataset: Dataset
+            print(f"Training dataset size: {len(dataset.manifest.records)}")
+
+        for dataset in val:
+            dataset: Dataset
+            print(f"Validation dataset size: {len(dataset.manifest.records)}")
+
+        # Create wrapper datasets
+        self._train_set = TrainingDataset(
+            datasets=train,
+            samples_per_epoch=cfg.samples_per_epoch,
+            max_atoms=cfg.max_atoms,
+            max_tokens=cfg.max_tokens,
+            max_seqs=cfg.max_seqs,
+            pad_to_max_atoms=cfg.pad_to_max_atoms,
+            pad_to_max_tokens=cfg.pad_to_max_tokens,
+            pad_to_max_seqs=cfg.pad_to_max_seqs,
+            symmetries=symmetries,
+            atoms_per_window_queries=cfg.atoms_per_window_queries,
+            min_dist=cfg.min_dist,
+            max_dist=cfg.max_dist,
+            num_bins=cfg.num_bins,
+            overfit=cfg.overfit,
+            binder_pocket_conditioned_prop=cfg.train_binder_pocket_conditioned_prop,
+            binder_pocket_cutoff=cfg.binder_pocket_cutoff,
+            binder_pocket_sampling_geometric_p=cfg.binder_pocket_sampling_geometric_p,
+            return_symmetries=cfg.return_train_symmetries,
+            compute_constraint_features=cfg.compute_constraint_features,
+        )
+        self._val_set = ValidationDataset(
+            datasets=train if cfg.overfit is not None else val,
+            seed=cfg.random_seed,
+            max_atoms=cfg.max_atoms,
+            max_tokens=cfg.max_tokens,
+            max_seqs=cfg.max_seqs,
+            pad_to_max_atoms=cfg.pad_to_max_atoms,
+            pad_to_max_tokens=cfg.pad_to_max_tokens,
+            pad_to_max_seqs=cfg.pad_to_max_seqs,
+            symmetries=symmetries,
+            atoms_per_window_queries=cfg.atoms_per_window_queries,
+            min_dist=cfg.min_dist,
+            max_dist=cfg.max_dist,
+            num_bins=cfg.num_bins,
+            overfit=cfg.overfit,
+            crop_validation=cfg.crop_validation,
+            return_symmetries=cfg.return_val_symmetries,
+            binder_pocket_conditioned_prop=cfg.val_binder_pocket_conditioned_prop,
+            binder_pocket_cutoff=cfg.binder_pocket_cutoff,
+            compute_constraint_features=cfg.compute_constraint_features,
+        )
+
+    def setup(self, stage: Optional[str] = None) -> None:
+        """Run the setup for the DataModule.
+
+        Parameters
+        ----------
+        stage : str, optional
+            The stage, one of 'fit', 'validate', 'test'.
+
+        """
+        return
+
+    def train_dataloader(self) -> DataLoader:
+        """Get the training dataloader.
+
+        Returns
+        -------
+        DataLoader
+            The training dataloader.
+
+        """
+        return DataLoader(
+            self._train_set,
+            batch_size=self.cfg.batch_size,
+            num_workers=self.cfg.num_workers,
+            pin_memory=self.cfg.pin_memory,
+            shuffle=False,
+            collate_fn=collate,
+        )
+
+    def val_dataloader(self) -> DataLoader:
+        """Get the validation dataloader.
+
+        Returns
+        -------
+        DataLoader
+            The validation dataloader.
+
+        """
+        return DataLoader(
+            self._val_set,
+            batch_size=self.cfg.val_batch_size,
+            num_workers=self.cfg.num_workers,
+            pin_memory=self.cfg.pin_memory,
+            shuffle=False,
+            collate_fn=collate,
+        )
diff --git a/forks/boltz/src/boltz/data/module/trainingv2.py b/forks/boltz/src/boltz/data/module/trainingv2.py
new file mode 100644
index 00000000..2141db17
--- /dev/null
+++ b/forks/boltz/src/boltz/data/module/trainingv2.py
@@ -0,0 +1,660 @@
+from dataclasses import dataclass
+from pathlib import Path
+from typing import Optional
+
+import numpy as np
+import pytorch_lightning as pl
+import torch
+from torch import Tensor
+from torch.utils.data import DataLoader
+
+from boltz.data.crop.cropper import Cropper
+from boltz.data.feature.featurizer import BoltzFeaturizer
+from boltz.data.feature.symmetry import get_symmetries
+from boltz.data.filter.dynamic.filter import DynamicFilter
+from boltz.data.pad import pad_to_max
+from boltz.data.sample.sampler import Sample, Sampler
+from boltz.data.tokenize.tokenizer import Tokenizer
+from boltz.data.types import MSA, Connection, Input, Manifest, Record, Structure
+
+
+@dataclass
+class DatasetConfig:
+    """Dataset configuration."""
+
+    target_dir: str
+    msa_dir: str
+    prob: float
+    sampler: Sampler
+    cropper: Cropper
+    filters: Optional[list] = None
+    split: Optional[str] = None
+    manifest_path: Optional[str] = None
+
+
+@dataclass
+class DataConfig:
+    """Data configuration."""
+
+    datasets: list[DatasetConfig]
+    filters: list[DynamicFilter]
+    featurizer: BoltzFeaturizer
+    tokenizer: Tokenizer
+    max_atoms: int
+    max_tokens: int
+    max_seqs: int
+    samples_per_epoch: int
+    batch_size: int
+    num_workers: int
+    random_seed: int
+    pin_memory: bool
+    symmetries: str
+    atoms_per_window_queries: int
+    min_dist: float
+    max_dist: float
+    num_bins: int
+    overfit: Optional[int] = None
+    pad_to_max_tokens: bool = False
+    pad_to_max_atoms: bool = False
+    pad_to_max_seqs: bool = False
+    crop_validation: bool = False
+    return_train_symmetries: bool = False
+    return_val_symmetries: bool = True
+    train_binder_pocket_conditioned_prop: float = 0.0
+    val_binder_pocket_conditioned_prop: float = 0.0
+    binder_pocket_cutoff: float = 6.0
+    binder_pocket_sampling_geometric_p: float = 0.0
+    val_batch_size: int = 1
+
+
+@dataclass
+class Dataset:
+    """Data holder."""
+
+    target_dir: Path
+    msa_dir: Path
+    manifest: Manifest
+    prob: float
+    sampler: Sampler
+    cropper: Cropper
+    tokenizer: Tokenizer
+    featurizer: BoltzFeaturizer
+
+
+def load_input(record: Record, target_dir: Path, msa_dir: Path) -> Input:
+    """Load the given input data.
+
+    Parameters
+    ----------
+    record : Record
+        The record to load.
+    target_dir : Path
+        The path to the data directory.
+    msa_dir : Path
+        The path to msa directory.
+
+    Returns
+    -------
+    Input
+        The loaded input.
+
+    """
+    # Load the structure
+    structure = np.load(target_dir / "structures" / f"{record.id}.npz")
+    structure = Structure(
+        atoms=structure["atoms"],
+        bonds=structure["bonds"],
+        residues=structure["residues"],
+        chains=structure["chains"],
+        connections=structure["connections"].astype(Connection),
+        interfaces=structure["interfaces"],
+        mask=structure["mask"],
+    )
+
+    msas = {}
+    for chain in record.chains:
+        msa_id = chain.msa_id
+        # Load the MSA for this chain, if any
+        if msa_id != -1 and msa_id != "":
+            msa = np.load(msa_dir / f"{msa_id}.npz")
+            msas[chain.chain_id] = MSA(**msa)
+
+    return Input(structure, msas)
+
+
+def collate(data: list[dict[str, Tensor]]) -> dict[str, Tensor]:
+    """Collate the data.
+
+    Parameters
+    ----------
+    data : list[dict[str, Tensor]]
+        The data to collate.
+
+    Returns
+    -------
+    dict[str, Tensor]
+        The collated data.
+
+    """
+    # Get the keys
+    keys = data[0].keys()
+
+    # Collate the data
+    collated = {}
+    for key in keys:
+        values = [d[key] for d in data]
+
+        if key not in [
+            "all_coords",
+            "all_resolved_mask",
+            "crop_to_all_atom_map",
+            "chain_symmetries",
+            "amino_acids_symmetries",
+            "ligand_symmetries",
+        ]:
+            # Check if all have the same shape
+            shape = values[0].shape
+            if not all(v.shape == shape for v in values):
+                values, _ = pad_to_max(values, 0)
+            else:
+                values = torch.stack(values, dim=0)
+
+        # Stack the values
+        collated[key] = values
+
+    return collated
+
+
+class TrainingDataset(torch.utils.data.Dataset):
+    """Base iterable dataset."""
+
+    def __init__(
+        self,
+        datasets: list[Dataset],
+        samples_per_epoch: int,
+        symmetries: dict,
+        max_atoms: int,
+        max_tokens: int,
+        max_seqs: int,
+        pad_to_max_atoms: bool = False,
+        pad_to_max_tokens: bool = False,
+        pad_to_max_seqs: bool = False,
+        atoms_per_window_queries: int = 32,
+        min_dist: float = 2.0,
+        max_dist: float = 22.0,
+        num_bins: int = 64,
+        overfit: Optional[int] = None,
+        binder_pocket_conditioned_prop: Optional[float] = 0.0,
+        binder_pocket_cutoff: Optional[float] = 6.0,
+        binder_pocket_sampling_geometric_p: Optional[float] = 0.0,
+        return_symmetries: Optional[bool] = False,
+    ) -> None:
+        """Initialize the training dataset."""
+        super().__init__()
+        self.datasets = datasets
+        self.probs = [d.prob for d in datasets]
+        self.samples_per_epoch = samples_per_epoch
+        self.symmetries = symmetries
+        self.max_tokens = max_tokens
+        self.max_seqs = max_seqs
+        self.max_atoms = max_atoms
+        self.pad_to_max_tokens = pad_to_max_tokens
+        self.pad_to_max_atoms = pad_to_max_atoms
+        self.pad_to_max_seqs = pad_to_max_seqs
+        self.atoms_per_window_queries = atoms_per_window_queries
+        self.min_dist = min_dist
+        self.max_dist = max_dist
+        self.num_bins = num_bins
+        self.binder_pocket_conditioned_prop = binder_pocket_conditioned_prop
+        self.binder_pocket_cutoff = binder_pocket_cutoff
+        self.binder_pocket_sampling_geometric_p = binder_pocket_sampling_geometric_p
+        self.return_symmetries = return_symmetries
+        self.samples = []
+        for dataset in datasets:
+            records = dataset.manifest.records
+            if overfit is not None:
+                records = records[:overfit]
+            iterator = dataset.sampler.sample(records, np.random)
+            self.samples.append(iterator)
+
+    def __getitem__(self, idx: int) -> dict[str, Tensor]:
+        """Get an item from the dataset.
+
+        Parameters
+        ----------
+        idx : int
+            The data index.
+
+        Returns
+        -------
+        dict[str, Tensor]
+            The sampled data features.
+
+        """
+        # Pick a random dataset
+        dataset_idx = np.random.choice(
+            len(self.datasets),
+            p=self.probs,
+        )
+        dataset = self.datasets[dataset_idx]
+
+        # Get a sample from the dataset
+        sample: Sample = next(self.samples[dataset_idx])
+
+        # Get the structure
+        try:
+            input_data = load_input(sample.record, dataset.target_dir, dataset.msa_dir)
+        except Exception as e:
+            print(
+                f"Failed to load input for {sample.record.id} with error {e}. Skipping."
+            )
+            return self.__getitem__(idx)
+
+        # Tokenize structure
+        try:
+            tokenized = dataset.tokenizer.tokenize(input_data)
+        except Exception as e:
+            print(f"Tokenizer failed on {sample.record.id} with error {e}. Skipping.")
+            return self.__getitem__(idx)
+
+        # Compute crop
+        try:
+            if self.max_tokens is not None:
+                tokenized = dataset.cropper.crop(
+                    tokenized,
+                    max_atoms=self.max_atoms,
+                    max_tokens=self.max_tokens,
+                    random=np.random,
+                    chain_id=sample.chain_id,
+                    interface_id=sample.interface_id,
+                )
+        except Exception as e:
+            print(f"Cropper failed on {sample.record.id} with error {e}. Skipping.")
+            return self.__getitem__(idx)
+
+        # Check if there are tokens
+        if len(tokenized.tokens) == 0:
+            msg = "No tokens in cropped structure."
+            raise ValueError(msg)
+
+        # Compute features
+        try:
+            features = dataset.featurizer.process(
+                tokenized,
+                training=True,
+                max_atoms=self.max_atoms if self.pad_to_max_atoms else None,
+                max_tokens=self.max_tokens if self.pad_to_max_tokens else None,
+                max_seqs=self.max_seqs,
+                pad_to_max_seqs=self.pad_to_max_seqs,
+                symmetries=self.symmetries,
+                atoms_per_window_queries=self.atoms_per_window_queries,
+                min_dist=self.min_dist,
+                max_dist=self.max_dist,
+                num_bins=self.num_bins,
+                compute_symmetries=self.return_symmetries,
+                binder_pocket_conditioned_prop=self.binder_pocket_conditioned_prop,
+                binder_pocket_cutoff=self.binder_pocket_cutoff,
+                binder_pocket_sampling_geometric_p=self.binder_pocket_sampling_geometric_p,
+            )
+        except Exception as e:
+            print(f"Featurizer failed on {sample.record.id} with error {e}. Skipping.")
+            return self.__getitem__(idx)
+
+        return features
+
+    def __len__(self) -> int:
+        """Get the length of the dataset.
+
+        Returns
+        -------
+        int
+            The length of the dataset.
+
+        """
+        return self.samples_per_epoch
+
+
+class ValidationDataset(torch.utils.data.Dataset):
+    """Base iterable dataset."""
+
+    def __init__(
+        self,
+        datasets: list[Dataset],
+        seed: int,
+        symmetries: dict,
+        max_atoms: Optional[int] = None,
+        max_tokens: Optional[int] = None,
+        max_seqs: Optional[int] = None,
+        pad_to_max_atoms: bool = False,
+        pad_to_max_tokens: bool = False,
+        pad_to_max_seqs: bool = False,
+        atoms_per_window_queries: int = 32,
+        min_dist: float = 2.0,
+        max_dist: float = 22.0,
+        num_bins: int = 64,
+        overfit: Optional[int] = None,
+        crop_validation: bool = False,
+        return_symmetries: Optional[bool] = False,
+        binder_pocket_conditioned_prop: Optional[float] = 0.0,
+        binder_pocket_cutoff: Optional[float] = 6.0,
+    ) -> None:
+        """Initialize the validation dataset."""
+        super().__init__()
+        self.datasets = datasets
+        self.max_atoms = max_atoms
+        self.max_tokens = max_tokens
+        self.max_seqs = max_seqs
+        self.seed = seed
+        self.symmetries = symmetries
+        self.random = np.random if overfit else np.random.RandomState(self.seed)
+        self.pad_to_max_tokens = pad_to_max_tokens
+        self.pad_to_max_atoms = pad_to_max_atoms
+        self.pad_to_max_seqs = pad_to_max_seqs
+        self.overfit = overfit
+        self.crop_validation = crop_validation
+        self.atoms_per_window_queries = atoms_per_window_queries
+        self.min_dist = min_dist
+        self.max_dist = max_dist
+        self.num_bins = num_bins
+        self.return_symmetries = return_symmetries
+        self.binder_pocket_conditioned_prop = binder_pocket_conditioned_prop
+        self.binder_pocket_cutoff = binder_pocket_cutoff
+
+    def __getitem__(self, idx: int) -> dict[str, Tensor]:
+        """Get an item from the dataset.
+
+        Parameters
+        ----------
+        idx : int
+            The data index.
+
+        Returns
+        -------
+        dict[str, Tensor]
+            The sampled data features.
+
+        """
+        # Pick dataset based on idx
+        for dataset in self.datasets:
+            size = len(dataset.manifest.records)
+            if self.overfit is not None:
+                size = min(size, self.overfit)
+            if idx < size:
+                break
+            idx -= size
+
+        # Get a sample from the dataset
+        record = dataset.manifest.records[idx]
+
+        # Get the structure
+        try:
+            input_data = load_input(record, dataset.target_dir, dataset.msa_dir)
+        except Exception as e:
+            print(f"Failed to load input for {record.id} with error {e}. Skipping.")
+            return self.__getitem__(0)
+
+        # Tokenize structure
+        try:
+            tokenized = dataset.tokenizer.tokenize(input_data)
+        except Exception as e:
+            print(f"Tokenizer failed on {record.id} with error {e}. Skipping.")
+            return self.__getitem__(0)
+
+        # Compute crop
+        try:
+            if self.crop_validation and (self.max_tokens is not None):
+                tokenized = dataset.cropper.crop(
+                    tokenized,
+                    max_tokens=self.max_tokens,
+                    random=self.random,
+                    max_atoms=self.max_atoms,
+                )
+        except Exception as e:
+            print(f"Cropper failed on {record.id} with error {e}. Skipping.")
+            return self.__getitem__(0)
+
+        # Check if there are tokens
+        if len(tokenized.tokens) == 0:
+            msg = "No tokens in cropped structure."
+            raise ValueError(msg)
+
+        # Compute features
+        try:
+            pad_atoms = self.crop_validation and self.pad_to_max_atoms
+            pad_tokens = self.crop_validation and self.pad_to_max_tokens
+
+            features = dataset.featurizer.process(
+                tokenized,
+                training=False,
+                max_atoms=self.max_atoms if pad_atoms else None,
+                max_tokens=self.max_tokens if pad_tokens else None,
+                max_seqs=self.max_seqs,
+                pad_to_max_seqs=self.pad_to_max_seqs,
+                symmetries=self.symmetries,
+                atoms_per_window_queries=self.atoms_per_window_queries,
+                min_dist=self.min_dist,
+                max_dist=self.max_dist,
+                num_bins=self.num_bins,
+                compute_symmetries=self.return_symmetries,
+                binder_pocket_conditioned_prop=self.binder_pocket_conditioned_prop,
+                binder_pocket_cutoff=self.binder_pocket_cutoff,
+                binder_pocket_sampling_geometric_p=1.0,  # this will only sample a single pocket token
+                only_ligand_binder_pocket=True,
+            )
+        except Exception as e:
+            print(f"Featurizer failed on {record.id} with error {e}. Skipping.")
+            return self.__getitem__(0)
+
+        return features
+
+    def __len__(self) -> int:
+        """Get the length of the dataset.
+
+        Returns
+        -------
+        int
+            The length of the dataset.
+
+        """
+        if self.overfit is not None:
+            length = sum(len(d.manifest.records[: self.overfit]) for d in self.datasets)
+        else:
+            length = sum(len(d.manifest.records) for d in self.datasets)
+
+        return length
+
+
+class BoltzTrainingDataModule(pl.LightningDataModule):
+    """DataModule for boltz."""
+
+    def __init__(self, cfg: DataConfig) -> None:
+        """Initialize the DataModule.
+
+        Parameters
+        ----------
+        config : DataConfig
+            The data configuration.
+
+        """
+        super().__init__()
+        self.cfg = cfg
+
+        assert self.cfg.val_batch_size == 1, "Validation only works with batch size=1."
+
+        # Load symmetries
+        symmetries = get_symmetries(cfg.symmetries)
+
+        # Load datasets
+        train: list[Dataset] = []
+        val: list[Dataset] = []
+
+        for data_config in cfg.datasets:
+            # Set target_dir
+            target_dir = Path(data_config.target_dir)
+            msa_dir = Path(data_config.msa_dir)
+
+            # Load manifest
+            if data_config.manifest_path is not None:
+                path = Path(data_config.manifest_path)
+            else:
+                path = target_dir / "manifest.json"
+            manifest: Manifest = Manifest.load(path)
+
+            # Split records if given
+            if data_config.split is not None:
+                with Path(data_config.split).open("r") as f:
+                    split = {x.lower() for x in f.read().splitlines()}
+
+                train_records = []
+                val_records = []
+                for record in manifest.records:
+                    if record.id.lower() in split:
+                        val_records.append(record)
+                    else:
+                        train_records.append(record)
+            else:
+                train_records = manifest.records
+                val_records = []
+
+            # Filter training records
+            train_records = [
+                record
+                for record in train_records
+                if all(f.filter(record) for f in cfg.filters)
+            ]
+            # Filter training records
+            if data_config.filters is not None:
+                train_records = [
+                    record
+                    for record in train_records
+                    if all(f.filter(record) for f in data_config.filters)
+                ]
+
+            # Create train dataset
+            train_manifest = Manifest(train_records)
+            train.append(
+                Dataset(
+                    target_dir,
+                    msa_dir,
+                    train_manifest,
+                    data_config.prob,
+                    data_config.sampler,
+                    data_config.cropper,
+                    cfg.tokenizer,
+                    cfg.featurizer,
+                )
+            )
+
+            # Create validation dataset
+            if val_records:
+                val_manifest = Manifest(val_records)
+                val.append(
+                    Dataset(
+                        target_dir,
+                        msa_dir,
+                        val_manifest,
+                        data_config.prob,
+                        data_config.sampler,
+                        data_config.cropper,
+                        cfg.tokenizer,
+                        cfg.featurizer,
+                    )
+                )
+
+        # Print dataset sizes
+        for dataset in train:
+            dataset: Dataset
+            print(f"Training dataset size: {len(dataset.manifest.records)}")
+
+        for dataset in val:
+            dataset: Dataset
+            print(f"Validation dataset size: {len(dataset.manifest.records)}")
+
+        # Create wrapper datasets
+        self._train_set = TrainingDataset(
+            datasets=train,
+            samples_per_epoch=cfg.samples_per_epoch,
+            max_atoms=cfg.max_atoms,
+            max_tokens=cfg.max_tokens,
+            max_seqs=cfg.max_seqs,
+            pad_to_max_atoms=cfg.pad_to_max_atoms,
+            pad_to_max_tokens=cfg.pad_to_max_tokens,
+            pad_to_max_seqs=cfg.pad_to_max_seqs,
+            symmetries=symmetries,
+            atoms_per_window_queries=cfg.atoms_per_window_queries,
+            min_dist=cfg.min_dist,
+            max_dist=cfg.max_dist,
+            num_bins=cfg.num_bins,
+            overfit=cfg.overfit,
+            binder_pocket_conditioned_prop=cfg.train_binder_pocket_conditioned_prop,
+            binder_pocket_cutoff=cfg.binder_pocket_cutoff,
+            binder_pocket_sampling_geometric_p=cfg.binder_pocket_sampling_geometric_p,
+            return_symmetries=cfg.return_train_symmetries,
+        )
+        self._val_set = ValidationDataset(
+            datasets=train if cfg.overfit is not None else val,
+            seed=cfg.random_seed,
+            max_atoms=cfg.max_atoms,
+            max_tokens=cfg.max_tokens,
+            max_seqs=cfg.max_seqs,
+            pad_to_max_atoms=cfg.pad_to_max_atoms,
+            pad_to_max_tokens=cfg.pad_to_max_tokens,
+            pad_to_max_seqs=cfg.pad_to_max_seqs,
+            symmetries=symmetries,
+            atoms_per_window_queries=cfg.atoms_per_window_queries,
+            min_dist=cfg.min_dist,
+            max_dist=cfg.max_dist,
+            num_bins=cfg.num_bins,
+            overfit=cfg.overfit,
+            crop_validation=cfg.crop_validation,
+            return_symmetries=cfg.return_val_symmetries,
+            binder_pocket_conditioned_prop=cfg.val_binder_pocket_conditioned_prop,
+            binder_pocket_cutoff=cfg.binder_pocket_cutoff,
+        )
+
+    def setup(self, stage: Optional[str] = None) -> None:
+        """Run the setup for the DataModule.
+
+        Parameters
+        ----------
+        stage : str, optional
+            The stage, one of 'fit', 'validate', 'test'.
+
+        """
+        return
+
+    def train_dataloader(self) -> DataLoader:
+        """Get the training dataloader.
+
+        Returns
+        -------
+        DataLoader
+            The training dataloader.
+
+        """
+        return DataLoader(
+            self._train_set,
+            batch_size=self.cfg.batch_size,
+            num_workers=self.cfg.num_workers,
+            pin_memory=self.cfg.pin_memory,
+            shuffle=False,
+            collate_fn=collate,
+        )
+
+    def val_dataloader(self) -> DataLoader:
+        """Get the validation dataloader.
+
+        Returns
+        -------
+        DataLoader
+            The validation dataloader.
+
+        """
+        return DataLoader(
+            self._val_set,
+            batch_size=self.cfg.val_batch_size,
+            num_workers=self.cfg.num_workers,
+            pin_memory=self.cfg.pin_memory,
+            shuffle=False,
+            collate_fn=collate,
+        )
diff --git a/forks/boltz/src/boltz/data/mol.py b/forks/boltz/src/boltz/data/mol.py
new file mode 100644
index 00000000..1b98e328
--- /dev/null
+++ b/forks/boltz/src/boltz/data/mol.py
@@ -0,0 +1,900 @@
+import itertools
+import pickle
+import random
+from pathlib import Path
+
+import numpy as np
+import torch
+from rdkit.Chem import Mol
+from tqdm import tqdm
+
+from boltz.data import const
+from boltz.data.pad import pad_dim
+from boltz.model.loss.confidence import lddt_dist
+
+
+def load_molecules(moldir: str, molecules: list[str]) -> dict[str, Mol]:
+    """Load the given input data.
+
+    Parameters
+    ----------
+    moldir : str
+        The path to the molecules directory.
+    molecules : list[str]
+        The molecules to load.
+
+    Returns
+    -------
+    dict[str, Mol]
+        The loaded molecules.
+    """
+    loaded_mols = {}
+    for molecule in molecules:
+        path = Path(moldir) / f"{molecule}.pkl"
+        if not path.exists():
+            msg = f"CCD component {molecule} not found!"
+            raise ValueError(msg)
+        with path.open("rb") as f:
+            loaded_mols[molecule] = pickle.load(f)  # noqa: S301
+    return loaded_mols
+
+
+def load_canonicals(moldir: str) -> dict[str, Mol]:
+    """Load the given input data.
+
+    Parameters
+    ----------
+    moldir : str
+        The molecules to load.
+
+    Returns
+    -------
+    dict[str, Mol]
+        The loaded molecules.
+
+    """
+    return load_molecules(moldir, const.canonical_tokens)
+
+
+def load_all_molecules(moldir: str) -> dict[str, Mol]:
+    """Load the given input data.
+
+    Parameters
+    ----------
+    moldir : str
+        The path to the molecules directory.
+    molecules : list[str]
+        The molecules to load.
+
+    Returns
+    -------
+    dict[str, Mol]
+        The loaded molecules.
+
+    """
+    loaded_mols = {}
+    files = list(Path(moldir).glob("*.pkl"))
+    for path in tqdm(files, total=len(files), desc="Loading molecules", leave=False):
+        mol_name = path.stem
+        with path.open("rb") as f:
+            loaded_mols[mol_name] = pickle.load(f)  # noqa: S301
+    return loaded_mols
+
+
+def get_symmetries(mols: dict[str, Mol]) -> dict:  # noqa: PLR0912
+    """Create a dictionary for the ligand symmetries.
+
+    Parameters
+    ----------
+    path : str
+        The path to the ligand symmetries.
+
+    Returns
+    -------
+    dict
+        The ligand symmetries.
+
+    """
+    symmetries = {}
+    for key, mol in mols.items():
+        try:
+            sym = pickle.loads(bytes.fromhex(mol.GetProp("symmetries")))  # noqa: S301
+
+            if mol.HasProp("pb_edge_index"):
+                edge_index = pickle.loads(
+                    bytes.fromhex(mol.GetProp("pb_edge_index"))
+                ).astype(np.int64)  # noqa: S301
+                lower_bounds = pickle.loads(
+                    bytes.fromhex(mol.GetProp("pb_lower_bounds"))
+                )  # noqa: S301
+                upper_bounds = pickle.loads(
+                    bytes.fromhex(mol.GetProp("pb_upper_bounds"))
+                )  # noqa: S301
+                bond_mask = pickle.loads(bytes.fromhex(mol.GetProp("pb_bond_mask")))  # noqa: S301
+                angle_mask = pickle.loads(bytes.fromhex(mol.GetProp("pb_angle_mask")))  # noqa: S301
+            else:
+                edge_index = np.empty((2, 0), dtype=np.int64)
+                lower_bounds = np.array([], dtype=np.float32)
+                upper_bounds = np.array([], dtype=np.float32)
+                bond_mask = np.array([], dtype=np.float32)
+                angle_mask = np.array([], dtype=np.float32)
+
+            if mol.HasProp("chiral_atom_index"):
+                chiral_atom_index = pickle.loads(
+                    bytes.fromhex(mol.GetProp("chiral_atom_index"))
+                ).astype(np.int64)
+                chiral_check_mask = pickle.loads(
+                    bytes.fromhex(mol.GetProp("chiral_check_mask"))
+                ).astype(np.int64)
+                chiral_atom_orientations = pickle.loads(
+                    bytes.fromhex(mol.GetProp("chiral_atom_orientations"))
+                )
+            else:
+                chiral_atom_index = np.empty((4, 0), dtype=np.int64)
+                chiral_check_mask = np.array([], dtype=bool)
+                chiral_atom_orientations = np.array([], dtype=bool)
+
+            if mol.HasProp("stereo_bond_index"):
+                stereo_bond_index = pickle.loads(
+                    bytes.fromhex(mol.GetProp("stereo_bond_index"))
+                ).astype(np.int64)
+                stereo_check_mask = pickle.loads(
+                    bytes.fromhex(mol.GetProp("stereo_check_mask"))
+                ).astype(np.int64)
+                stereo_bond_orientations = pickle.loads(
+                    bytes.fromhex(mol.GetProp("stereo_bond_orientations"))
+                )
+            else:
+                stereo_bond_index = np.empty((4, 0), dtype=np.int64)
+                stereo_check_mask = np.array([], dtype=bool)
+                stereo_bond_orientations = np.array([], dtype=bool)
+
+            if mol.HasProp("aromatic_5_ring_index"):
+                aromatic_5_ring_index = pickle.loads(
+                    bytes.fromhex(mol.GetProp("aromatic_5_ring_index"))
+                ).astype(np.int64)
+            else:
+                aromatic_5_ring_index = np.empty((5, 0), dtype=np.int64)
+            if mol.HasProp("aromatic_6_ring_index"):
+                aromatic_6_ring_index = pickle.loads(
+                    bytes.fromhex(mol.GetProp("aromatic_6_ring_index"))
+                ).astype(np.int64)
+            else:
+                aromatic_6_ring_index = np.empty((6, 0), dtype=np.int64)
+            if mol.HasProp("planar_double_bond_index"):
+                planar_double_bond_index = pickle.loads(
+                    bytes.fromhex(mol.GetProp("planar_double_bond_index"))
+                ).astype(np.int64)
+            else:
+                planar_double_bond_index = np.empty((6, 0), dtype=np.int64)
+
+            atom_names = [atom.GetProp("name") for atom in mol.GetAtoms()]
+            symmetries[key] = (
+                sym,
+                atom_names,
+                edge_index,
+                lower_bounds,
+                upper_bounds,
+                bond_mask,
+                angle_mask,
+                chiral_atom_index,
+                chiral_check_mask,
+                chiral_atom_orientations,
+                stereo_bond_index,
+                stereo_check_mask,
+                stereo_bond_orientations,
+                aromatic_5_ring_index,
+                aromatic_6_ring_index,
+                planar_double_bond_index,
+            )
+        except Exception as e:  # noqa: BLE001, PERF203, S110
+            pass
+
+    return symmetries
+
+
+def compute_symmetry_idx_dictionary(data):
+    # Compute the symmetry index dictionary
+    total_count = 0
+    all_coords = []
+    for i, chain in enumerate(data.chains):
+        chain.start_idx = total_count
+        for j, token in enumerate(chain.tokens):
+            token.start_idx = total_count - chain.start_idx
+            all_coords.extend(
+                [[atom.coords.x, atom.coords.y, atom.coords.z] for atom in token.atoms]
+            )
+            total_count += len(token.atoms)
+    return all_coords
+
+
+def get_current_idx_list(data):
+    idx = []
+    for chain in data.chains:
+        if chain.in_crop:
+            for token in chain.tokens:
+                if token.in_crop:
+                    idx.extend(
+                        [
+                            chain.start_idx + token.start_idx + i
+                            for i in range(len(token.atoms))
+                        ]
+                    )
+    return idx
+
+
+def all_different_after_swap(l):
+    final = [s[-1] for s in l]
+    return len(final) == len(set(final))
+
+
+def minimum_lddt_symmetry_coords(
+    coords: torch.Tensor,
+    feats: dict,
+    index_batch: int,
+):
+    all_coords = feats["all_coords"][index_batch].unsqueeze(0).to(coords)
+    all_resolved_mask = (
+        feats["all_resolved_mask"][index_batch].to(coords).to(torch.bool)
+    )
+    crop_to_all_atom_map = (
+        feats["crop_to_all_atom_map"][index_batch].to(coords).to(torch.long)
+    )
+    chain_symmetries = feats["chain_swaps"][index_batch]
+    amino_acids_symmetries = feats["amino_acids_symmetries"][index_batch]
+    ligand_symmetries = feats["ligand_symmetries"][index_batch]
+
+    dmat_predicted = torch.cdist(
+        coords[:, : len(crop_to_all_atom_map)], coords[:, : len(crop_to_all_atom_map)]
+    )
+
+    # Check best symmetry on chain swap
+    best_true_coords = all_coords[:, crop_to_all_atom_map].clone()
+    best_true_resolved_mask = all_resolved_mask[crop_to_all_atom_map].clone()
+    best_lddt = -1.0
+    for c in chain_symmetries:
+        true_all_coords = all_coords.clone()
+        true_all_resolved_mask = all_resolved_mask.clone()
+        for start1, end1, start2, end2, chainidx1, chainidx2 in c:
+            true_all_coords[:, start1:end1] = all_coords[:, start2:end2]
+            true_all_resolved_mask[start1:end1] = all_resolved_mask[start2:end2]
+        true_coords = true_all_coords[:, crop_to_all_atom_map]
+        true_resolved_mask = true_all_resolved_mask[crop_to_all_atom_map]
+        dmat_true = torch.cdist(true_coords, true_coords)
+        pair_mask = (
+            true_resolved_mask[:, None]
+            * true_resolved_mask[None, :]
+            * (1 - torch.eye(len(true_resolved_mask))).to(true_resolved_mask)
+        )
+
+        lddt = lddt_dist(
+            dmat_predicted, dmat_true, pair_mask, cutoff=15.0, per_atom=False
+        )[0]
+        lddt = lddt.item()
+
+        if lddt > best_lddt and torch.sum(true_resolved_mask) > 3:
+            best_lddt = lddt
+            best_true_coords = true_coords
+            best_true_resolved_mask = true_resolved_mask
+
+    # atom symmetries (nucleic acid and protein residues), resolved greedily without recomputing alignment
+    true_coords = best_true_coords.clone()
+    true_resolved_mask = best_true_resolved_mask.clone()
+    for symmetric_amino_or_lig in amino_acids_symmetries + ligand_symmetries:
+        best_lddt_improvement = 0.0
+
+        indices = set()
+        for c in symmetric_amino_or_lig:
+            for i, j in c:
+                indices.add(i)
+        indices = sorted(list(indices))
+        indices = torch.from_numpy(np.asarray(indices)).to(true_coords.device).long()
+        pred_coords_subset = coords[:, : len(crop_to_all_atom_map)][:, indices]
+        sub_dmat_pred = torch.cdist(
+            coords[:, : len(crop_to_all_atom_map)], pred_coords_subset
+        )
+
+        for c in symmetric_amino_or_lig:
+            # starting from greedy best, try to swap the atoms
+            new_true_coords = true_coords.clone()
+            new_true_resolved_mask = true_resolved_mask.clone()
+            for i, j in c:
+                new_true_coords[:, i] = true_coords[:, j]
+                new_true_resolved_mask[i] = true_resolved_mask[j]
+
+            true_coords_subset = true_coords[:, indices]
+            new_true_coords_subset = new_true_coords[:, indices]
+
+            sub_dmat_true = torch.cdist(true_coords, true_coords_subset)
+            sub_dmat_new_true = torch.cdist(new_true_coords, new_true_coords_subset)
+
+            sub_true_pair_lddt = (
+                true_resolved_mask[:, None] * true_resolved_mask[None, indices]
+            )
+            sub_true_pair_lddt[indices] = (
+                sub_true_pair_lddt[indices]
+                * (1 - torch.eye(len(indices))).to(sub_true_pair_lddt).bool()
+            )
+
+            sub_new_true_pair_lddt = (
+                new_true_resolved_mask[:, None] * new_true_resolved_mask[None, indices]
+            )
+            sub_new_true_pair_lddt[indices] = (
+                sub_new_true_pair_lddt[indices]
+                * (1 - torch.eye(len(indices))).to(sub_true_pair_lddt).bool()
+            )
+
+            lddt, total = lddt_dist(
+                sub_dmat_pred,
+                sub_dmat_true,
+                sub_true_pair_lddt,
+                cutoff=15.0,
+                per_atom=False,
+            )
+            new_lddt, new_total = lddt_dist(
+                sub_dmat_pred,
+                sub_dmat_new_true,
+                sub_new_true_pair_lddt,
+                cutoff=15.0,
+                per_atom=False,
+            )
+
+            lddt_improvement = new_lddt - lddt
+
+            if lddt_improvement > best_lddt_improvement:
+                best_true_coords = new_true_coords
+                best_true_resolved_mask = new_true_resolved_mask
+                best_lddt_improvement = lddt_improvement
+
+        # greedily update best coordinates after each amino acid
+        true_coords = best_true_coords.clone()
+        true_resolved_mask = best_true_resolved_mask.clone()
+
+    # Recomputing alignment
+    true_coords = pad_dim(true_coords, 1, coords.shape[1] - true_coords.shape[1])
+    true_resolved_mask = pad_dim(
+        true_resolved_mask,
+        0,
+        coords.shape[1] - true_resolved_mask.shape[0],
+    )
+
+    return true_coords, true_resolved_mask.unsqueeze(0)
+
+
+def compute_single_distogram_loss(pred, target, mask):
+    # Compute the distogram loss
+    errors = -1 * torch.sum(
+        target * torch.nn.functional.log_softmax(pred, dim=-1),
+        dim=-1,
+    )
+    denom = 1e-5 + torch.sum(mask, dim=(-1, -2))
+    mean = errors * mask
+    mean = torch.sum(mean, dim=-1)
+    mean = mean / denom[..., None]
+    batch_loss = torch.sum(mean, dim=-1)
+    global_loss = torch.mean(batch_loss)
+    return global_loss
+
+
+def minimum_lddt_symmetry_dist(
+    pred_distogram: torch.Tensor,
+    feats: dict,
+    index_batch: int,
+):
+    # Note: for now only ligand symmetries are resolved
+
+    disto_target = feats["disto_target"][index_batch]
+    mask = feats["token_disto_mask"][index_batch]
+    mask = mask[None, :] * mask[:, None]
+    mask = mask * (1 - torch.eye(mask.shape[1])).to(disto_target)
+
+    coords = feats["coords"][index_batch]
+
+    ligand_symmetries = feats["ligand_symmetries"][index_batch]
+    atom_to_token_map = feats["atom_to_token"][index_batch].argmax(dim=-1)
+
+    # atom symmetries, resolved greedily without recomputing alignment
+    for symmetric_amino_or_lig in ligand_symmetries:
+        best_c, best_disto, best_loss_improvement = None, None, 0.0
+        for c in symmetric_amino_or_lig:
+            # starting from greedy best, try to swap the atoms
+            new_disto_target = disto_target.clone()
+            indices = []
+
+            # fix the distogram by replacing first the columns then the rows
+            disto_temp = new_disto_target.clone()
+            for i, j in c:
+                new_disto_target[:, atom_to_token_map[i]] = disto_temp[
+                    :, atom_to_token_map[j]
+                ]
+                indices.append(atom_to_token_map[i].item())
+            disto_temp = new_disto_target.clone()
+            for i, j in c:
+                new_disto_target[atom_to_token_map[i], :] = disto_temp[
+                    atom_to_token_map[j], :
+                ]
+
+            indices = (
+                torch.from_numpy(np.asarray(indices)).to(disto_target.device).long()
+            )
+
+            pred_distogram_subset = pred_distogram[:, indices]
+            disto_target_subset = disto_target[:, indices]
+            new_disto_target_subset = new_disto_target[:, indices]
+            mask_subset = mask[:, indices]
+
+            loss = compute_single_distogram_loss(
+                pred_distogram_subset, disto_target_subset, mask_subset
+            )
+            new_loss = compute_single_distogram_loss(
+                pred_distogram_subset, new_disto_target_subset, mask_subset
+            )
+            loss_improvement = (loss - new_loss) * len(indices)
+
+            if loss_improvement > best_loss_improvement:
+                best_c = c
+                best_disto = new_disto_target
+                best_loss_improvement = loss_improvement
+
+        # greedily update best coordinates after each ligand
+        if best_loss_improvement > 0:
+            disto_target = best_disto.clone()
+            old_coords = coords.clone()
+            for i, j in best_c:
+                coords[:, i] = old_coords[:, j]
+
+    # update features to be used in diffusion and in distogram loss
+    feats["disto_target"][index_batch] = disto_target
+    feats["coords"][index_batch] = coords
+    return
+
+
+def compute_all_coords_mask(structure):
+    # Compute all coords, crop mask and add start_idx to structure
+    total_count = 0
+    all_coords = []
+    all_coords_crop_mask = []
+    all_resolved_mask = []
+    for i, chain in enumerate(structure.chains):
+        chain.start_idx = total_count
+        for j, token in enumerate(chain.tokens):
+            token.start_idx = total_count - chain.start_idx
+            all_coords.extend(
+                [[atom.coords.x, atom.coords.y, atom.coords.z] for atom in token.atoms]
+            )
+            all_coords_crop_mask.extend(
+                [token.in_crop for _ in range(len(token.atoms))]
+            )
+            all_resolved_mask.extend(
+                [token.is_present for _ in range(len(token.atoms))]
+            )
+            total_count += len(token.atoms)
+    if len(all_coords_crop_mask) != len(all_resolved_mask):
+        pass
+    return all_coords, all_coords_crop_mask, all_resolved_mask
+
+
+def get_chain_symmetries(cropped, max_n_symmetries=100):
+    # get all coordinates and resolved mask
+    structure = cropped.structure
+    all_coords = []
+    all_resolved_mask = []
+    original_atom_idx = []
+    chain_atom_idx = []
+    chain_atom_num = []
+    chain_in_crop = []
+    chain_asym_id = []
+    new_atom_idx = 0
+
+    for chain in structure.chains:
+        atom_idx, atom_num = (
+            chain["atom_idx"],  # Global index of first atom in the chain
+            chain["atom_num"],  # Number of atoms in the chain
+        )
+
+        # compute coordinates and resolved mask
+        resolved_mask = structure.atoms["is_present"][
+            atom_idx : atom_idx + atom_num
+        ]  # Whether each atom in the chain is actually resolved
+
+        # ensemble_atom_starts = [structure.ensemble[idx]["atom_coord_idx"] for idx in cropped.ensemble_ref_idxs]
+        # coords = np.array(
+        #    [structure.coords[ensemble_atom_start + atom_idx: ensemble_atom_start + atom_idx + atom_num]["coords"] for
+        #     ensemble_atom_start in ensemble_atom_starts])
+
+        coords = structure.atoms["coords"][atom_idx : atom_idx + atom_num]
+
+        in_crop = False
+        for token in cropped.tokens:
+            if token["asym_id"] == chain["asym_id"]:
+                in_crop = True
+                break
+
+        all_coords.append(coords)
+        all_resolved_mask.append(resolved_mask)
+        original_atom_idx.append(atom_idx)
+        chain_atom_idx.append(new_atom_idx)
+        chain_atom_num.append(atom_num)
+        chain_in_crop.append(in_crop)
+        chain_asym_id.append(chain["asym_id"])
+
+        new_atom_idx += atom_num
+
+    all_coords = np.concatenate(all_coords, axis=0)
+    # Compute backmapping from token to all coords
+    crop_to_all_atom_map = []
+    for token in cropped.tokens:
+        chain_idx = chain_asym_id.index(token["asym_id"])
+        start = (
+            chain_atom_idx[chain_idx] - original_atom_idx[chain_idx] + token["atom_idx"]
+        )
+        crop_to_all_atom_map.append(np.arange(start, start + token["atom_num"]))
+    crop_to_all_atom_map = np.concatenate(crop_to_all_atom_map, axis=0)
+
+    # Compute the connections edge index for covalent bonds
+    all_atom_to_crop_map = np.zeros(all_coords.shape[0], dtype=np.int64)
+    all_atom_to_crop_map[crop_to_all_atom_map.astype(np.int64)] = np.arange(
+        crop_to_all_atom_map.shape[0]
+    )
+    connections_edge_index = []
+    for connection in structure.bonds:
+        if (connection["chain_1"] == connection["chain_2"]) and (
+            connection["res_1"] == connection["res_2"]
+        ):
+            continue
+        connections_edge_index.append([connection["atom_1"], connection["atom_2"]])
+    if len(connections_edge_index) > 0:
+        connections_edge_index = np.array(connections_edge_index, dtype=np.int64).T
+        connections_edge_index = all_atom_to_crop_map[connections_edge_index]
+    else:
+        connections_edge_index = np.empty((2, 0))
+
+    # Compute the symmetries between chains
+    symmetries = []
+    swaps = []
+    for i, chain in enumerate(structure.chains):
+        start = chain_atom_idx[i]
+        end = start + chain_atom_num[i]
+
+        if chain_in_crop[i]:
+            possible_swaps = []
+            for j, chain2 in enumerate(structure.chains):
+                start2 = chain_atom_idx[j]
+                end2 = start2 + chain_atom_num[j]
+                if (
+                    chain["entity_id"] == chain2["entity_id"]
+                    and end - start == end2 - start2
+                ):
+                    possible_swaps.append((start, end, start2, end2, i, j))
+            swaps.append(possible_swaps)
+
+        found = False
+        for symmetry_idx, symmetry in enumerate(symmetries):
+            j = symmetry[0][0]
+            chain2 = structure.chains[j]
+            start2 = chain_atom_idx[j]
+            end2 = start2 + chain_atom_num[j]
+            if (
+                chain["entity_id"] == chain2["entity_id"]
+                and end - start == end2 - start2
+            ):
+                symmetries[symmetry_idx].append(
+                    (i, start, end, chain_in_crop[i], chain["mol_type"])
+                )
+                found = True
+        if not found:
+            symmetries.append([(i, start, end, chain_in_crop[i], chain["mol_type"])])
+
+    combinations = itertools.product(*swaps)
+    # to avoid combinatorial explosion, bound the number of combinations even considered
+    combinations = list(itertools.islice(combinations, max_n_symmetries * 10))
+    # filter for all chains getting a different assignment
+    combinations = [c for c in combinations if all_different_after_swap(c)]
+
+    if len(combinations) > max_n_symmetries:
+        combinations = random.sample(combinations, max_n_symmetries)
+
+    if len(combinations) == 0:
+        combinations.append([])
+
+    for i in range(len(symmetries) - 1, -1, -1):
+        if not any(chain[3] for chain in symmetries[i]):
+            symmetries.pop(i)
+
+    features = {}
+    features["all_coords"] = torch.Tensor(all_coords)  # axis=1 with ensemble
+
+    features["all_resolved_mask"] = torch.Tensor(
+        np.concatenate(all_resolved_mask, axis=0)
+    )
+    features["crop_to_all_atom_map"] = torch.Tensor(crop_to_all_atom_map)
+    features["chain_symmetries"] = symmetries
+    features["connections_edge_index"] = torch.tensor(connections_edge_index)
+    features["chain_swaps"] = combinations
+
+    return features
+
+
+def get_amino_acids_symmetries(cropped):
+    # Compute standard amino-acids symmetries
+    swaps = []
+    start_index_crop = 0
+    for token in cropped.tokens:
+        symmetries = const.ref_symmetries.get(const.tokens[token["res_type"]], [])
+        if len(symmetries) > 0:
+            residue_swaps = []
+            for sym in symmetries:
+                sym_new_idx = [
+                    (i + start_index_crop, j + start_index_crop) for i, j in sym
+                ]
+                residue_swaps.append(sym_new_idx)
+            swaps.append(residue_swaps)
+        start_index_crop += token["atom_num"]
+
+    features = {"amino_acids_symmetries": swaps}
+    return features
+
+
+def slice_valid_index(index, ccd_to_valid_id_array, args=None):
+    index = ccd_to_valid_id_array[index]
+    valid_index_mask = (~np.isnan(index)).all(axis=0)
+    index = index[:, valid_index_mask]
+    if args is None:
+        return index
+    args = (arg[valid_index_mask] for arg in args)
+    return index, args
+
+
+def get_ligand_symmetries(cropped, symmetries, return_physical_metrics=False):
+    # Compute ligand and non-standard amino-acids symmetries
+    structure = cropped.structure
+
+    added_molecules = {}
+    index_mols = []
+    atom_count = 0
+
+    for token in cropped.tokens:
+        # check if molecule is already added by identifying it through asym_id and res_idx
+        atom_count += token["atom_num"]
+        mol_id = (token["asym_id"], token["res_idx"])
+        if mol_id in added_molecules:
+            added_molecules[mol_id] += token["atom_num"]
+            continue
+        added_molecules[mol_id] = token["atom_num"]
+
+        # get the molecule type and indices
+        residue_idx = token["res_idx"] + structure.chains[token["asym_id"]]["res_idx"]
+        mol_name = structure.residues[residue_idx]["name"]
+        atom_idx = structure.residues[residue_idx]["atom_idx"]
+        mol_atom_names = structure.atoms[
+            atom_idx : atom_idx + structure.residues[residue_idx]["atom_num"]
+        ]["name"]
+        if mol_name not in const.ref_symmetries:
+            index_mols.append(
+                (mol_name, atom_count - token["atom_num"], mol_id, mol_atom_names)
+            )
+
+    # for each molecule, get the symmetries
+    molecule_symmetries = []
+    all_edge_index = []
+    all_lower_bounds, all_upper_bounds = [], []
+    all_bond_mask, all_angle_mask = [], []
+    all_chiral_atom_index, all_chiral_check_mask, all_chiral_atom_orientations = (
+        [],
+        [],
+        [],
+    )
+    all_stereo_bond_index, all_stereo_check_mask, all_stereo_bond_orientations = (
+        [],
+        [],
+        [],
+    )
+    (
+        all_aromatic_5_ring_index,
+        all_aromatic_6_ring_index,
+        all_planar_double_bond_index,
+    ) = (
+        [],
+        [],
+        [],
+    )
+    for mol_name, start_mol, mol_id, mol_atom_names in index_mols:
+        if not mol_name in symmetries:
+            continue
+        else:
+            swaps = []
+            (
+                syms_ccd,
+                mol_atom_names_ccd,
+                edge_index,
+                lower_bounds,
+                upper_bounds,
+                bond_mask,
+                angle_mask,
+                chiral_atom_index,
+                chiral_check_mask,
+                chiral_atom_orientations,
+                stereo_bond_index,
+                stereo_check_mask,
+                stereo_bond_orientations,
+                aromatic_5_ring_index,
+                aromatic_6_ring_index,
+                planar_double_bond_index,
+            ) = symmetries[mol_name]
+            # Get indices of mol_atom_names_ccd that are in mol_atom_names
+            ccd_to_valid_ids = {
+                mol_atom_names_ccd.index(name): i
+                for i, name in enumerate(mol_atom_names)
+            }
+            ccd_to_valid_id_array = np.array(
+                [
+                    float("nan") if i not in ccd_to_valid_ids else ccd_to_valid_ids[i]
+                    for i in range(len(mol_atom_names_ccd))
+                ]
+            )
+            ccd_valid_ids = set(ccd_to_valid_ids.keys())
+            syms = []
+            # Get syms
+            for sym_ccd in syms_ccd:
+                sym_dict = {}
+                bool_add = True
+                for i, j in enumerate(sym_ccd):
+                    if i in ccd_valid_ids:
+                        if j in ccd_valid_ids:
+                            i_true = ccd_to_valid_ids[i]
+                            j_true = ccd_to_valid_ids[j]
+                            sym_dict[i_true] = j_true
+                        else:
+                            bool_add = False
+                            break
+                if bool_add:
+                    syms.append([sym_dict[i] for i in range(len(ccd_valid_ids))])
+            for sym in syms:
+                if len(sym) != added_molecules[mol_id]:
+                    raise Exception(
+                        f"Symmetry length mismatch {len(sym)} {added_molecules[mol_id]}"
+                    )
+                # assert (
+                #     len(sym) == added_molecules[mol_id]
+                # ), f"Symmetry length mismatch {len(sym)} {added_molecules[mol_id]}"
+                sym_new_idx = []
+                for i, j in enumerate(sym):
+                    if i != int(j):
+                        sym_new_idx.append((i + start_mol, int(j) + start_mol))
+                if len(sym_new_idx) > 0:
+                    swaps.append(sym_new_idx)
+
+            if len(swaps) > 0:
+                molecule_symmetries.append(swaps)
+
+            if return_physical_metrics:
+                edge_index, (lower_bounds, upper_bounds, bond_mask, angle_mask) = (
+                    slice_valid_index(
+                        edge_index,
+                        ccd_to_valid_id_array,
+                        (lower_bounds, upper_bounds, bond_mask, angle_mask),
+                    )
+                )
+                all_edge_index.append(edge_index + start_mol)
+                all_lower_bounds.append(lower_bounds)
+                all_upper_bounds.append(upper_bounds)
+                all_bond_mask.append(bond_mask)
+                all_angle_mask.append(angle_mask)
+
+                chiral_atom_index, (chiral_check_mask, chiral_atom_orientations) = (
+                    slice_valid_index(
+                        chiral_atom_index,
+                        ccd_to_valid_id_array,
+                        (chiral_check_mask, chiral_atom_orientations),
+                    )
+                )
+                all_chiral_atom_index.append(chiral_atom_index + start_mol)
+                all_chiral_check_mask.append(chiral_check_mask)
+                all_chiral_atom_orientations.append(chiral_atom_orientations)
+
+                stereo_bond_index, (stereo_check_mask, stereo_bond_orientations) = (
+                    slice_valid_index(
+                        stereo_bond_index,
+                        ccd_to_valid_id_array,
+                        (stereo_check_mask, stereo_bond_orientations),
+                    )
+                )
+                all_stereo_bond_index.append(stereo_bond_index + start_mol)
+                all_stereo_check_mask.append(stereo_check_mask)
+                all_stereo_bond_orientations.append(stereo_bond_orientations)
+
+                aromatic_5_ring_index = slice_valid_index(
+                    aromatic_5_ring_index, ccd_to_valid_id_array
+                )
+                aromatic_6_ring_index = slice_valid_index(
+                    aromatic_6_ring_index, ccd_to_valid_id_array
+                )
+                planar_double_bond_index = slice_valid_index(
+                    planar_double_bond_index, ccd_to_valid_id_array
+                )
+                all_aromatic_5_ring_index.append(aromatic_5_ring_index + start_mol)
+                all_aromatic_6_ring_index.append(aromatic_6_ring_index + start_mol)
+                all_planar_double_bond_index.append(
+                    planar_double_bond_index + start_mol
+                )
+
+    if return_physical_metrics:
+        if len(all_edge_index) > 0:
+            all_edge_index = np.concatenate(all_edge_index, axis=1)
+            all_lower_bounds = np.concatenate(all_lower_bounds, axis=0)
+            all_upper_bounds = np.concatenate(all_upper_bounds, axis=0)
+            all_bond_mask = np.concatenate(all_bond_mask, axis=0)
+            all_angle_mask = np.concatenate(all_angle_mask, axis=0)
+
+            all_chiral_atom_index = np.concatenate(all_chiral_atom_index, axis=1)
+            all_chiral_check_mask = np.concatenate(all_chiral_check_mask, axis=0)
+            all_chiral_atom_orientations = np.concatenate(
+                all_chiral_atom_orientations, axis=0
+            )
+
+            all_stereo_bond_index = np.concatenate(all_stereo_bond_index, axis=1)
+            all_stereo_check_mask = np.concatenate(all_stereo_check_mask, axis=0)
+            all_stereo_bond_orientations = np.concatenate(
+                all_stereo_bond_orientations, axis=0
+            )
+
+            all_aromatic_5_ring_index = np.concatenate(
+                all_aromatic_5_ring_index, axis=1
+            )
+            all_aromatic_6_ring_index = np.concatenate(
+                all_aromatic_6_ring_index, axis=1
+            )
+            all_planar_double_bond_index = np.empty(
+                (6, 0), dtype=np.int64
+            )  # TODO remove np.concatenate(all_planar_double_bond_index, axis=1)
+        else:
+            all_edge_index = np.empty((2, 0), dtype=np.int64)
+            all_lower_bounds = np.array([], dtype=np.float32)
+            all_upper_bounds = np.array([], dtype=np.float32)
+            all_bond_mask = np.array([], dtype=bool)
+            all_angle_mask = np.array([], dtype=bool)
+
+            all_chiral_atom_index = np.empty((4, 0), dtype=np.int64)
+            all_chiral_check_mask = np.array([], dtype=bool)
+            all_chiral_atom_orientations = np.array([], dtype=bool)
+
+            all_stereo_bond_index = np.empty((4, 0), dtype=np.int64)
+            all_stereo_check_mask = np.array([], dtype=bool)
+            all_stereo_bond_orientations = np.array([], dtype=bool)
+
+            all_aromatic_5_ring_index = np.empty((5, 0), dtype=np.int64)
+            all_aromatic_6_ring_index = np.empty((6, 0), dtype=np.int64)
+            all_planar_double_bond_index = np.empty((6, 0), dtype=np.int64)
+
+        features = {
+            "ligand_symmetries": molecule_symmetries,
+            "ligand_edge_index": torch.tensor(all_edge_index).long(),
+            "ligand_edge_lower_bounds": torch.tensor(all_lower_bounds),
+            "ligand_edge_upper_bounds": torch.tensor(all_upper_bounds),
+            "ligand_edge_bond_mask": torch.tensor(all_bond_mask),
+            "ligand_edge_angle_mask": torch.tensor(all_angle_mask),
+            "ligand_chiral_atom_index": torch.tensor(all_chiral_atom_index).long(),
+            "ligand_chiral_check_mask": torch.tensor(all_chiral_check_mask),
+            "ligand_chiral_atom_orientations": torch.tensor(
+                all_chiral_atom_orientations
+            ),
+            "ligand_stereo_bond_index": torch.tensor(all_stereo_bond_index).long(),
+            "ligand_stereo_check_mask": torch.tensor(all_stereo_check_mask),
+            "ligand_stereo_bond_orientations": torch.tensor(
+                all_stereo_bond_orientations
+            ),
+            "ligand_aromatic_5_ring_index": torch.tensor(
+                all_aromatic_5_ring_index
+            ).long(),
+            "ligand_aromatic_6_ring_index": torch.tensor(
+                all_aromatic_6_ring_index
+            ).long(),
+            "ligand_planar_double_bond_index": torch.tensor(
+                all_planar_double_bond_index
+            ).long(),
+        }
+    else:
+        features = {
+            "ligand_symmetries": molecule_symmetries,
+        }
+    return features
diff --git a/forks/boltz/src/boltz/data/msa/__init__.py b/forks/boltz/src/boltz/data/msa/__init__.py
new file mode 100644
index 00000000..e69de29b
diff --git a/forks/boltz/src/boltz/data/msa/mmseqs2.py b/forks/boltz/src/boltz/data/msa/mmseqs2.py
new file mode 100644
index 00000000..f2aab6e8
--- /dev/null
+++ b/forks/boltz/src/boltz/data/msa/mmseqs2.py
@@ -0,0 +1,286 @@
+# From https://github.com/sokrypton/ColabFold/blob/main/colabfold/colabfold.py
+
+import logging
+import os
+import random
+import tarfile
+import time
+from typing import Optional, Union, Dict
+
+import requests
+from requests.auth import HTTPBasicAuth
+from tqdm import tqdm
+
+logger = logging.getLogger(__name__)
+
+TQDM_BAR_FORMAT = (
+    "{l_bar}{bar}| {n_fmt}/{total_fmt} [elapsed: {elapsed} remaining: {remaining}]"
+)
+
+
+def run_mmseqs2(  # noqa: PLR0912, D103, C901, PLR0915
+    x: Union[str, list[str]],
+    prefix: str = "tmp",
+    use_env: bool = True,
+    use_filter: bool = True,
+    use_pairing: bool = False,
+    pairing_strategy: str = "greedy",
+    host_url: str = "https://api.colabfold.com",
+    msa_server_username: Optional[str] = None,
+    msa_server_password: Optional[str] = None,
+    auth_headers: Optional[Dict[str, str]] = None,
+) -> tuple[list[str], list[str]]:
+    submission_endpoint = "ticket/pair" if use_pairing else "ticket/msa"
+
+    # Validate mutually exclusive authentication methods
+    has_basic_auth = msa_server_username and msa_server_password
+    has_header_auth = auth_headers is not None
+    if has_basic_auth and (has_header_auth or auth_headers):
+        raise ValueError(
+            "Cannot use both basic authentication (username/password) and header/API key authentication. "
+            "Please use only one authentication method."
+        )
+
+    # Set header agent as boltz
+    headers = {}
+    headers["User-Agent"] = "boltz"
+
+    # Set up authentication
+    auth = None
+    if has_basic_auth:
+        auth = HTTPBasicAuth(msa_server_username, msa_server_password)
+        logger.debug(f"MMSeqs2 server authentication: using basic auth for user '{msa_server_username}'")
+    elif has_header_auth:
+        headers.update(auth_headers)
+        logger.debug("MMSeqs2 server authentication: using header-based authentication")
+    else:
+        logger.debug("MMSeqs2 server authentication: no credentials provided")
+    
+    logger.debug(f"Connecting to MMSeqs2 server at: {host_url}")
+    logger.debug(f"Using endpoint: {submission_endpoint}")
+    logger.debug(f"Pairing strategy: {pairing_strategy}")
+    logger.debug(f"Use environment databases: {use_env}")
+    logger.debug(f"Use filtering: {use_filter}")
+
+    def submit(seqs, mode, N=101):
+        n, query = N, ""
+        for seq in seqs:
+            query += f">{n}\n{seq}\n"
+            n += 1
+
+        error_count = 0
+        while True:
+            try:
+                # https://requests.readthedocs.io/en/latest/user/advanced/#advanced
+                # "good practice to set connect timeouts to slightly larger than a multiple of 3"
+                logger.debug(f"Submitting MSA request to {host_url}/{submission_endpoint}")
+                res = requests.post(
+                    f"{host_url}/{submission_endpoint}",
+                    data={"q": query, "mode": mode},
+                    timeout=6.02,
+                    headers=headers,
+                    auth=auth,
+                )
+                logger.debug(f"MSA submission response status: {res.status_code}")
+            except Exception as e:
+                error_count += 1
+                logger.warning(
+                    f"Error while fetching result from MSA server. Retrying... ({error_count}/5)"
+                )
+                logger.warning(f"Error: {e}")
+                if error_count > 5:
+                    raise Exception(
+                        "Too many failed attempts for the MSA generation request."
+                    )
+                time.sleep(5)
+            else:
+                break
+
+        try:
+            out = res.json()
+        except ValueError:
+            logger.error(f"Server didn't reply with json: {res.text}")
+            out = {"status": "ERROR"}
+        return out
+
+    def status(ID):
+        error_count = 0
+        while True:
+            try:
+                logger.debug(f"Checking MSA job status for ID: {ID}")
+                res = requests.get(
+                    f"{host_url}/ticket/{ID}", timeout=6.02, headers=headers, auth=auth
+                )
+                logger.debug(f"MSA status check response status: {res.status_code}")
+            except Exception as e:
+                error_count += 1
+                logger.warning(
+                    f"Error while fetching result from MSA server. Retrying... ({error_count}/5)"
+                )
+                logger.warning(f"Error: {e}")
+                if error_count > 5:
+                    raise Exception(
+                        "Too many failed attempts for the MSA generation request."
+                    )
+                time.sleep(5)
+            else:
+                break
+        try:
+            out = res.json()
+        except ValueError:
+            logger.error(f"Server didn't reply with json: {res.text}")
+            out = {"status": "ERROR"}
+        return out
+
+    def download(ID, path):
+        error_count = 0
+        while True:
+            try:
+                logger.debug(f"Downloading MSA results for ID: {ID}")
+                res = requests.get(
+                    f"{host_url}/result/download/{ID}", timeout=6.02, headers=headers, auth=auth
+                )
+                logger.debug(f"MSA download response status: {res.status_code}")
+            except Exception as e:
+                error_count += 1
+                logger.warning(
+                    f"Error while fetching result from MSA server. Retrying... ({error_count}/5)"
+                )
+                logger.warning(f"Error: {e}")
+                if error_count > 5:
+                    raise Exception(
+                        "Too many failed attempts for the MSA generation request."
+                    )
+                time.sleep(5)
+            else:
+                break
+        with open(path, "wb") as out:
+            out.write(res.content)
+
+    # process input x
+    seqs = [x] if isinstance(x, str) else x
+
+    # setup mode
+    if use_filter:
+        mode = "env" if use_env else "all"
+    else:
+        mode = "env-nofilter" if use_env else "nofilter"
+
+    if use_pairing:
+        mode = ""
+        # greedy is default, complete was the previous behavior
+        if pairing_strategy == "greedy":
+            mode = "pairgreedy"
+        elif pairing_strategy == "complete":
+            mode = "paircomplete"
+        if use_env:
+            mode = mode + "-env"
+
+    # define path
+    path = f"{prefix}_{mode}"
+    if not os.path.isdir(path):
+        os.mkdir(path)
+
+    # call mmseqs2 api
+    tar_gz_file = f"{path}/out.tar.gz"
+    N, REDO = 101, True
+
+    # deduplicate and keep track of order
+    seqs_unique = []
+    # TODO this might be slow for large sets
+    [seqs_unique.append(x) for x in seqs if x not in seqs_unique]
+    Ms = [N + seqs_unique.index(seq) for seq in seqs]
+    # lets do it!
+    if not os.path.isfile(tar_gz_file):
+        TIME_ESTIMATE = 150 * len(seqs_unique)
+        with tqdm(total=TIME_ESTIMATE, bar_format=TQDM_BAR_FORMAT) as pbar:
+            while REDO:
+                pbar.set_description("SUBMIT")
+
+                # Resubmit job until it goes through
+                out = submit(seqs_unique, mode, N)
+                while out["status"] in ["UNKNOWN", "RATELIMIT"]:
+                    sleep_time = 5 + random.randint(0, 5)
+                    logger.error(f"Sleeping for {sleep_time}s. Reason: {out['status']}")
+                    # resubmit
+                    time.sleep(sleep_time)
+                    out = submit(seqs_unique, mode, N)
+
+                if out["status"] == "ERROR":
+                    msg = (
+                        "MMseqs2 API is giving errors. Please confirm your "
+                        " input is a valid protein sequence. If error persists, "
+                        "please try again an hour later."
+                    )
+                    raise Exception(msg)
+
+                if out["status"] == "MAINTENANCE":
+                    msg = (
+                        "MMseqs2 API is undergoing maintenance. "
+                        "Please try again in a few minutes."
+                    )
+                    raise Exception(msg)
+
+                # wait for job to finish
+                ID, TIME = out["id"], 0
+                logger.debug(f"MSA job submitted successfully with ID: {ID}")
+                pbar.set_description(out["status"])
+                while out["status"] in ["UNKNOWN", "RUNNING", "PENDING"]:
+                    t = 5 + random.randint(0, 5)
+                    logger.error(f"Sleeping for {t}s. Reason: {out['status']}")
+                    time.sleep(t)
+                    out = status(ID)
+                    pbar.set_description(out["status"])
+                    if out["status"] == "RUNNING":
+                        TIME += t
+                        pbar.update(n=t)
+
+                if out["status"] == "COMPLETE":
+                    logger.debug(f"MSA job completed successfully for ID: {ID}")
+                    if TIME < TIME_ESTIMATE:
+                        pbar.update(n=(TIME_ESTIMATE - TIME))
+                    REDO = False
+
+                if out["status"] == "ERROR":
+                    REDO = False
+                    msg = (
+                        "MMseqs2 API is giving errors. Please confirm your "
+                        " input is a valid protein sequence. If error persists, "
+                        "please try again an hour later."
+                    )
+                    raise Exception(msg)
+
+            # Download results
+            download(ID, tar_gz_file)
+
+    # prep list of a3m files
+    if use_pairing:
+        a3m_files = [f"{path}/pair.a3m"]
+    else:
+        a3m_files = [f"{path}/uniref.a3m"]
+        if use_env:
+            a3m_files.append(f"{path}/bfd.mgnify30.metaeuk30.smag30.a3m")
+
+    # extract a3m files
+    if any(not os.path.isfile(a3m_file) for a3m_file in a3m_files):
+        with tarfile.open(tar_gz_file) as tar_gz:
+            tar_gz.extractall(path)
+
+    # gather a3m lines
+    a3m_lines = {}
+    for a3m_file in a3m_files:
+        update_M, M = True, None
+        for line in open(a3m_file, "r"):
+            if len(line) > 0:
+                if "\x00" in line:
+                    line = line.replace("\x00", "")
+                    update_M = True
+                if line.startswith(">") and update_M:
+                    M = int(line[1:].rstrip())
+                    update_M = False
+                    if M not in a3m_lines:
+                        a3m_lines[M] = []
+                a3m_lines[M].append(line)
+
+    a3m_lines = ["".join(a3m_lines[n]) for n in Ms]
+    return a3m_lines
diff --git a/forks/boltz/src/boltz/data/pad.py b/forks/boltz/src/boltz/data/pad.py
new file mode 100644
index 00000000..fe655e6a
--- /dev/null
+++ b/forks/boltz/src/boltz/data/pad.py
@@ -0,0 +1,84 @@
+import torch
+from torch import Tensor
+from torch.nn.functional import pad
+
+
+def pad_dim(data: Tensor, dim: int, pad_len: float, value: float = 0) -> Tensor:
+    """Pad a tensor along a given dimension.
+
+    Parameters
+    ----------
+    data : Tensor
+        The input tensor.
+    dim : int
+        The dimension to pad.
+    pad_len : float
+        The padding length.
+    value : int, optional
+        The value to pad with.
+
+    Returns
+    -------
+    Tensor
+        The padded tensor.
+
+    """
+    if pad_len == 0:
+        return data
+
+    total_dims = len(data.shape)
+    padding = [0] * (2 * (total_dims - dim))
+    padding[2 * (total_dims - 1 - dim) + 1] = pad_len
+    return pad(data, tuple(padding), value=value)
+
+
+def pad_to_max(data: list[Tensor], value: float = 0) -> tuple[Tensor, Tensor]:
+    """Pad the data in all dimensions to the maximum found.
+
+    Parameters
+    ----------
+    data : list[Tensor]
+        list of tensors to pad.
+    value : float
+        The value to use for padding.
+
+    Returns
+    -------
+    Tensor
+        The padded tensor.
+    Tensor
+        The padding mask.
+
+    """
+    if isinstance(data[0], str):
+        return data, 0
+
+    # Check if all have the same shape
+    if all(d.shape == data[0].shape for d in data):
+        return torch.stack(data, dim=0), 0
+
+    # Get the maximum in each dimension
+    num_dims = len(data[0].shape)
+    max_dims = [max(d.shape[i] for d in data) for i in range(num_dims)]
+
+    # Get the padding lengths
+    pad_lengths = []
+    for d in data:
+        dims = []
+        for i in range(num_dims):
+            dims.append(0)
+            dims.append(max_dims[num_dims - i - 1] - d.shape[num_dims - i - 1])
+        pad_lengths.append(dims)
+
+    # Pad the data
+    padding = [
+        pad(torch.ones_like(d), pad_len, value=0)
+        for d, pad_len in zip(data, pad_lengths)
+    ]
+    data = [pad(d, pad_len, value=value) for d, pad_len in zip(data, pad_lengths)]
+
+    # Stack the data
+    padding = torch.stack(padding, dim=0)
+    data = torch.stack(data, dim=0)
+
+    return data, padding
diff --git a/forks/boltz/src/boltz/data/parse/__init__.py b/forks/boltz/src/boltz/data/parse/__init__.py
new file mode 100644
index 00000000..e69de29b
diff --git a/forks/boltz/src/boltz/data/parse/a3m.py b/forks/boltz/src/boltz/data/parse/a3m.py
new file mode 100644
index 00000000..9df97140
--- /dev/null
+++ b/forks/boltz/src/boltz/data/parse/a3m.py
@@ -0,0 +1,134 @@
+import gzip
+from pathlib import Path
+from typing import Optional, TextIO
+
+import numpy as np
+
+from boltz.data import const
+from boltz.data.types import MSA, MSADeletion, MSAResidue, MSASequence
+
+
+def _parse_a3m(  # noqa: C901
+    lines: TextIO,
+    taxonomy: Optional[dict[str, str]],
+    max_seqs: Optional[int] = None,
+) -> MSA:
+    """Process an MSA file.
+
+    Parameters
+    ----------
+    lines : TextIO
+        The lines of the MSA file.
+    taxonomy : dict[str, str]
+        The taxonomy database, if available.
+    max_seqs : int, optional
+        The maximum number of sequences.
+
+    Returns
+    -------
+    MSA
+        The MSA object.
+
+    """
+    visited = set()
+    sequences = []
+    deletions = []
+    residues = []
+
+    seq_idx = 0
+    for line in lines:
+        line: str
+        line = line.strip()  # noqa: PLW2901
+        if not line or line.startswith("#"):
+            continue
+
+        # Get taxonomy, if annotated
+        if line.startswith(">"):
+            header = line.split()[0]
+            if taxonomy and header.startswith(">UniRef100"):
+                uniref_id = header.split("_")[1]
+                taxonomy_id = taxonomy.get(uniref_id)
+                if taxonomy_id is None:
+                    taxonomy_id = -1
+            else:
+                taxonomy_id = -1
+            continue
+
+        # Skip if duplicate sequence
+        str_seq = line.replace("-", "").upper()
+        if str_seq not in visited:
+            visited.add(str_seq)
+        else:
+            continue
+
+        # Process sequence
+        residue = []
+        deletion = []
+        count = 0
+        res_idx = 0
+        for c in line:
+            if c != "-" and c.islower():
+                count += 1
+                continue
+            token = const.prot_letter_to_token[c]
+            token = const.token_ids[token]
+            residue.append(token)
+            if count > 0:
+                deletion.append((res_idx, count))
+                count = 0
+            res_idx += 1
+
+        res_start = len(residues)
+        res_end = res_start + len(residue)
+
+        del_start = len(deletions)
+        del_end = del_start + len(deletion)
+
+        sequences.append((seq_idx, taxonomy_id, res_start, res_end, del_start, del_end))
+        residues.extend(residue)
+        deletions.extend(deletion)
+
+        seq_idx += 1
+        if (max_seqs is not None) and (seq_idx >= max_seqs):
+            break
+
+    # Create MSA object
+    msa = MSA(
+        residues=np.array(residues, dtype=MSAResidue),
+        deletions=np.array(deletions, dtype=MSADeletion),
+        sequences=np.array(sequences, dtype=MSASequence),
+    )
+    return msa
+
+
+def parse_a3m(
+    path: Path,
+    taxonomy: Optional[dict[str, str]],
+    max_seqs: Optional[int] = None,
+) -> MSA:
+    """Process an A3M file.
+
+    Parameters
+    ----------
+    path : Path
+        The path to the a3m(.gz) file.
+    taxonomy : Redis
+        The taxonomy database.
+    max_seqs : int, optional
+        The maximum number of sequences.
+
+    Returns
+    -------
+    MSA
+        The MSA object.
+
+    """
+    # Read the file
+    if path.suffix == ".gz":
+        with gzip.open(str(path), "rt") as f:
+            msa = _parse_a3m(f, taxonomy, max_seqs)
+    else:
+        with path.open("r") as f:
+            msa = _parse_a3m(f, taxonomy, max_seqs)
+
+    return msa
diff --git a/forks/boltz/src/boltz/data/parse/csv.py b/forks/boltz/src/boltz/data/parse/csv.py
new file mode 100644
index 00000000..cf26866a
--- /dev/null
+++ b/forks/boltz/src/boltz/data/parse/csv.py
@@ -0,0 +1,100 @@
+from pathlib import Path
+from typing import Optional
+
+import numpy as np
+import pandas as pd
+
+from boltz.data import const
+from boltz.data.types import MSA, MSADeletion, MSAResidue, MSASequence
+
+
+def parse_csv(
+    path: Path,
+    max_seqs: Optional[int] = None,
+) -> MSA:
+    """Process an A3M file.
+
+    Parameters
+    ----------
+    path : Path
+        The path to the a3m(.gz) file.
+    max_seqs : int, optional
+        The maximum number of sequences.
+
+    Returns
+    -------
+    MSA
+        The MSA object.
+
+    """
+    # Read file
+    data = pd.read_csv(path)
+
+    # Check columns
+    if tuple(sorted(data.columns)) != ("key", "sequence"):
+        msg = "Invalid CSV format, expected columns: ['sequence', 'key']"
+        raise ValueError(msg)
+
+    # Create taxonomy mapping
+    visited = set()
+    sequences = []
+    deletions = []
+    residues = []
+
+    seq_idx = 0
+    for line, key in zip(data["sequence"], data["key"]):
+        line: str
+        line = line.strip()  # noqa: PLW2901
+        if not line:
+            continue
+
+        # Get taxonomy, if annotated
+        taxonomy_id = -1
+        if (str(key) != "nan") and (key is not None) and (key != ""):
+            taxonomy_id = key
+
+        # Skip if duplicate sequence
+        str_seq = line.replace("-", "").upper()
+        if str_seq not in visited:
+            visited.add(str_seq)
+        else:
+            continue
+
+        # Process sequence
+        residue = []
+        deletion = []
+        count = 0
+        res_idx = 0
+        for c in line:
+            if c != "-" and c.islower():
+                count += 1
+                continue
+            token = const.prot_letter_to_token[c]
+            token = const.token_ids[token]
+            residue.append(token)
+            if count > 0:
+                deletion.append((res_idx, count))
+                count = 0
+            res_idx += 1
+
+        res_start = len(residues)
+        res_end = res_start + len(residue)
+
+        del_start = len(deletions)
+        del_end = del_start + len(deletion)
+
+        sequences.append((seq_idx, taxonomy_id, res_start, res_end, del_start, del_end))
+        residues.extend(residue)
+        deletions.extend(deletion)
+
+        seq_idx += 1
+        if (max_seqs is not None) and (seq_idx >= max_seqs):
+            break
+
+    # Create MSA object
+    msa = MSA(
+        residues=np.array(residues, dtype=MSAResidue),
+        deletions=np.array(deletions, dtype=MSADeletion),
+        sequences=np.array(sequences, dtype=MSASequence),
+    )
+    return msa
diff --git a/forks/boltz/src/boltz/data/parse/fasta.py b/forks/boltz/src/boltz/data/parse/fasta.py
new file mode 100644
index 00000000..114cf984
--- /dev/null
+++ b/forks/boltz/src/boltz/data/parse/fasta.py
@@ -0,0 +1,138 @@
+from collections.abc import Mapping
+from pathlib import Path
+
+from Bio import SeqIO
+from rdkit.Chem.rdchem import Mol
+
+from boltz.data.parse.yaml import parse_boltz_schema
+from boltz.data.types import Target
+
+
+def parse_fasta(  # noqa: C901, PLR0912
+    path: Path,
+    ccd: Mapping[str, Mol],
+    mol_dir: Path,
+    boltz2: bool = False,
+) -> Target:
+    """Parse a fasta file.
+
+    The name of the fasta file is used as the name of this job.
+    We rely on the fasta record id to determine the entity type.
+
+    > CHAIN_ID|ENTITY_TYPE|MSA_ID
+    SEQUENCE
+    > CHAIN_ID|ENTITY_TYPE|MSA_ID
+    ...
+
+    Where ENTITY_TYPE is either protein, rna, dna, ccd or smiles,
+    and CHAIN_ID is the chain identifier, which should be unique.
+    The MSA_ID is optional and should only be used on proteins.
+
+    Parameters
+    ----------
+    fasta_file : Path
+        Path to the fasta file.
+    ccd : Dict
+        Dictionary of CCD components.
+    mol_dir : Path
+        Path to the directory containing the molecules.
+    boltz2 : bool
+        Whether to parse the input for Boltz2.
+
+    Returns
+    -------
+    Target
+        The parsed target.
+
+    """
+    # Read fasta file
+    with path.open("r") as f:
+        records = list(SeqIO.parse(f, "fasta"))
+
+    # Make sure all records have a chain id and entity
+    for seq_record in records:
+        if "|" not in seq_record.id:
+            msg = f"Invalid record id: {seq_record.id}"
+            raise ValueError(msg)
+
+        header = seq_record.id.split("|")
+        assert len(header) >= 2, f"Invalid record id: {seq_record.id}"
+
+        chain_id, entity_type = header[:2]
+        if entity_type.lower() not in {"protein", "dna", "rna", "ccd", "smiles"}:
+            msg = f"Invalid entity type: {entity_type}"
+            raise ValueError(msg)
+        if chain_id == "":
+            msg = "Empty chain id in input fasta!"
+            raise ValueError(msg)
+        if entity_type == "":
+            msg = "Empty entity type in input fasta!"
+            raise ValueError(msg)
+
+    # Convert to yaml format
+    sequences = []
+    for seq_record in records:
+        # Get chain id, entity type and sequence
+        header = seq_record.id.split("|")
+        chain_id, entity_type = header[:2]
+        if len(header) == 3 and header[2] != "":
+            assert entity_type.lower() == "protein", (
+                "MSA_ID is only allowed for proteins"
+            )
+            msa_id = header[2]
+        else:
+            msa_id = None
+
+        entity_type = entity_type.upper()
+        seq = str(seq_record.seq)
+
+        if entity_type == "PROTEIN":
+            molecule = {
+                "protein": {
+                    "id": chain_id,
+                    "sequence": seq,
+                    "modifications": [],
+                    "msa": msa_id,
+                },
+            }
+        elif entity_type == "RNA":
+            molecule = {
+                "rna": {
+                    "id": chain_id,
+                    "sequence": seq,
+                    "modifications": [],
+                },
+            }
+        elif entity_type == "DNA":
+            molecule = {
+                "dna": {
+                    "id": chain_id,
+                    "sequence": seq,
+                    "modifications": [],
+                }
+            }
+        elif entity_type.upper() == "CCD":
+            molecule = {
+                "ligand": {
+                    "id": chain_id,
+                    "ccd": seq,
+                }
+            }
+        elif entity_type.upper() == "SMILES":
+            molecule = {
+                "ligand": {
+                    "id": chain_id,
+                    "smiles": seq,
+                }
+            }
+
+        sequences.append(molecule)
+
+    data = {
+        "sequences": sequences,
+        "bonds": [],
+        "version": 1,
+    }
+
+    name = path.stem
+    return parse_boltz_schema(name, data, ccd, mol_dir, boltz2)
diff --git a/forks/boltz/src/boltz/data/parse/mmcif.py b/forks/boltz/src/boltz/data/parse/mmcif.py
new file mode 100644
index 00000000..cade3c2d
--- /dev/null
+++ b/forks/boltz/src/boltz/data/parse/mmcif.py
@@ -0,0 +1,1239 @@
+import contextlib
+from collections import defaultdict
+from dataclasses import dataclass, replace
+from typing import Optional
+
+import gemmi
+import numpy as np
+from rdkit import rdBase
+from rdkit.Chem import AllChem
+from rdkit.Chem.rdchem import Mol
+from sklearn.neighbors import KDTree
+
+from boltz.data import const
+from boltz.data.mol import load_molecules
+from boltz.data.types import (
+    AtomV2,
+    BondV2,
+    Chain,
+    Coords,
+    Ensemble,
+    Interface,
+    Residue,
+    StructureInfo,
+    StructureV2,
+)
+
+####################################################################################################
+# DATACLASSES
+####################################################################################################
+
+
+@dataclass(frozen=True, slots=True)
+class ParsedAtom:
+    """A parsed atom object."""
+
+    name: str
+    coords: tuple[float, float, float]
+    is_present: bool
+    bfactor: float
+    plddt: Optional[float] = None
+
+
+@dataclass(frozen=True, slots=True)
+class ParsedBond:
+    """A parsed bond object."""
+
+    atom_1: int
+    atom_2: int
+    type: int
+
+
+@dataclass(frozen=True, slots=True)
+class ParsedResidue:
+    """A parsed residue object."""
+
+    name: str
+    type: int
+    idx: int
+    atoms: list[ParsedAtom]
+    bonds: list[ParsedBond]
+    orig_idx: Optional[int]
+    atom_center: int
+    atom_disto: int
+    is_standard: bool
+    is_present: bool
+
+
+@dataclass(frozen=True, slots=True)
+class ParsedChain:
+    """A parsed chain object."""
+
+    name: str
+    entity: str
+    type: int
+    residues: list[ParsedResidue]
+    sequence: Optional[str] = None
+
+
+@dataclass(frozen=True, slots=True)
+class ParsedConnection:
+    """A parsed connection object."""
+
+    chain_1: str
+    chain_2: str
+    residue_index_1: int
+    residue_index_2: int
+    atom_index_1: str
+    atom_index_2: str
+
+
+@dataclass(frozen=True, slots=True)
+class ParsedStructure:
+    """A parsed structure object."""
+
+    data: StructureV2
+    info: StructureInfo
+    sequences: dict[str, str]
+
+
+####################################################################################################
+# HELPERS
+####################################################################################################
+
+
+def get_mol(ccd: str, mols: dict, moldir: str) -> Mol:
+    """Get mol from CCD code.
+
+    Return mol with ccd from mols if it is in mols. Otherwise load it from moldir,
+    add it to mols, and return the mol.
+    """
+    mol = mols.get(ccd)
+    if mol is None:
+        # Load molecule
+        mol = load_molecules(moldir, [ccd])[ccd]
+
+        # Add to resource
+        if isinstance(mols, dict):
+            mols[ccd] = mol
+        else:
+            mols.set(ccd, mol)
+
+    return mol
+
+
+def get_dates(block: gemmi.cif.Block) -> tuple[str, str, str]:
+    """Get the deposited, released, and last revision dates.
+
+    Parameters
+    ----------
+    block : gemmi.cif.Block
+        The block to process.
+
+    Returns
+    -------
+    str
+        The deposited date.
+    str
+        The released date.
+    str
+        The last revision date.
+
+    """
+    deposited = "_pdbx_database_status.recvd_initial_deposition_date"
+    revision = "_pdbx_audit_revision_history.revision_date"
+    deposit_date = revision_date = release_date = ""
+    with contextlib.suppress(Exception):
+        deposit_date = block.find([deposited])[0][0]
+        release_date = block.find([revision])[0][0]
+        revision_date = block.find([revision])[-1][0]
+
+    return deposit_date, release_date, revision_date
+
+
+def get_resolution(block: gemmi.cif.Block) -> float:
+    """Get the resolution from a gemmi structure.
+
+    Parameters
+    ----------
+    block : gemmi.cif.Block
+        The block to process.
+
+    Returns
+    -------
+    float
+        The resolution.
+
+    """
+    resolution = 0.0
+    for res_key in (
+        "_refine.ls_d_res_high",
+        "_em_3d_reconstruction.resolution",
+        "_reflns.d_resolution_high",
+    ):
+        with contextlib.suppress(Exception):
+            resolution = float(block.find([res_key])[0].str(0))
+            break
+    return resolution
+
+
+def get_method(block: gemmi.cif.Block) -> str:
+    """Get the method from a gemmi structure.
+
+    Parameters
+    ----------
+    block : gemmi.cif.Block
+        The block to process.
+
+    Returns
+    -------
+    str
+        The method.
+
+    """
+    method = ""
+    method_key = "_exptl.method"
+    with contextlib.suppress(Exception):
+        methods = block.find([method_key])
+        method = ",".join([m.str(0).lower() for m in methods])
+
+    return method
+
+
+def get_experiment_conditions(
+    block: gemmi.cif.Block,
+) -> tuple[Optional[float], Optional[float]]:
+    """Get temperature and pH.
+
+    Parameters
+    ----------
+    block : gemmi.cif.Block
+        The block to process.
+
+    Returns
+    -------
+    tuple[float, float]
+        The temperature and pH.
+    """
+    temperature = None
+    ph = None
+
+    keys_t = [
+        "_exptl_crystal_grow.temp",
+        "_pdbx_nmr_exptl_sample_conditions.temperature",
+    ]
+    for key in keys_t:
+        with contextlib.suppress(Exception):
+            temperature = float(block.find([key])[0][0])
+            break
+
+    keys_ph = ["_exptl_crystal_grow.pH", "_pdbx_nmr_exptl_sample_conditions.pH"]
+    with contextlib.suppress(Exception):
+        for key in keys_ph:
+            ph = float(block.find([key])[0][0])
+            break
+
+    return temperature, ph
+
+
+def get_unk_token(dtype: gemmi.PolymerType) -> str:
+    """Get the unknown token for a given entity type.
+
+    Parameters
+    ----------
+    dtype : gemmi.EntityType
+        The entity type.
+
+    Returns
+    -------
+    str
+        The unknown token.
+
+    """
+    if dtype == gemmi.PolymerType.PeptideL:
+        unk = const.unk_token["PROTEIN"]
+    elif dtype == gemmi.PolymerType.Dna:
+        unk = const.unk_token["DNA"]
+    elif dtype == gemmi.PolymerType.Rna:
+        unk = const.unk_token["RNA"]
+    else:
+        msg = f"Unknown polymer type: {dtype}"
+        raise ValueError(msg)
+
+    return unk
+
+
+def compute_covalent_ligands(
+    connections: list[gemmi.Connection],
+    subchain_map: dict[tuple[str, int], str],
+    entities: dict[str, gemmi.Entity],
+) -> set[str]:
+    """Compute the covalent ligands from a list of connections.
+
+    Parameters
+    ----------
+    connections: list[gemmi.Connection]
+        The connections to process.
+    subchain_map: dict[tuple[str, int], str]
+        The mapping from chain, residue index to subchain name.
+    entities: dict[str, gemmi.Entity]
+        The entities in the structure.
+
+    Returns
+    -------
+    set
+        The covalent ligand subchains.
+
+    """
+    # Get covalent chain ids
+    covalent_chain_ids = set()
+    for connection in connections:
+        if connection.type.name != "Covale":
+            continue
+
+        # Map to correct subchain
+        chain_1_name = connection.partner1.chain_name
+        chain_2_name = connection.partner2.chain_name
+
+        res_1_id = connection.partner1.res_id.seqid
+        res_1_id = str(res_1_id.num) + str(res_1_id.icode).strip()
+
+        res_2_id = connection.partner2.res_id.seqid
+        res_2_id = str(res_2_id.num) + str(res_2_id.icode).strip()
+
+        subchain_1 = subchain_map[(chain_1_name, res_1_id)]
+        subchain_2 = subchain_map[(chain_2_name, res_2_id)]
+
+        # If non-polymer or branched, add to set
+        entity_1 = entities[subchain_1].entity_type.name
+        entity_2 = entities[subchain_2].entity_type.name
+
+        if entity_1 in {"NonPolymer", "Branched"}:
+            covalent_chain_ids.add(subchain_1)
+        if entity_2 in {"NonPolymer", "Branched"}:
+            covalent_chain_ids.add(subchain_2)
+
+    return covalent_chain_ids
+
+
+def compute_interfaces(atom_data: np.ndarray, chain_data: np.ndarray) -> np.ndarray:
+    """Compute the chain-chain interfaces from a gemmi structure.
+
+    Parameters
+    ----------
+    atom_data : list[tuple]
+        The atom data.
+    chain_data : list[tuple]
+        The chain data.
+
+    Returns
+    -------
+    list[tuple[int, int]]
+        The interfaces.
+
+    """
+    # Compute chain_id per atom
+    chain_ids = []
+    for idx, chain in enumerate(chain_data):
+        chain_ids.extend([idx] * chain["atom_num"])
+    chain_ids = np.array(chain_ids)
+
+    # Filter to present atoms
+    coords = atom_data["coords"]
+    mask = atom_data["is_present"]
+
+    coords = coords[mask]
+    chain_ids = chain_ids[mask]
+
+    # Compute the distance matrix
+    tree = KDTree(coords, metric="euclidean")
+    query = tree.query_radius(coords, const.atom_interface_cutoff)
+
+    # Get unique chain pairs
+    interfaces = set()
+    for c1, pairs in zip(chain_ids, query):
+        chains = np.unique(chain_ids[pairs])
+        chains = chains[chains != c1]
+        interfaces.update((c1, c2) for c2 in chains)
+
+    # Get unique chain pairs
+    interfaces = [(min(i, j), max(i, j)) for i, j in interfaces]
+    interfaces = list({(int(i), int(j)) for i, j in interfaces})
+    interfaces = np.array(interfaces, dtype=Interface)
+    return interfaces
+
+
+####################################################################################################
+# PARSING
+####################################################################################################
+
+
+def parse_ccd_residue(  # noqa: PLR0915, C901
+    name: str,
+    ref_mol: Mol,
+    res_idx: int,
+    gemmi_mol: Optional[gemmi.Residue] = None,
+    is_covalent: bool = False,
+) -> Optional[ParsedResidue]:
+    """Parse an MMCIF ligand.
+
+    First tries to get the SMILES string from the RCSB.
+    Then, tries to infer atom ordering using RDKit.
+
+    Parameters
+    ----------
+    name: str
+        The name of the molecule to parse.
+    components : dict
+        The preprocessed PDB components dictionary.
+    res_idx : int
+        The residue index.
+    gemmi_mol : Optional[gemmi.Residue]
+        The PDB molecule, as a gemmi Residue object, if any.
+
+    Returns
+    -------
+    ParsedResidue, optional
+       The output ParsedResidue, if successful.
+
+    """
+    # Check if we have a PDB structure for this residue,
+    # it could be a missing residue from the sequence
+    is_present = gemmi_mol is not None
+
+    # Save original index (required for parsing connections)
+    if is_present:
+        orig_idx = gemmi_mol.seqid
+        orig_idx = str(orig_idx.num) + str(orig_idx.icode).strip()
+    else:
+        orig_idx = None
+
+    # Remove hydrogens
+    ref_mol = AllChem.RemoveHs(ref_mol, sanitize=False)
+
+    # Check if this is a single atom CCD residue
+    if ref_mol.GetNumAtoms() == 1:
+        pos = (0, 0, 0)
+        bfactor = 0
+        if is_present:
+            pos = (
+                gemmi_mol[0].pos.x,
+                gemmi_mol[0].pos.y,
+                gemmi_mol[0].pos.z,
+            )
+            bfactor = gemmi_mol[0].b_iso
+        ref_atom = ref_mol.GetAtoms()[0]
+        atom = ParsedAtom(
+            name=ref_atom.GetProp("name"),
+            coords=pos,
+            is_present=is_present,
+            bfactor=bfactor,
+        )
+        unk_prot_id = const.unk_token_ids["PROTEIN"]
+        residue = ParsedResidue(
+            name=name,
+            type=unk_prot_id,
+            atoms=[atom],
+            bonds=[],
+            idx=res_idx,
+            orig_idx=orig_idx,
+            atom_center=0,  # Placeholder, no center
+            atom_disto=0,  # Placeholder, no center
+            is_standard=False,
+            is_present=is_present,
+        )
+        return residue
+
+    # If multi-atom, start by getting the PDB coordinates
+    pdb_pos = {}
+    bfactor = {}
+    if is_present:
+        # Match atoms based on names
+        for atom in gemmi_mol:
+            atom: gemmi.Atom
+            pos = (atom.pos.x, atom.pos.y, atom.pos.z)
+            pdb_pos[atom.name] = pos
+            bfactor[atom.name] = atom.b_iso
+    # Parse each atom in order of the reference mol
+    atoms = []
+    atom_idx = 0
+    idx_map = {}  # Used for bonds later
+
+    for i, atom in enumerate(ref_mol.GetAtoms()):
+        # Get atom name, charge, element and reference coordinates
+        atom_name = atom.GetProp("name")
+
+        # If the atom is a leaving atom, skip if not in the PDB and is_covalent
+        if (
+            atom.HasProp("leaving_atom")
+            and int(atom.GetProp("leaving_atom")) == 1
+            and is_covalent
+            and (atom_name not in pdb_pos)
+        ):
+            continue
+
+        # Get PDB coordinates, if any
+        coords = pdb_pos.get(atom_name)
+        if coords is None:
+            atom_is_present = False
+            coords = (0, 0, 0)
+        else:
+            atom_is_present = True
+
+        # Add atom to list
+        atoms.append(
+            ParsedAtom(
+                name=atom_name,
+                coords=coords,
+                is_present=atom_is_present,
+                bfactor=bfactor.get(atom_name, 0),
+            )
+        )
+        idx_map[i] = atom_idx
+        atom_idx += 1
+
+    # Load bonds
+    bonds = []
+    unk_bond = const.bond_type_ids[const.unk_bond_type]
+    for bond in ref_mol.GetBonds():
+        idx_1 = bond.GetBeginAtomIdx()
+        idx_2 = bond.GetEndAtomIdx()
+
+        # Skip bonds with atoms ignored
+        if (idx_1 not in idx_map) or (idx_2 not in idx_map):
+            continue
+
+        idx_1 = idx_map[idx_1]
+        idx_2 = idx_map[idx_2]
+        start = min(idx_1, idx_2)
+        end = max(idx_1, idx_2)
+        bond_type = bond.GetBondType().name
+        bond_type = const.bond_type_ids.get(bond_type, unk_bond)
+        bonds.append(ParsedBond(start, end, bond_type))
+
+    unk_prot_id = const.unk_token_ids["PROTEIN"]
+    return ParsedResidue(
+        name=name,
+        type=unk_prot_id,
+        atoms=atoms,
+        bonds=bonds,
+        idx=res_idx,
+        atom_center=0,
+        atom_disto=0,
+        orig_idx=orig_idx,
+        is_standard=False,
+        is_present=is_present,
+    )
+
+
+def parse_polymer(  # noqa: C901, PLR0915, PLR0912
+    polymer: gemmi.ResidueSpan,
+    polymer_type: gemmi.PolymerType,
+    sequence: list[str],
+    chain_id: str,
+    entity: str,
+    mols: dict[str, Mol],
+    moldir: str,
+) -> Optional[ParsedChain]:
+    """Process a gemmi Polymer into a chain object.
+
+    Performs alignment of the full sequence to the polymer
+    residues. Loads coordinates and masks for the atoms in
+    the polymer, following the ordering in const.atom_order.
+
+    Parameters
+    ----------
+    polymer : gemmi.ResidueSpan
+        The polymer to process.
+    polymer_type : gemmi.PolymerType
+        The polymer type.
+    sequence : str
+        The full sequence of the polymer.
+    chain_id : str
+        The chain identifier.
+    entity : str
+        The entity name.
+    components : dict[str, Mol]
+        The preprocessed PDB components dictionary.
+
+    Returns
+    -------
+    ParsedChain, optional
+        The output chain, if successful.
+
+    Raises
+    ------
+    ValueError
+        If the alignment fails.
+
+    """
+    # Ignore microheterogeneities (pick first)
+    sequence = [gemmi.Entity.first_mon(item) for item in sequence]
+
+    # Align full sequence to polymer residues
+    # This is a simple way to handle all the different numbering schemes
+    result = gemmi.align_sequence_to_polymer(
+        sequence,
+        polymer,
+        polymer_type,
+        gemmi.AlignmentScoring(),
+    )
+
+    # Get coordinates and masks
+    i = 0
+    ref_res = set(const.tokens)
+    parsed = []
+    for j, match in enumerate(result.match_string):
+        # Get residue name from sequence
+        res_name = sequence[j]
+
+        # Check if we have a match in the structure
+        res = None
+        name_to_atom = {}
+
+        if match == "|":
+            # Get pdb residue
+            res = polymer[i]
+            name_to_atom = {a.name.upper(): a for a in res}
+
+            # Double check the match
+            if res.name != res_name:
+                msg = "Alignment mismatch!"
+                raise ValueError(msg)
+
+            # Increment polymer index
+            i += 1
+
+        # Map MSE to MET, put the selenium atom in the sulphur column
+        if res_name == "MSE":
+            res_name = "MET"
+            if "SE" in name_to_atom:
+                name_to_atom["SD"] = name_to_atom["SE"]
+
+        # Handle non-standard residues
+        elif res_name not in ref_res:
+            modified_mol = get_mol(res_name, mols, moldir)
+            if modified_mol is not None:
+                residue = parse_ccd_residue(
+                    name=res_name,
+                    ref_mol=modified_mol,
+                    res_idx=j,
+                    gemmi_mol=res,
+                    is_covalent=True,
+                )
+                parsed.append(residue)
+                continue
+            else:  # noqa: RET507
+                res_name = "UNK"
+
+        # Load regular residues
+        ref_mol = get_mol(res_name, mols, moldir)
+        ref_mol = AllChem.RemoveHs(ref_mol, sanitize=False)
+
+        # Only use reference atoms set in constants
+        ref_name_to_atom = {a.GetProp("name"): a for a in ref_mol.GetAtoms()}
+        ref_atoms = [ref_name_to_atom[a] for a in const.ref_atoms[res_name]]
+
+        # Iterate, always in the same order
+        atoms: list[ParsedAtom] = []
+
+        for ref_atom in ref_atoms:
+            # Get atom name
+            atom_name = ref_atom.GetProp("name")
+
+            # Get coordinates from PDB
+            if atom_name in name_to_atom:
+                atom: gemmi.Atom = name_to_atom[atom_name]
+                atom_is_present = True
+                coords = (atom.pos.x, atom.pos.y, atom.pos.z)
+                bfactor = atom.b_iso
+            else:
+                atom_is_present = False
+                coords = (0, 0, 0)
+                bfactor = 0
+
+            # Add atom to list
+            atoms.append(
+                ParsedAtom(
+                    name=atom_name,
+                    coords=coords,
+                    is_present=atom_is_present,
+                    bfactor=bfactor,
+                )
+            )
+
+        # Fix naming errors in arginine residues where NH2 is
+        # incorrectly assigned to be closer to CD than NH1
+        if (res is not None) and (res_name == "ARG"):
+            ref_atoms: list[str] = const.ref_atoms["ARG"]
+            cd = atoms[ref_atoms.index("CD")]
+            nh1 = atoms[ref_atoms.index("NH1")]
+            nh2 = atoms[ref_atoms.index("NH2")]
+
+            cd_coords = np.array(cd.coords)
+            nh1_coords = np.array(nh1.coords)
+            nh2_coords = np.array(nh2.coords)
+
+            if all(atom.is_present for atom in (cd, nh1, nh2)) and (
+                np.linalg.norm(nh1_coords - cd_coords)
+                > np.linalg.norm(nh2_coords - cd_coords)
+            ):
+                atoms[ref_atoms.index("NH1")] = replace(nh1, coords=nh2.coords)
+                atoms[ref_atoms.index("NH2")] = replace(nh2, coords=nh1.coords)
+
+        # Add residue to parsed list
+        if res is not None:
+            orig_idx = res.seqid
+            orig_idx = str(orig_idx.num) + str(orig_idx.icode).strip()
+        else:
+            orig_idx = None
+
+        atom_center = const.res_to_center_atom_id[res_name]
+        atom_disto = const.res_to_disto_atom_id[res_name]
+        parsed.append(
+            ParsedResidue(
+                name=res_name,
+                type=const.token_ids[res_name],
+                atoms=atoms,
+                bonds=[],
+                idx=j,
+                atom_center=atom_center,
+                atom_disto=atom_disto,
+                is_standard=True,
+                is_present=res is not None,
+                orig_idx=orig_idx,
+            )
+        )
+
+    # Get polymer class
+    if polymer_type == gemmi.PolymerType.PeptideL:
+        chain_type = const.chain_type_ids["PROTEIN"]
+    elif polymer_type == gemmi.PolymerType.Dna:
+        chain_type = const.chain_type_ids["DNA"]
+    elif polymer_type == gemmi.PolymerType.Rna:
+        chain_type = const.chain_type_ids["RNA"]
+
+    # Return polymer object
+    return ParsedChain(
+        name=chain_id,
+        entity=entity,
+        residues=parsed,
+        type=chain_type,
+        sequence=gemmi.one_letter_code(sequence),
+    )
+
+
+def parse_connection(
+    connection: gemmi.Connection,
+    chains: list[ParsedChain],
+    subchain_map: dict[tuple[str, int], str],
+) -> ParsedConnection:
+    """Parse (covalent) connection from a gemmi Connection.
+
+    Parameters
+    ----------
+    connections : gemmi.Connectionlist
+        The connection list to parse.
+    chains : list[Chain]
+        The parsed chains.
+    subchain_map : dict[tuple[str, int], str]
+        The mapping from chain, residue index to subchain name.
+
+    Returns
+    -------
+    list[Connection]
+        The parsed connections.
+
+    """
+    # Map to correct subchains
+    chain_1_name = connection.partner1.chain_name
+    chain_2_name = connection.partner2.chain_name
+
+    res_1_id = connection.partner1.res_id.seqid
+    res_1_id = str(res_1_id.num) + str(res_1_id.icode).strip()
+
+    res_2_id = connection.partner2.res_id.seqid
+    res_2_id = str(res_2_id.num) + str(res_2_id.icode).strip()
+
+    subchain_1 = subchain_map[(chain_1_name, res_1_id)]
+    subchain_2 = subchain_map[(chain_2_name, res_2_id)]
+
+    # Get chain indices
+    chain_1 = next(chain for chain in chains if (chain.name == subchain_1))
+    chain_2 = next(chain for chain in chains if (chain.name == subchain_2))
+
+    # Get residue indices
+    res_1_idx, res_1 = next(
+        (idx, res)
+        for idx, res in enumerate(chain_1.residues)
+        if (res.orig_idx == res_1_id)
+    )
+    res_2_idx, res_2 = next(
+        (idx, res)
+        for idx, res in enumerate(chain_2.residues)
+        if (res.orig_idx == res_2_id)
+    )
+
+    # Get atom indices
+    atom_index_1 = next(
+        idx
+        for idx, atom in enumerate(res_1.atoms)
+        if atom.name == connection.partner1.atom_name
+    )
+    atom_index_2 = next(
+        idx
+        for idx, atom in enumerate(res_2.atoms)
+        if atom.name == connection.partner2.atom_name
+    )
+
+    conn = ParsedConnection(
+        chain_1=subchain_1,
+        chain_2=subchain_2,
+        residue_index_1=res_1_idx,
+        residue_index_2=res_2_idx,
+        atom_index_1=atom_index_1,
+        atom_index_2=atom_index_2,
+    )
+
+    return conn
+
+
+def parse_mmcif(  # noqa: C901, PLR0915, PLR0912
+    path: str,
+    mols: Optional[dict[str, Mol]] = None,
+    moldir: Optional[str] = None,
+    use_assembly: bool = True,
+    compute_interfaces: bool = True,
+) -> ParsedStructure:
+    """Parse a structure in MMCIF format.
+
+    Parameters
+    ----------
+    mmcif_file : PathLike
+        Path to the MMCIF file.
+    components: Mapping[str, Mol]
+        The preprocessed PDB components dictionary.
+
+    Returns
+    -------
+    ParsedStructure
+        The parsed structure.
+
+    """
+    # Disable rdkit warnings
+    blocker = rdBase.BlockLogs()  # noqa: F841
+
+    # set mols
+    mols = {} if mols is None else mols
+
+    # Parse MMCIF input file
+    block = gemmi.cif.read(str(path))[0]
+
+    # Extract medatadata
+    deposit_date, release_date, revision_date = get_dates(block)
+    resolution = get_resolution(block)
+    method = get_method(block)
+    temperature, ph = get_experiment_conditions(block)
+
+    # Load structure object
+    structure = gemmi.make_structure_from_block(block)
+
+    # Clean up the structure
+    structure.merge_chain_parts()
+    structure.remove_waters()
+    structure.remove_hydrogens()
+    structure.remove_alternative_conformations()
+    structure.remove_empty_chains()
+
+    # Expand assembly 1
+    if use_assembly and structure.assemblies:
+        how = gemmi.HowToNameCopiedChain.AddNumber
+        assembly_name = structure.assemblies[0].name
+        structure.transform_to_assembly(assembly_name, how=how)
+
+    # Parse entities
+    # Create mapping from subchain id to entity
+    entities: dict[str, gemmi.Entity] = {}
+    entity_ids: dict[str, int] = {}
+    for entity_id, entity in enumerate(structure.entities):
+        entity: gemmi.Entity
+        if entity.entity_type.name == "Water":
+            continue
+        for subchain_id in entity.subchains:
+            entities[subchain_id] = entity
+            entity_ids[subchain_id] = entity_id
+
+    # Create mapping from chain, residue to subchains
+    # since a Connection uses the chains and not subchins
+    subchain_map = {}
+    for chain in structure[0]:
+        for residue in chain:
+            seq_id = residue.seqid
+            seq_id = str(seq_id.num) + str(seq_id.icode).strip()
+            subchain_map[(chain.name, seq_id)] = residue.subchain
+
+    # Find covalent ligands
+    covalent_chain_ids = compute_covalent_ligands(
+        connections=structure.connections,
+        subchain_map=subchain_map,
+        entities=entities,
+    )
+
+    # Parse chains
+    chains: list[ParsedChain] = []
+    for raw_chain in structure[0].subchains():
+        # Check chain type
+        subchain_id = raw_chain.subchain_id()
+        entity: gemmi.Entity = entities[subchain_id]
+        entity_type = entity.entity_type.name
+
+        # Parse a polymer
+        if entity_type == "Polymer":
+            # Skip PeptideD, DnaRnaHybrid, Pna, Other
+            if entity.polymer_type.name not in {
+                "PeptideL",
+                "Dna",
+                "Rna",
+            }:
+                continue
+
+            # Add polymer if successful
+            parsed_polymer = parse_polymer(
+                polymer=raw_chain,
+                polymer_type=entity.polymer_type,
+                sequence=entity.full_sequence,
+                chain_id=subchain_id,
+                entity=entity.name,
+                mols=mols,
+                moldir=moldir,
+            )
+            if parsed_polymer is not None:
+                chains.append(parsed_polymer)
+
+        # Parse a non-polymer
+        elif entity_type in {"NonPolymer", "Branched"}:
+            # Skip UNL
+            if any(lig.name == "UNL" for lig in raw_chain):
+                continue
+
+            residues = []
+            for lig_idx, ligand in enumerate(raw_chain):
+                # Check if ligand is covalent
+                if entity_type == "Branched":
+                    is_covalent = True
+                else:
+                    is_covalent = subchain_id in covalent_chain_ids
+
+                ligand: gemmi.Residue
+                ligand_mol = get_mol(ligand.name, mols, moldir)
+
+                residue = parse_ccd_residue(
+                    name=ligand.name,
+                    ref_mol=ligand_mol,
+                    res_idx=lig_idx,
+                    gemmi_mol=ligand,
+                    is_covalent=is_covalent,
+                )
+                residues.append(residue)
+
+            if residues:
+                chains.append(
+                    ParsedChain(
+                        name=subchain_id,
+                        entity=entity.name,
+                        residues=residues,
+                        type=const.chain_type_ids["NONPOLYMER"],
+                    )
+                )
+
+    # If no chains parsed fail
+    if not chains:
+        msg = "No chains parsed!"
+        raise ValueError(msg)
+
+    # Want to traverse subchains in same order as reference structure
+    ref_chain_map = {ref_chain.name: i for i, ref_chain in enumerate(chains)}
+    all_ensembles = [chains]
+
+    # Loop through different structures in model
+    for struct in list(structure)[1:]:
+        struct: gemmi.Model
+        ensemble_chains = {}
+
+        for raw_chain in struct.subchains():
+            # Check chain type
+            subchain_id = raw_chain.subchain_id()
+            entity: gemmi.Entity = entities[subchain_id]
+            entity_type = entity.entity_type.name
+
+            # Parse a polymer
+            if entity_type == "Polymer":
+                # Skip PeptideD, DnaRnaHybrid, Pna, Other
+                if entity.polymer_type.name not in {
+                    "PeptideL",
+                    "Dna",
+                    "Rna",
+                }:
+                    continue
+
+                # Add polymer if successful
+                parsed_polymer = parse_polymer(
+                    polymer=raw_chain,
+                    polymer_type=entity.polymer_type,
+                    sequence=entity.full_sequence,
+                    chain_id=subchain_id,
+                    entity=entity.name,
+                    mols=mols,
+                    moldir=moldir,
+                )
+                if parsed_polymer is not None:
+                    ensemble_chains[ref_chain_map[subchain_id]] = parsed_polymer
+
+            # Parse a non-polymer
+            elif entity_type in {"NonPolymer", "Branched"}:
+                # Skip UNL
+                if any(lig.name == "UNL" for lig in raw_chain):
+                    continue
+
+                residues = []
+                for lig_idx, ligand in enumerate(raw_chain):
+                    # Check if ligand is covalent
+                    if entity_type == "Branched":
+                        is_covalent = True
+                    else:
+                        is_covalent = subchain_id in covalent_chain_ids
+
+                    ligand: gemmi.Residue
+                    ligand_mol = get_mol(ligand.name, mols, moldir)
+
+                    residue = parse_ccd_residue(
+                        name=ligand.name,
+                        ref_mol=ligand_mol,
+                        res_idx=lig_idx,
+                        gemmi_mol=ligand,
+                        is_covalent=is_covalent,
+                    )
+                    residues.append(residue)
+
+                if residues:
+                    parsed_non_polymer = ParsedChain(
+                        name=subchain_id,
+                        entity=entity.name,
+                        residues=residues,
+                        type=const.chain_type_ids["NONPOLYMER"],
+                    )
+                    ensemble_chains[ref_chain_map[subchain_id]] = parsed_non_polymer
+
+        # Ensure ensemble chains are in the same order as reference structure
+        ensemble_chains = [ensemble_chains[idx] for idx in range(len(ensemble_chains))]
+        all_ensembles.append(ensemble_chains)
+
+    # Parse covalent connections
+    connections: list[ParsedConnection] = []
+    for connection in structure.connections:
+        # Skip non-covalent connections
+        connection: gemmi.Connection
+        if connection.type.name != "Covale":
+            continue
+        try:
+            parsed_connection = parse_connection(
+                connection=connection,
+                chains=chains,
+                subchain_map=subchain_map,
+            )
+        except Exception:  # noqa: S112, BLE001
+            continue
+        connections.append(parsed_connection)
+
+    # Create tables
+    atom_data = []
+    bond_data = []
+    res_data = []
+    chain_data = []
+    ensemble_data = []
+    coords_data = defaultdict(list)
+
+    # Convert parsed chains to tables
+    atom_idx = 0
+    res_idx = 0
+    sym_count = {}
+    chain_to_idx = {}
+    res_to_idx = {}
+    chain_to_seq = {}
+
+    for asym_id, chain in enumerate(chains):
+        # Compute number of atoms and residues
+        res_num = len(chain.residues)
+        atom_num = sum(len(res.atoms) for res in chain.residues)
+
+        # Get same chain across models in ensemble
+        ensemble_chains = [ensemble[asym_id] for ensemble in all_ensembles]
+        assert len(ensemble_chains) == len(all_ensembles)
+        for ensemble_chain in ensemble_chains:
+            assert len(ensemble_chain.residues) == res_num
+            assert sum(len(res.atoms) for res in ensemble_chain.residues) == atom_num
+
+        # Find all copies of this chain in the assembly
+        entity_id = entity_ids[chain.name]
+        sym_id = sym_count.get(entity_id, 0)
+        chain_data.append(
+            (
+                chain.name,
+                chain.type,
+                entity_id,
+                sym_id,
+                asym_id,
+                atom_idx,
+                atom_num,
+                res_idx,
+                res_num,
+                0,
+            )
+        )
+        chain_to_idx[chain.name] = asym_id
+        sym_count[entity_id] = sym_id + 1
+        if chain.sequence is not None:
+            chain_to_seq[chain.name] = chain.sequence
+
+        # Add residue, atom, bond, data
+        for i, res in enumerate(chain.residues):
+            # Get same residue across models in ensemble
+            ensemble_residues = [
+                ensemble_chain.residues[i] for ensemble_chain in ensemble_chains
+            ]
+            assert len(ensemble_residues) == len(all_ensembles)
+            for ensemble_res in ensemble_residues:
+                assert ensemble_res.name == res.name
+
+            atom_center = atom_idx + res.atom_center
+            atom_disto = atom_idx + res.atom_disto
+            res_data.append(
+                (
+                    res.name,
+                    res.type,
+                    res.idx,
+                    atom_idx,
+                    len(res.atoms),
+                    atom_center,
+                    atom_disto,
+                    res.is_standard,
+                    res.is_present,
+                )
+            )
+            res_to_idx[(chain.name, i)] = (res_idx, atom_idx)
+
+            for bond in res.bonds:
+                chain_1 = asym_id
+                chain_2 = asym_id
+                res_1 = res_idx
+                res_2 = res_idx
+                atom_1 = atom_idx + bond.atom_1
+                atom_2 = atom_idx + bond.atom_2
+                bond_data.append(
+                    (
+                        chain_1,
+                        chain_2,
+                        res_1,
+                        res_2,
+                        atom_1,
+                        atom_2,
+                        bond.type,
+                    )
+                )
+
+            for a_idx, atom in enumerate(res.atoms):
+                # Get same atom across models in ensemble
+                ensemble_atoms = [
+                    ensemble_res.atoms[a_idx] for ensemble_res in ensemble_residues
+                ]
+                assert len(ensemble_atoms) == len(all_ensembles)
+                for e_idx, ensemble_atom in enumerate(ensemble_atoms):
+                    assert ensemble_atom.name == atom.name
+                    assert atom.is_present == ensemble_atom.is_present
+
+                    coords_data[e_idx].append(ensemble_atom.coords)
+
+                atom_data.append(
+                    (
+                        atom.name,
+                        atom.coords,
+                        atom.is_present,
+                        atom.bfactor,
+                        1.0,  # plddt is 1 for real data
+                    )
+                )
+                atom_idx += 1
+
+            res_idx += 1
+
+    # Create coordinates table
+    coords_data_ = []
+    for e_idx in range(len(coords_data)):
+        ensemble_data.append((e_idx * atom_idx, atom_idx))
+        coords_data_.append(coords_data[e_idx])
+    coords_data = [(x,) for xs in coords_data_ for x in xs]
+
+    # Convert connections to tables
+    for conn in connections:
+        chain_1_idx = chain_to_idx[conn.chain_1]
+        chain_2_idx = chain_to_idx[conn.chain_2]
+        res_1_idx, atom_1_offset = res_to_idx[(conn.chain_1, conn.residue_index_1)]
+        res_2_idx, atom_2_offset = res_to_idx[(conn.chain_2, conn.residue_index_2)]
+        atom_1_idx = atom_1_offset + conn.atom_index_1
+        atom_2_idx = atom_2_offset + conn.atom_index_2
+        bond_data.append(
+            (
+                chain_1_idx,
+                chain_2_idx,
+                res_1_idx,
+                res_2_idx,
+                atom_1_idx,
+                atom_2_idx,
+                const.bond_type_ids["COVALENT"],
+            )
+        )
+
+    # Convert into datatypes
+    atoms = np.array(atom_data, dtype=AtomV2)
+    bonds = np.array(bond_data, dtype=BondV2)
+    residues = np.array(res_data, dtype=Residue)
+    chains = np.array(chain_data, dtype=Chain)
+    mask = np.ones(len(chain_data), dtype=bool)
+    ensemble = np.array(ensemble_data, dtype=Ensemble)
+    coords = np.array(coords_data, dtype=Coords)
+
+    # Compute interface chains (find chains with a heavy atom within 5A)
+    if compute_interfaces:
+        interfaces = compute_interfaces(atoms, chains)
+    else:
+        interfaces = np.array([], dtype=Interface)
+
+    # Return parsed structure
+    info = StructureInfo(
+        deposited=deposit_date,
+        revised=revision_date,
+        released=release_date,
+        resolution=resolution,
+        method=method,
+        num_chains=len(chains),
+        num_interfaces=len(interfaces),
+        temperature=temperature,
+        pH=ph,
+    )
+
+    data = StructureV2(
+        atoms=atoms,
+        bonds=bonds,
+        residues=residues,
+        chains=chains,
+        interfaces=interfaces,
+        mask=mask,
+        ensemble=ensemble,
+        coords=coords,
+    )
+
+    return ParsedStructure(
+        data=data,
+        info=info,
+        sequences=chain_to_seq,
+    )
diff --git a/forks/boltz/src/boltz/data/parse/mmcif_with_constraints.py b/forks/boltz/src/boltz/data/parse/mmcif_with_constraints.py
new file mode 100644
index 00000000..6a5b0409
--- /dev/null
+++ b/forks/boltz/src/boltz/data/parse/mmcif_with_constraints.py
@@ -0,0 +1,1607 @@
+import contextlib
+from collections import defaultdict
+from dataclasses import dataclass, replace
+from typing import Optional
+
+import gemmi
+import numpy as np
+from rdkit import Chem, rdBase
+from rdkit.Chem import AllChem, HybridizationType
+from rdkit.Chem.rdchem import BondStereo, Mol
+from rdkit.Chem.rdDistGeom import GetMoleculeBoundsMatrix
+from rdkit.Chem.rdMolDescriptors import CalcNumHeavyAtoms
+from sklearn.neighbors import KDTree
+
+from boltz.data import const
+from boltz.data.mol import load_molecules
+from boltz.data.types import (
+    AtomV2,
+    BondV2,
+    Chain,
+    ChiralAtomConstraint,
+    Coords,
+    Ensemble,
+    Interface,
+    PlanarBondConstraint,
+    PlanarRing5Constraint,
+    PlanarRing6Constraint,
+    RDKitBoundsConstraint,
+    Residue,
+    ResidueConstraints,
+    StereoBondConstraint,
+    StructureInfo,
+    StructureV2,
+)
+
+####################################################################################################
+# DATACLASSES
+####################################################################################################
+
+
+@dataclass(frozen=True, slots=True)
+class ParsedAtom:
+    """A parsed atom object."""
+
+    name: str
+    coords: tuple[float, float, float]
+    is_present: bool
+    bfactor: float
+    plddt: Optional[float] = None
+
+
+@dataclass(frozen=True, slots=True)
+class ParsedBond:
+    """A parsed bond object."""
+
+    atom_1: int
+    atom_2: int
+    type: int
+
+
+@dataclass(frozen=True)
+class ParsedRDKitBoundsConstraint:
+    """A parsed RDKit bounds constraint object."""
+
+    atom_idxs: tuple[int, int]
+    is_bond: bool
+    is_angle: bool
+    upper_bound: float
+    lower_bound: float
+
+
+@dataclass(frozen=True)
+class ParsedChiralAtomConstraint:
+    """A parsed chiral atom constraint object."""
+
+    atom_idxs: tuple[int, int, int, int]
+    is_reference: bool
+    is_r: bool
+
+
+@dataclass(frozen=True)
+class ParsedStereoBondConstraint:
+    """A parsed stereo bond constraint object."""
+
+    atom_idxs: tuple[int, int, int, int]
+    is_check: bool
+    is_e: bool
+
+
+@dataclass(frozen=True)
+class ParsedPlanarBondConstraint:
+    """A parsed planar bond constraint object."""
+
+    atom_idxs: tuple[int, int, int, int, int, int]
+
+
+@dataclass(frozen=True)
+class ParsedPlanarRing5Constraint:
+    """A parsed planar bond constraint object."""
+
+    atom_idxs: tuple[int, int, int, int, int]
+
+
+@dataclass(frozen=True)
+class ParsedPlanarRing6Constraint:
+    """A parsed planar bond constraint object."""
+
+    atom_idxs: tuple[int, int, int, int, int, int]
+
+
+@dataclass(frozen=True, slots=True)
+class ParsedResidue:
+    """A parsed residue object."""
+
+    name: str
+    type: int
+    idx: int
+    atoms: list[ParsedAtom]
+    bonds: list[ParsedBond]
+    orig_idx: Optional[int]
+    atom_center: int
+    atom_disto: int
+    is_standard: bool
+    is_present: bool
+    rdkit_bounds_constraints: Optional[list[ParsedRDKitBoundsConstraint]] = None
+    chiral_atom_constraints: Optional[list[ParsedChiralAtomConstraint]] = None
+    stereo_bond_constraints: Optional[list[ParsedStereoBondConstraint]] = None
+    planar_bond_constraints: Optional[list[ParsedPlanarBondConstraint]] = None
+    planar_ring_5_constraints: Optional[list[ParsedPlanarRing5Constraint]] = None
+    planar_ring_6_constraints: Optional[list[ParsedPlanarRing6Constraint]] = None
+
+
+@dataclass(frozen=True, slots=True)
+class ParsedChain:
+    """A parsed chain object."""
+
+    name: str
+    entity: str
+    type: int
+    residues: list[ParsedResidue]
+    sequence: Optional[str] = None
+
+
+@dataclass(frozen=True, slots=True)
+class ParsedConnection:
+    """A parsed connection object."""
+
+    chain_1: str
+    chain_2: str
+    residue_index_1: int
+    residue_index_2: int
+    atom_index_1: str
+    atom_index_2: str
+
+
+@dataclass(frozen=True, slots=True)
+class ParsedStructure:
+    """A parsed structure object."""
+
+    data: StructureV2
+    info: StructureInfo
+    sequences: dict[str, str]
+    residue_constraints: Optional[ResidueConstraints] = None
+
+
+####################################################################################################
+# HELPERS
+####################################################################################################
+
+
+def get_mol(ccd: str, mols: dict, moldir: str) -> Mol:
+    """Get mol from CCD code.
+
+    Return mol with ccd from mols if it is in mols. Otherwise load it from moldir,
+    add it to mols, and return the mol.
+    """
+    mol = mols.get(ccd)
+    if mol is None:
+        # Load molecule
+        mol = load_molecules(moldir, [ccd])[ccd]
+
+        # Add to resource
+        if isinstance(mols, dict):
+            mols[ccd] = mol
+        else:
+            mols.set(ccd, mol)
+
+    return mol
+
+
+def get_dates(block: gemmi.cif.Block) -> tuple[str, str, str]:
+    """Get the deposited, released, and last revision dates.
+
+    Parameters
+    ----------
+    block : gemmi.cif.Block
+        The block to process.
+
+    Returns
+    -------
+    str
+        The deposited date.
+    str
+        The released date.
+    str
+        The last revision date.
+
+    """
+    deposited = "_pdbx_database_status.recvd_initial_deposition_date"
+    revision = "_pdbx_audit_revision_history.revision_date"
+    deposit_date = revision_date = release_date = ""
+    with contextlib.suppress(Exception):
+        deposit_date = block.find([deposited])[0][0]
+        release_date = block.find([revision])[0][0]
+        revision_date = block.find([revision])[-1][0]
+
+    return deposit_date, release_date, revision_date
+
+
+def get_resolution(block: gemmi.cif.Block) -> float:
+    """Get the resolution from a gemmi structure.
+
+    Parameters
+    ----------
+    block : gemmi.cif.Block
+        The block to process.
+
+    Returns
+    -------
+    float
+        The resolution.
+
+    """
+    resolution = 0.0
+    for res_key in (
+        "_refine.ls_d_res_high",
+        "_em_3d_reconstruction.resolution",
+        "_reflns.d_resolution_high",
+    ):
+        with contextlib.suppress(Exception):
+            resolution = float(block.find([res_key])[0].str(0))
+            break
+    return resolution
+
+
+def get_method(block: gemmi.cif.Block) -> str:
+    """Get the method from a gemmi structure.
+
+    Parameters
+    ----------
+    block : gemmi.cif.Block
+        The block to process.
+
+    Returns
+    -------
+    str
+        The method.
+
+    """
+    method = ""
+    method_key = "_exptl.method"
+    with contextlib.suppress(Exception):
+        methods = block.find([method_key])
+        method = ",".join([m.str(0).lower() for m in methods])
+
+    return method
+
+
+def get_experiment_conditions(
+    block: gemmi.cif.Block,
+) -> tuple[Optional[float], Optional[float]]:
+    """Get temperature and pH.
+
+    Parameters
+    ----------
+    block : gemmi.cif.Block
+        The block to process.
+
+    Returns
+    -------
+    tuple[float, float]
+        The temperature and pH.
+    """
+    temperature = None
+    ph = None
+
+    keys_t = [
+        "_exptl_crystal_grow.temp",
+        "_pdbx_nmr_exptl_sample_conditions.temperature",
+    ]
+    for key in keys_t:
+        with contextlib.suppress(Exception):
+            temperature = float(block.find([key])[0][0])
+            break
+
+    keys_ph = ["_exptl_crystal_grow.pH", "_pdbx_nmr_exptl_sample_conditions.pH"]
+    with contextlib.suppress(Exception):
+        for key in keys_ph:
+            ph = float(block.find([key])[0][0])
+            break
+
+    return temperature, ph
+
+
+def get_unk_token(dtype: gemmi.PolymerType) -> str:
+    """Get the unknown token for a given entity type.
+
+    Parameters
+    ----------
+    dtype : gemmi.EntityType
+        The entity type.
+
+    Returns
+    -------
+    str
+        The unknown token.
+
+    """
+    if dtype == gemmi.PolymerType.PeptideL:
+        unk = const.unk_token["PROTEIN"]
+    elif dtype == gemmi.PolymerType.Dna:
+        unk = const.unk_token["DNA"]
+    elif dtype == gemmi.PolymerType.Rna:
+        unk = const.unk_token["RNA"]
+    else:
+        msg = f"Unknown polymer type: {dtype}"
+        raise ValueError(msg)
+
+    return unk
+
+
+def compute_covalent_ligands(
+    connections: list[gemmi.Connection],
+    subchain_map: dict[tuple[str, int], str],
+    entities: dict[str, gemmi.Entity],
+) -> set[str]:
+    """Compute the covalent ligands from a list of connections.
+
+    Parameters
+    ----------
+    connections: list[gemmi.Connection]
+        The connections to process.
+    subchain_map: dict[tuple[str, int], str]
+        The mapping from chain, residue index to subchain name.
+    entities: dict[str, gemmi.Entity]
+        The entities in the structure.
+
+    Returns
+    -------
+    set
+        The covalent ligand subchains.
+
+    """
+    # Get covalent chain ids
+    covalent_chain_ids = set()
+    for connection in connections:
+        if connection.type.name != "Covale":
+            continue
+
+        # Map to correct subchain
+        chain_1_name = connection.partner1.chain_name
+        chain_2_name = connection.partner2.chain_name
+
+        res_1_id = connection.partner1.res_id.seqid
+        res_1_id = str(res_1_id.num) + str(res_1_id.icode).strip()
+
+        res_2_id = connection.partner2.res_id.seqid
+        res_2_id = str(res_2_id.num) + str(res_2_id.icode).strip()
+
+        subchain_1 = subchain_map[(chain_1_name, res_1_id)]
+        subchain_2 = subchain_map[(chain_2_name, res_2_id)]
+
+        # If non-polymer or branched, add to set
+        entity_1 = entities[subchain_1].entity_type.name
+        entity_2 = entities[subchain_2].entity_type.name
+
+        if entity_1 in {"NonPolymer", "Branched"}:
+            covalent_chain_ids.add(subchain_1)
+        if entity_2 in {"NonPolymer", "Branched"}:
+            covalent_chain_ids.add(subchain_2)
+
+    return covalent_chain_ids
+
+
+def compute_interfaces(atom_data: np.ndarray, chain_data: np.ndarray) -> np.ndarray:
+    """Compute the chain-chain interfaces from a gemmi structure.
+
+    Parameters
+    ----------
+    atom_data : list[tuple]
+        The atom data.
+    chain_data : list[tuple]
+        The chain data.
+
+    Returns
+    -------
+    list[tuple[int, int]]
+        The interfaces.
+
+    """
+    # Compute chain_id per atom
+    chain_ids = []
+    for idx, chain in enumerate(chain_data):
+        chain_ids.extend([idx] * chain["atom_num"])
+    chain_ids = np.array(chain_ids)
+
+    # Filter to present atoms
+    coords = atom_data["coords"]
+    mask = atom_data["is_present"]
+
+    coords = coords[mask]
+    chain_ids = chain_ids[mask]
+
+    # Compute the distance matrix
+    tree = KDTree(coords, metric="euclidean")
+    query = tree.query_radius(coords, const.atom_interface_cutoff)
+
+    # Get unique chain pairs
+    interfaces = set()
+    for c1, pairs in zip(chain_ids, query):
+        chains = np.unique(chain_ids[pairs])
+        chains = chains[chains != c1]
+        interfaces.update((c1, c2) for c2 in chains)
+
+    # Get unique chain pairs
+    interfaces = [(min(i, j), max(i, j)) for i, j in interfaces]
+    interfaces = list({(int(i), int(j)) for i, j in interfaces})
+    interfaces = np.array(interfaces, dtype=Interface)
+    return interfaces
+
+
+####################################################################################################
+# CONSTRAINTS
+####################################################################################################
+
+
+def compute_geometry_constraints(mol: Mol, idx_map):
+    if mol.GetNumAtoms() <= 1:
+        return []
+
+    bounds = GetMoleculeBoundsMatrix(
+        mol,
+        set15bounds=True,
+        scaleVDW=True,
+        doTriangleSmoothing=True,
+        useMacrocycle14config=False,
+    )
+    bonds = set(
+        tuple(sorted(b)) for b in mol.GetSubstructMatches(Chem.MolFromSmarts("*~*"))
+    )
+    angles = set(
+        tuple(sorted([a[0], a[2]]))
+        for a in mol.GetSubstructMatches(Chem.MolFromSmarts("*~*~*"))
+    )
+
+    constraints = []
+    for i, j in zip(*np.triu_indices(mol.GetNumAtoms(), k=1)):
+        if i in idx_map and j in idx_map:
+            constraint = ParsedRDKitBoundsConstraint(
+                atom_idxs=(idx_map[i], idx_map[j]),
+                is_bond=tuple(sorted([i, j])) in bonds,
+                is_angle=tuple(sorted([i, j])) in angles,
+                upper_bound=bounds[i, j],
+                lower_bound=bounds[j, i],
+            )
+            constraints.append(constraint)
+    return constraints
+
+
+def compute_chiral_atom_constraints(mol, idx_map):
+    constraints = []
+    if all([atom.HasProp("_CIPRank") for atom in mol.GetAtoms()]):
+        for center_idx, orientation in Chem.FindMolChiralCenters(
+            mol, includeUnassigned=False
+        ):
+            center = mol.GetAtomWithIdx(center_idx)
+            neighbors = [
+                (neighbor.GetIdx(), int(neighbor.GetProp("_CIPRank")))
+                for neighbor in center.GetNeighbors()
+            ]
+            neighbors = sorted(
+                neighbors, key=lambda neighbor: neighbor[1], reverse=True
+            )
+            neighbors = tuple(neighbor[0] for neighbor in neighbors)
+            is_r = orientation == "R"
+
+            if len(neighbors) > 4 or center.GetHybridization() != HybridizationType.SP3:
+                continue
+
+            atom_idxs = (*neighbors[:3], center_idx)
+            if all(i in idx_map for i in atom_idxs):
+                constraints.append(
+                    ParsedChiralAtomConstraint(
+                        atom_idxs=tuple(idx_map[i] for i in atom_idxs),
+                        is_reference=True,
+                        is_r=is_r,
+                    )
+                )
+
+            if len(neighbors) == 4:
+                for skip_idx in range(3):
+                    chiral_set = neighbors[:skip_idx] + neighbors[skip_idx + 1 :]
+                    if skip_idx % 2 == 0:
+                        atom_idxs = chiral_set[::-1] + (center_idx,)
+                    else:
+                        atom_idxs = chiral_set + (center_idx,)
+                    if all(i in idx_map for i in atom_idxs):
+                        constraints.append(
+                            ParsedChiralAtomConstraint(
+                                atom_idxs=tuple(idx_map[i] for i in atom_idxs),
+                                is_reference=False,
+                                is_r=is_r,
+                            )
+                        )
+    return constraints
+
+
+def compute_stereo_bond_constraints(mol, idx_map):
+    constraints = []
+    if all([atom.HasProp("_CIPRank") for atom in mol.GetAtoms()]):
+        for bond in mol.GetBonds():
+            stereo = bond.GetStereo()
+            if stereo in {BondStereo.STEREOE, BondStereo.STEREOZ}:
+                start_atom_idx, end_atom_idx = (
+                    bond.GetBeginAtomIdx(),
+                    bond.GetEndAtomIdx(),
+                )
+                start_neighbors = [
+                    (neighbor.GetIdx(), int(neighbor.GetProp("_CIPRank")))
+                    for neighbor in mol.GetAtomWithIdx(start_atom_idx).GetNeighbors()
+                    if neighbor.GetIdx() != end_atom_idx
+                ]
+                start_neighbors = sorted(
+                    start_neighbors, key=lambda neighbor: neighbor[1], reverse=True
+                )
+                start_neighbors = [neighbor[0] for neighbor in start_neighbors]
+                end_neighbors = [
+                    (neighbor.GetIdx(), int(neighbor.GetProp("_CIPRank")))
+                    for neighbor in mol.GetAtomWithIdx(end_atom_idx).GetNeighbors()
+                    if neighbor.GetIdx() != start_atom_idx
+                ]
+                end_neighbors = sorted(
+                    end_neighbors, key=lambda neighbor: neighbor[1], reverse=True
+                )
+                end_neighbors = [neighbor[0] for neighbor in end_neighbors]
+                is_e = stereo == BondStereo.STEREOE
+
+                atom_idxs = (
+                    start_neighbors[0],
+                    start_atom_idx,
+                    end_atom_idx,
+                    end_neighbors[0],
+                )
+                if all(i in idx_map for i in atom_idxs):
+                    constraints.append(
+                        ParsedStereoBondConstraint(
+                            atom_idxs=tuple(idx_map[i] for i in atom_idxs),
+                            is_check=True,
+                            is_e=is_e,
+                        )
+                    )
+
+                if len(start_neighbors) == 2 and len(end_neighbors) == 2:
+                    atom_idxs = (
+                        start_neighbors[1],
+                        start_atom_idx,
+                        end_atom_idx,
+                        end_neighbors[1],
+                    )
+                    if all(i in idx_map for i in atom_idxs):
+                        constraints.append(
+                            ParsedStereoBondConstraint(
+                                atom_idxs=tuple(idx_map[i] for i in atom_idxs),
+                                is_check=False,
+                                is_e=is_e,
+                            )
+                        )
+    return constraints
+
+
+def compute_flatness_constraints(mol, idx_map):
+    planar_double_bond_smarts = Chem.MolFromSmarts("[C;X3;^2](*)(*)=[C;X3;^2](*)(*)")
+    aromatic_ring_5_smarts = Chem.MolFromSmarts("[ar5^2]1[ar5^2][ar5^2][ar5^2][ar5^2]1")
+    aromatic_ring_6_smarts = Chem.MolFromSmarts(
+        "[ar6^2]1[ar6^2][ar6^2][ar6^2][ar6^2][ar6^2]1"
+    )
+
+    planar_double_bond_constraints = []
+    aromatic_ring_5_constraints = []
+    aromatic_ring_6_constraints = []
+    for match in mol.GetSubstructMatches(planar_double_bond_smarts):
+        if all(i in idx_map for i in match):
+            planar_double_bond_constraints.append(
+                ParsedPlanarBondConstraint(atom_idxs=tuple(idx_map[i] for i in match))
+            )
+    for match in mol.GetSubstructMatches(aromatic_ring_5_smarts):
+        if all(i in idx_map for i in match):
+            aromatic_ring_5_constraints.append(
+                ParsedPlanarRing5Constraint(atom_idxs=tuple(idx_map[i] for i in match))
+            )
+    for match in mol.GetSubstructMatches(aromatic_ring_6_smarts):
+        if all(i in idx_map for i in match):
+            aromatic_ring_6_constraints.append(
+                ParsedPlanarRing6Constraint(atom_idxs=tuple(idx_map[i] for i in match))
+            )
+
+    return (
+        planar_double_bond_constraints,
+        aromatic_ring_5_constraints,
+        aromatic_ring_6_constraints,
+    )
+
+
+####################################################################################################
+# PARSING
+####################################################################################################
+
+
+def parse_ccd_residue(  # noqa: PLR0915, C901
+    name: str,
+    ref_mol: Mol,
+    res_idx: int,
+    gemmi_mol: Optional[gemmi.Residue] = None,
+    is_covalent: bool = False,
+) -> Optional[ParsedResidue]:
+    """Parse an MMCIF ligand.
+
+    First tries to get the SMILES string from the RCSB.
+    Then, tries to infer atom ordering using RDKit.
+
+    Parameters
+    ----------
+    name: str
+        The name of the molecule to parse.
+    components : dict
+        The preprocessed PDB components dictionary.
+    res_idx : int
+        The residue index.
+    gemmi_mol : Optional[gemmi.Residue]
+        The PDB molecule, as a gemmi Residue object, if any.
+
+    Returns
+    -------
+    ParsedResidue, optional
+       The output ParsedResidue, if successful.
+
+    """
+    # Check if we have a PDB structure for this residue,
+    # it could be a missing residue from the sequence
+    is_present = gemmi_mol is not None
+
+    # Save original index (required for parsing connections)
+    if is_present:
+        orig_idx = gemmi_mol.seqid
+        orig_idx = str(orig_idx.num) + str(orig_idx.icode).strip()
+    else:
+        orig_idx = None
+
+    # Check if this is a single heavy atom CCD residue
+    if CalcNumHeavyAtoms(ref_mol) == 1:
+        # Remove hydrogens
+        ref_mol = AllChem.RemoveHs(ref_mol, sanitize=False)
+
+        pos = (0, 0, 0)
+        bfactor = 0
+        if is_present:
+            pos = (
+                gemmi_mol[0].pos.x,
+                gemmi_mol[0].pos.y,
+                gemmi_mol[0].pos.z,
+            )
+            bfactor = gemmi_mol[0].b_iso
+        ref_atom = ref_mol.GetAtoms()[0]
+        atom = ParsedAtom(
+            name=ref_atom.GetProp("name"),
+            coords=pos,
+            is_present=is_present,
+            bfactor=bfactor,
+        )
+        unk_prot_id = const.unk_token_ids["PROTEIN"]
+        residue = ParsedResidue(
+            name=name,
+            type=unk_prot_id,
+            atoms=[atom],
+            bonds=[],
+            idx=res_idx,
+            orig_idx=orig_idx,
+            atom_center=0,  # Placeholder, no center
+            atom_disto=0,  # Placeholder, no center
+            is_standard=False,
+            is_present=is_present,
+        )
+        return residue
+
+    # If multi-atom, start by getting the PDB coordinates
+    pdb_pos = {}
+    bfactor = {}
+    if is_present:
+        # Match atoms based on names
+        for atom in gemmi_mol:
+            atom: gemmi.Atom
+            pos = (atom.pos.x, atom.pos.y, atom.pos.z)
+            pdb_pos[atom.name] = pos
+            bfactor[atom.name] = atom.b_iso
+    # Parse each atom in order of the reference mol
+    atoms = []
+    atom_idx = 0
+    idx_map = {}  # Used for bonds later
+
+    for i, atom in enumerate(ref_mol.GetAtoms()):
+        # Ignore Hydrogen atoms
+        if atom.GetAtomicNum() == 1:
+            continue
+
+        # Get atom name, charge, element and reference coordinates
+        atom_name = atom.GetProp("name")
+
+        # If the atom is a leaving atom, skip if not in the PDB and is_covalent
+        if (
+            atom.HasProp("leaving_atom")
+            and int(atom.GetProp("leaving_atom")) == 1
+            and is_covalent
+            and (atom_name not in pdb_pos)
+        ):
+            continue
+
+        # Get PDB coordinates, if any
+        coords = pdb_pos.get(atom_name)
+        if coords is None:
+            atom_is_present = False
+            coords = (0, 0, 0)
+        else:
+            atom_is_present = True
+
+        # Add atom to list
+        atoms.append(
+            ParsedAtom(
+                name=atom_name,
+                coords=coords,
+                is_present=atom_is_present,
+                bfactor=bfactor.get(atom_name, 0),
+            )
+        )
+        idx_map[i] = atom_idx
+        atom_idx += 1
+
+    # Load bonds
+    bonds = []
+    unk_bond = const.bond_type_ids[const.unk_bond_type]
+    for bond in ref_mol.GetBonds():
+        idx_1 = bond.GetBeginAtomIdx()
+        idx_2 = bond.GetEndAtomIdx()
+
+        # Skip bonds with atoms ignored
+        if (idx_1 not in idx_map) or (idx_2 not in idx_map):
+            continue
+
+        idx_1 = idx_map[idx_1]
+        idx_2 = idx_map[idx_2]
+        start = min(idx_1, idx_2)
+        end = max(idx_1, idx_2)
+        bond_type = bond.GetBondType().name
+        bond_type = const.bond_type_ids.get(bond_type, unk_bond)
+        bonds.append(ParsedBond(start, end, bond_type))
+
+    rdkit_bounds_constraints = compute_geometry_constraints(ref_mol, idx_map)
+    chiral_atom_constraints = compute_chiral_atom_constraints(ref_mol, idx_map)
+    stereo_bond_constraints = compute_stereo_bond_constraints(ref_mol, idx_map)
+    planar_bond_constraints, planar_ring_5_constraints, planar_ring_6_constraints = (
+        compute_flatness_constraints(ref_mol, idx_map)
+    )
+
+    unk_prot_id = const.unk_token_ids["PROTEIN"]
+    return ParsedResidue(
+        name=name,
+        type=unk_prot_id,
+        atoms=atoms,
+        bonds=bonds,
+        idx=res_idx,
+        atom_center=0,
+        atom_disto=0,
+        orig_idx=orig_idx,
+        is_standard=False,
+        is_present=is_present,
+        rdkit_bounds_constraints=rdkit_bounds_constraints,
+        chiral_atom_constraints=chiral_atom_constraints,
+        stereo_bond_constraints=stereo_bond_constraints,
+        planar_bond_constraints=planar_bond_constraints,
+        planar_ring_5_constraints=planar_ring_5_constraints,
+        planar_ring_6_constraints=planar_ring_6_constraints,
+    )
+
+
+def parse_polymer(  # noqa: C901, PLR0915, PLR0912
+    polymer: gemmi.ResidueSpan,
+    polymer_type: gemmi.PolymerType,
+    sequence: list[str],
+    chain_id: str,
+    entity: str,
+    mols: dict[str, Mol],
+    moldir: str,
+) -> Optional[ParsedChain]:
+    """Process a gemmi Polymer into a chain object.
+
+    Performs alignment of the full sequence to the polymer
+    residues. Loads coordinates and masks for the atoms in
+    the polymer, following the ordering in const.atom_order.
+
+    Parameters
+    ----------
+    polymer : gemmi.ResidueSpan
+        The polymer to process.
+    polymer_type : gemmi.PolymerType
+        The polymer type.
+    sequence : str
+        The full sequence of the polymer.
+    chain_id : str
+        The chain identifier.
+    entity : str
+        The entity name.
+    components : dict[str, Mol]
+        The preprocessed PDB components dictionary.
+
+    Returns
+    -------
+    ParsedChain, optional
+        The output chain, if successful.
+
+    Raises
+    ------
+    ValueError
+        If the alignment fails.
+
+    """
+    # Ignore microheterogeneities (pick first)
+    sequence = [gemmi.Entity.first_mon(item) for item in sequence]
+
+    # Align full sequence to polymer residues
+    # This is a simple way to handle all the different numbering schemes
+    result = gemmi.align_sequence_to_polymer(
+        sequence,
+        polymer,
+        polymer_type,
+        gemmi.AlignmentScoring(),
+    )
+
+    # Get coordinates and masks
+    i = 0
+    ref_res = set(const.tokens)
+    parsed = []
+    for j, match in enumerate(result.match_string):
+        # Get residue name from sequence
+        res_name = sequence[j]
+
+        # Check if we have a match in the structure
+        res = None
+        name_to_atom = {}
+
+        if match == "|":
+            # Get pdb residue
+            res = polymer[i]
+            name_to_atom = {a.name.upper(): a for a in res}
+
+            # Double check the match
+            if res.name != res_name:
+                msg = "Alignment mismatch!"
+                raise ValueError(msg)
+
+            # Increment polymer index
+            i += 1
+
+        # Map MSE to MET, put the selenium atom in the sulphur column
+        if res_name == "MSE":
+            res_name = "MET"
+            if "SE" in name_to_atom:
+                name_to_atom["SD"] = name_to_atom["SE"]
+
+        # Handle non-standard residues
+        elif res_name not in ref_res:
+            modified_mol = get_mol(res_name, mols, moldir)
+            if modified_mol is not None:
+                residue = parse_ccd_residue(
+                    name=res_name,
+                    ref_mol=modified_mol,
+                    res_idx=j,
+                    gemmi_mol=res,
+                    is_covalent=True,
+                )
+                parsed.append(residue)
+                continue
+            else:  # noqa: RET507
+                res_name = "UNK"
+
+        # Load regular residues
+        ref_mol = get_mol(res_name, mols, moldir)
+        ref_mol = AllChem.RemoveHs(ref_mol, sanitize=False)
+
+        # Only use reference atoms set in constants
+        ref_name_to_atom = {a.GetProp("name"): a for a in ref_mol.GetAtoms()}
+        ref_atoms = [ref_name_to_atom[a] for a in const.ref_atoms[res_name]]
+
+        # Iterate, always in the same order
+        atoms: list[ParsedAtom] = []
+
+        for ref_atom in ref_atoms:
+            # Get atom name
+            atom_name = ref_atom.GetProp("name")
+
+            # Get coordinates from PDB
+            if atom_name in name_to_atom:
+                atom: gemmi.Atom = name_to_atom[atom_name]
+                atom_is_present = True
+                coords = (atom.pos.x, atom.pos.y, atom.pos.z)
+                bfactor = atom.b_iso
+            else:
+                atom_is_present = False
+                coords = (0, 0, 0)
+                bfactor = 0
+
+            # Add atom to list
+            atoms.append(
+                ParsedAtom(
+                    name=atom_name,
+                    coords=coords,
+                    is_present=atom_is_present,
+                    bfactor=bfactor,
+                )
+            )
+
+        # Fix naming errors in arginine residues where NH2 is
+        # incorrectly assigned to be closer to CD than NH1
+        if (res is not None) and (res_name == "ARG"):
+            ref_atoms: list[str] = const.ref_atoms["ARG"]
+            cd = atoms[ref_atoms.index("CD")]
+            nh1 = atoms[ref_atoms.index("NH1")]
+            nh2 = atoms[ref_atoms.index("NH2")]
+
+            cd_coords = np.array(cd.coords)
+            nh1_coords = np.array(nh1.coords)
+            nh2_coords = np.array(nh2.coords)
+
+            if all(atom.is_present for atom in (cd, nh1, nh2)) and (
+                np.linalg.norm(nh1_coords - cd_coords)
+                > np.linalg.norm(nh2_coords - cd_coords)
+            ):
+                atoms[ref_atoms.index("NH1")] = replace(nh1, coords=nh2.coords)
+                atoms[ref_atoms.index("NH2")] = replace(nh2, coords=nh1.coords)
+
+        # Add residue to parsed list
+        if res is not None:
+            orig_idx = res.seqid
+            orig_idx = str(orig_idx.num) + str(orig_idx.icode).strip()
+        else:
+            orig_idx = None
+
+        atom_center = const.res_to_center_atom_id[res_name]
+        atom_disto = const.res_to_disto_atom_id[res_name]
+        parsed.append(
+            ParsedResidue(
+                name=res_name,
+                type=const.token_ids[res_name],
+                atoms=atoms,
+                bonds=[],
+                idx=j,
+                atom_center=atom_center,
+                atom_disto=atom_disto,
+                is_standard=True,
+                is_present=res is not None,
+                orig_idx=orig_idx,
+            )
+        )
+
+    # Get polymer class
+    if polymer_type == gemmi.PolymerType.PeptideL:
+        chain_type = const.chain_type_ids["PROTEIN"]
+    elif polymer_type == gemmi.PolymerType.Dna:
+        chain_type = const.chain_type_ids["DNA"]
+    elif polymer_type == gemmi.PolymerType.Rna:
+        chain_type = const.chain_type_ids["RNA"]
+
+    # Return polymer object
+    return ParsedChain(
+        name=chain_id,
+        entity=entity,
+        residues=parsed,
+        type=chain_type,
+        sequence=gemmi.one_letter_code(sequence),
+    )
+
+
+def parse_connection(
+    connection: gemmi.Connection,
+    chains: list[ParsedChain],
+    subchain_map: dict[tuple[str, int], str],
+) -> ParsedConnection:
+    """Parse (covalent) connection from a gemmi Connection.
+
+    Parameters
+    ----------
+    connections : gemmi.Connectionlist
+        The connection list to parse.
+    chains : list[Chain]
+        The parsed chains.
+    subchain_map : dict[tuple[str, int], str]
+        The mapping from chain, residue index to subchain name.
+
+    Returns
+    -------
+    list[Connection]
+        The parsed connections.
+
+    """
+    # Map to correct subchains
+    chain_1_name = connection.partner1.chain_name
+    chain_2_name = connection.partner2.chain_name
+
+    res_1_id = connection.partner1.res_id.seqid
+    res_1_id = str(res_1_id.num) + str(res_1_id.icode).strip()
+
+    res_2_id = connection.partner2.res_id.seqid
+    res_2_id = str(res_2_id.num) + str(res_2_id.icode).strip()
+
+    subchain_1 = subchain_map[(chain_1_name, res_1_id)]
+    subchain_2 = subchain_map[(chain_2_name, res_2_id)]
+
+    # Get chain indices
+    chain_1 = next(chain for chain in chains if (chain.name == subchain_1))
+    chain_2 = next(chain for chain in chains if (chain.name == subchain_2))
+
+    # Get residue indices
+    res_1_idx, res_1 = next(
+        (idx, res)
+        for idx, res in enumerate(chain_1.residues)
+        if (res.orig_idx == res_1_id)
+    )
+    res_2_idx, res_2 = next(
+        (idx, res)
+        for idx, res in enumerate(chain_2.residues)
+        if (res.orig_idx == res_2_id)
+    )
+
+    # Get atom indices
+    atom_index_1 = next(
+        idx
+        for idx, atom in enumerate(res_1.atoms)
+        if atom.name == connection.partner1.atom_name
+    )
+    atom_index_2 = next(
+        idx
+        for idx, atom in enumerate(res_2.atoms)
+        if atom.name == connection.partner2.atom_name
+    )
+
+    conn = ParsedConnection(
+        chain_1=subchain_1,
+        chain_2=subchain_2,
+        residue_index_1=res_1_idx,
+        residue_index_2=res_2_idx,
+        atom_index_1=atom_index_1,
+        atom_index_2=atom_index_2,
+    )
+
+    return conn
+
+
+def parse_mmcif(  # noqa: C901, PLR0915, PLR0912
+    path: str,
+    mols: Optional[dict[str, Mol]] = None,
+    moldir: Optional[str] = None,
+    use_assembly: bool = True,
+    call_compute_interfaces: bool = True,
+) -> ParsedStructure:
+    """Parse a structure in MMCIF format.
+
+    Parameters
+    ----------
+    mmcif_file : PathLike
+        Path to the MMCIF file.
+    components: Mapping[str, Mol]
+        The preprocessed PDB components dictionary.
+
+    Returns
+    -------
+    ParsedStructure
+        The parsed structure.
+
+    """
+    # Disable rdkit warnings
+    blocker = rdBase.BlockLogs()  # noqa: F841
+
+    # set mols
+    mols = {} if mols is None else mols
+
+    # Parse MMCIF input file
+    block = gemmi.cif.read(str(path))[0]
+
+    # Extract medatadata
+    deposit_date, release_date, revision_date = get_dates(block)
+    resolution = get_resolution(block)
+    method = get_method(block)
+    temperature, ph = get_experiment_conditions(block)
+
+    # Load structure object
+    structure = gemmi.make_structure_from_block(block)
+
+    # Clean up the structure
+    structure.merge_chain_parts()
+    structure.remove_waters()
+    structure.remove_hydrogens()
+    structure.remove_alternative_conformations()
+    structure.remove_empty_chains()
+
+    # Expand assembly 1
+    if use_assembly and structure.assemblies:
+        how = gemmi.HowToNameCopiedChain.AddNumber
+        assembly_name = structure.assemblies[0].name
+        structure.transform_to_assembly(assembly_name, how=how)
+
+    # Parse entities
+    # Create mapping from subchain id to entity
+    entities: dict[str, gemmi.Entity] = {}
+    entity_ids: dict[str, int] = {}
+    for entity_id, entity in enumerate(structure.entities):
+        entity: gemmi.Entity
+        if entity.entity_type.name == "Water":
+            continue
+        for subchain_id in entity.subchains:
+            entities[subchain_id] = entity
+            entity_ids[subchain_id] = entity_id
+
+    # Create mapping from chain, residue to subchains
+    # since a Connection uses the chains and not subchins
+    subchain_map = {}
+    for chain in structure[0]:
+        for residue in chain:
+            seq_id = residue.seqid
+            seq_id = str(seq_id.num) + str(seq_id.icode).strip()
+            subchain_map[(chain.name, seq_id)] = residue.subchain
+
+    # Find covalent ligands
+    covalent_chain_ids = compute_covalent_ligands(
+        connections=structure.connections,
+        subchain_map=subchain_map,
+        entities=entities,
+    )
+
+    # Parse chains
+    chains: list[ParsedChain] = []
+    for raw_chain in structure[0].subchains():
+        # Check chain type
+        subchain_id = raw_chain.subchain_id()
+        entity: gemmi.Entity = entities[subchain_id]
+        entity_type = entity.entity_type.name
+
+        # Parse a polymer
+        if entity_type == "Polymer":
+            # Skip PeptideD, DnaRnaHybrid, Pna, Other
+            if entity.polymer_type.name not in {
+                "PeptideL",
+                "Dna",
+                "Rna",
+            }:
+                continue
+
+            # Add polymer if successful
+            parsed_polymer = parse_polymer(
+                polymer=raw_chain,
+                polymer_type=entity.polymer_type,
+                sequence=entity.full_sequence,
+                chain_id=subchain_id,
+                entity=entity.name,
+                mols=mols,
+                moldir=moldir,
+            )
+            if parsed_polymer is not None:
+                chains.append(parsed_polymer)
+
+        # Parse a non-polymer
+        elif entity_type in {"NonPolymer", "Branched"}:
+            # Skip UNL
+            if any(lig.name == "UNL" for lig in raw_chain):
+                continue
+
+            residues = []
+            for lig_idx, ligand in enumerate(raw_chain):
+                # Check if ligand is covalent
+                if entity_type == "Branched":
+                    is_covalent = True
+                else:
+                    is_covalent = subchain_id in covalent_chain_ids
+
+                ligand: gemmi.Residue
+                ligand_mol = get_mol(ligand.name, mols, moldir)
+
+                residue = parse_ccd_residue(
+                    name=ligand.name,
+                    ref_mol=ligand_mol,
+                    res_idx=lig_idx,
+                    gemmi_mol=ligand,
+                    is_covalent=is_covalent,
+                )
+                residues.append(residue)
+
+            if residues:
+                chains.append(
+                    ParsedChain(
+                        name=subchain_id,
+                        entity=entity.name,
+                        residues=residues,
+                        type=const.chain_type_ids["NONPOLYMER"],
+                    )
+                )
+
+    # If no chains parsed fail
+    if not chains:
+        msg = "No chains parsed!"
+        raise ValueError(msg)
+
+    # Want to traverse subchains in same order as reference structure
+    ref_chain_map = {ref_chain.name: i for i, ref_chain in enumerate(chains)}
+    all_ensembles = [chains]
+
+    # Loop through different structures in model
+    for struct in list(structure)[1:]:
+        struct: gemmi.Model
+        ensemble_chains = {}
+
+        for raw_chain in struct.subchains():
+            # Check chain type
+            subchain_id = raw_chain.subchain_id()
+            entity: gemmi.Entity = entities[subchain_id]
+            entity_type = entity.entity_type.name
+
+            # Parse a polymer
+            if entity_type == "Polymer":
+                # Skip PeptideD, DnaRnaHybrid, Pna, Other
+                if entity.polymer_type.name not in {
+                    "PeptideL",
+                    "Dna",
+                    "Rna",
+                }:
+                    continue
+
+                # Add polymer if successful
+                parsed_polymer = parse_polymer(
+                    polymer=raw_chain,
+                    polymer_type=entity.polymer_type,
+                    sequence=entity.full_sequence,
+                    chain_id=subchain_id,
+                    entity=entity.name,
+                    mols=mols,
+                    moldir=moldir,
+                )
+                if parsed_polymer is not None:
+                    ensemble_chains[ref_chain_map[subchain_id]] = parsed_polymer
+
+            # Parse a non-polymer
+            elif entity_type in {"NonPolymer", "Branched"}:
+                # Skip UNL
+                if any(lig.name == "UNL" for lig in raw_chain):
+                    continue
+
+                residues = []
+                for lig_idx, ligand in enumerate(raw_chain):
+                    # Check if ligand is covalent
+                    if entity_type == "Branched":
+                        is_covalent = True
+                    else:
+                        is_covalent = subchain_id in covalent_chain_ids
+
+                    ligand: gemmi.Residue
+                    ligand_mol = get_mol(ligand.name, mols, moldir)
+
+                    residue = parse_ccd_residue(
+                        name=ligand.name,
+                        ref_mol=ligand_mol,
+                        res_idx=lig_idx,
+                        gemmi_mol=ligand,
+                        is_covalent=is_covalent,
+                    )
+                    residues.append(residue)
+
+                if residues:
+                    parsed_non_polymer = ParsedChain(
+                        name=subchain_id,
+                        entity=entity.name,
+                        residues=residues,
+                        type=const.chain_type_ids["NONPOLYMER"],
+                    )
+                    ensemble_chains[ref_chain_map[subchain_id]] = parsed_non_polymer
+
+        # Ensure ensemble chains are in the same order as reference structure
+        ensemble_chains = [ensemble_chains[idx] for idx in range(len(ensemble_chains))]
+        all_ensembles.append(ensemble_chains)
+
+    # Parse covalent connections
+    connections: list[ParsedConnection] = []
+    for connection in structure.connections:
+        # Skip non-covalent connections
+        connection: gemmi.Connection
+        if connection.type.name != "Covale":
+            continue
+        try:
+            parsed_connection = parse_connection(
+                connection=connection,
+                chains=chains,
+                subchain_map=subchain_map,
+            )
+        except Exception:  # noqa: S112, BLE001
+            continue
+        connections.append(parsed_connection)
+
+    # Create tables
+    atom_data = []
+    bond_data = []
+    res_data = []
+    chain_data = []
+    ensemble_data = []
+    coords_data = defaultdict(list)
+
+    rdkit_bounds_constraint_data = []
+    chiral_atom_constraint_data = []
+    stereo_bond_constraint_data = []
+    planar_bond_constraint_data = []
+    planar_ring_5_constraint_data = []
+    planar_ring_6_constraint_data = []
+
+    # Convert parsed chains to tables
+    atom_idx = 0
+    res_idx = 0
+    sym_count = {}
+    chain_to_idx = {}
+    res_to_idx = {}
+    chain_to_seq = {}
+
+    for asym_id, chain in enumerate(chains):
+        # Compute number of atoms and residues
+        res_num = len(chain.residues)
+        atom_num = sum(len(res.atoms) for res in chain.residues)
+
+        # Get same chain across models in ensemble
+        ensemble_chains = [ensemble[asym_id] for ensemble in all_ensembles]
+        assert len(ensemble_chains) == len(all_ensembles)
+        for ensemble_chain in ensemble_chains:
+            assert len(ensemble_chain.residues) == res_num
+            assert sum(len(res.atoms) for res in ensemble_chain.residues) == atom_num
+
+        # Find all copies of this chain in the assembly
+        entity_id = entity_ids[chain.name]
+        sym_id = sym_count.get(entity_id, 0)
+        chain_data.append(
+            (
+                chain.name,
+                chain.type,
+                entity_id,
+                sym_id,
+                asym_id,
+                atom_idx,
+                atom_num,
+                res_idx,
+                res_num,
+                0,
+            )
+        )
+        chain_to_idx[chain.name] = asym_id
+        sym_count[entity_id] = sym_id + 1
+        if chain.sequence is not None:
+            chain_to_seq[chain.name] = chain.sequence
+
+        # Add residue, atom, bond, data
+        for i, res in enumerate(chain.residues):
+            # Get same residue across models in ensemble
+            ensemble_residues = [
+                ensemble_chain.residues[i] for ensemble_chain in ensemble_chains
+            ]
+            assert len(ensemble_residues) == len(all_ensembles)
+            for ensemble_res in ensemble_residues:
+                assert ensemble_res.name == res.name
+
+            atom_center = atom_idx + res.atom_center
+            atom_disto = atom_idx + res.atom_disto
+            res_data.append(
+                (
+                    res.name,
+                    res.type,
+                    res.idx,
+                    atom_idx,
+                    len(res.atoms),
+                    atom_center,
+                    atom_disto,
+                    res.is_standard,
+                    res.is_present,
+                )
+            )
+            res_to_idx[(chain.name, i)] = (res_idx, atom_idx)
+
+            if res.rdkit_bounds_constraints is not None:
+                for constraint in res.rdkit_bounds_constraints:
+                    rdkit_bounds_constraint_data.append(  # noqa: PERF401
+                        (
+                            tuple(
+                                c_atom_idx + atom_idx
+                                for c_atom_idx in constraint.atom_idxs
+                            ),
+                            constraint.is_bond,
+                            constraint.is_angle,
+                            constraint.upper_bound,
+                            constraint.lower_bound,
+                        )
+                    )
+            if res.chiral_atom_constraints is not None:
+                for constraint in res.chiral_atom_constraints:
+                    chiral_atom_constraint_data.append(  # noqa: PERF401
+                        (
+                            tuple(
+                                c_atom_idx + atom_idx
+                                for c_atom_idx in constraint.atom_idxs
+                            ),
+                            constraint.is_reference,
+                            constraint.is_r,
+                        )
+                    )
+            if res.stereo_bond_constraints is not None:
+                for constraint in res.stereo_bond_constraints:
+                    stereo_bond_constraint_data.append(  # noqa: PERF401
+                        (
+                            tuple(
+                                c_atom_idx + atom_idx
+                                for c_atom_idx in constraint.atom_idxs
+                            ),
+                            constraint.is_check,
+                            constraint.is_e,
+                        )
+                    )
+            if res.planar_bond_constraints is not None:
+                for constraint in res.planar_bond_constraints:
+                    planar_bond_constraint_data.append(  # noqa: PERF401
+                        (
+                            tuple(
+                                c_atom_idx + atom_idx
+                                for c_atom_idx in constraint.atom_idxs
+                            ),
+                        )
+                    )
+            if res.planar_ring_5_constraints is not None:
+                for constraint in res.planar_ring_5_constraints:
+                    planar_ring_5_constraint_data.append(  # noqa: PERF401
+                        (
+                            tuple(
+                                c_atom_idx + atom_idx
+                                for c_atom_idx in constraint.atom_idxs
+                            ),
+                        )
+                    )
+            if res.planar_ring_6_constraints is not None:
+                for constraint in res.planar_ring_6_constraints:
+                    planar_ring_6_constraint_data.append(  # noqa: PERF401
+                        (
+                            tuple(
+                                c_atom_idx + atom_idx
+                                for c_atom_idx in constraint.atom_idxs
+                            ),
+                        )
+                    )
+
+            for bond in res.bonds:
+                chain_1 = asym_id
+                chain_2 = asym_id
+                res_1 = res_idx
+                res_2 = res_idx
+                atom_1 = atom_idx + bond.atom_1
+                atom_2 = atom_idx + bond.atom_2
+                bond_data.append(
+                    (
+                        chain_1,
+                        chain_2,
+                        res_1,
+                        res_2,
+                        atom_1,
+                        atom_2,
+                        bond.type,
+                    )
+                )
+
+            for a_idx, atom in enumerate(res.atoms):
+                # Get same atom across models in ensemble
+                ensemble_atoms = [
+                    ensemble_res.atoms[a_idx] for ensemble_res in ensemble_residues
+                ]
+                assert len(ensemble_atoms) == len(all_ensembles)
+                for e_idx, ensemble_atom in enumerate(ensemble_atoms):
+                    assert ensemble_atom.name == atom.name
+                    assert atom.is_present == ensemble_atom.is_present
+
+                    coords_data[e_idx].append(ensemble_atom.coords)
+
+                atom_data.append(
+                    (
+                        atom.name,
+                        atom.coords,
+                        atom.is_present,
+                        atom.bfactor,
+                        1.0,  # plddt is 1 for real data
+                    )
+                )
+                atom_idx += 1
+
+            res_idx += 1
+
+    # Create coordinates table
+    coords_data_ = []
+    for e_idx in range(len(coords_data)):
+        ensemble_data.append((e_idx * atom_idx, atom_idx))
+        coords_data_.append(coords_data[e_idx])
+    coords_data = [(x,) for xs in coords_data_ for x in xs]
+
+    # Convert connections to tables
+    for conn in connections:
+        chain_1_idx = chain_to_idx[conn.chain_1]
+        chain_2_idx = chain_to_idx[conn.chain_2]
+        res_1_idx, atom_1_offset = res_to_idx[(conn.chain_1, conn.residue_index_1)]
+        res_2_idx, atom_2_offset = res_to_idx[(conn.chain_2, conn.residue_index_2)]
+        atom_1_idx = atom_1_offset + conn.atom_index_1
+        atom_2_idx = atom_2_offset + conn.atom_index_2
+        bond_data.append(
+            (
+                chain_1_idx,
+                chain_2_idx,
+                res_1_idx,
+                res_2_idx,
+                atom_1_idx,
+                atom_2_idx,
+                const.bond_type_ids["COVALENT"],
+            )
+        )
+
+    # Convert into datatypes
+    atoms = np.array(atom_data, dtype=AtomV2)
+    bonds = np.array(bond_data, dtype=BondV2)
+    residues = np.array(res_data, dtype=Residue)
+    chains = np.array(chain_data, dtype=Chain)
+    mask = np.ones(len(chain_data), dtype=bool)
+    ensemble = np.array(ensemble_data, dtype=Ensemble)
+    coords = np.array(coords_data, dtype=Coords)
+    rdkit_bounds_constraints = np.array(
+        rdkit_bounds_constraint_data, dtype=RDKitBoundsConstraint
+    )
+    chiral_atom_constraints = np.array(
+        chiral_atom_constraint_data, dtype=ChiralAtomConstraint
+    )
+    stereo_bond_constraints = np.array(
+        stereo_bond_constraint_data, dtype=StereoBondConstraint
+    )
+    planar_bond_constraints = np.array(
+        planar_bond_constraint_data, dtype=PlanarBondConstraint
+    )
+    planar_ring_5_constraints = np.array(
+        planar_ring_5_constraint_data, dtype=PlanarRing5Constraint
+    )
+    planar_ring_6_constraints = np.array(
+        planar_ring_6_constraint_data, dtype=PlanarRing6Constraint
+    )
+    residue_constraints = ResidueConstraints(
+        rdkit_bounds_constraints=rdkit_bounds_constraints,
+        chiral_atom_constraints=chiral_atom_constraints,
+        stereo_bond_constraints=stereo_bond_constraints,
+        planar_bond_constraints=planar_bond_constraints,
+        planar_ring_5_constraints=planar_ring_5_constraints,
+        planar_ring_6_constraints=planar_ring_6_constraints,
+    )
+
+    # Compute interface chains (find chains with a heavy atom within 5A)
+    if call_compute_interfaces:
+        interfaces = compute_interfaces(atoms, chains)
+    else:
+        interfaces = np.array([], dtype=Interface)
+
+    # Return parsed structure
+    info = StructureInfo(
+        deposited=deposit_date,
+        revised=revision_date,
+        released=release_date,
+        resolution=resolution,
+        method=method,
+        num_chains=len(chains),
+        num_interfaces=len(interfaces),
+        temperature=temperature,
+        pH=ph,
+    )
+
+    data = StructureV2(
+        atoms=atoms,
+        bonds=bonds,
+        residues=residues,
+        chains=chains,
+        interfaces=interfaces,
+        mask=mask,
+        ensemble=ensemble,
+        coords=coords,
+    )
+
+    return ParsedStructure(
+        data=data,
+        info=info,
+        sequences=chain_to_seq,
+        residue_constraints=residue_constraints,
+    )
diff --git a/forks/boltz/src/boltz/data/parse/schema.py b/forks/boltz/src/boltz/data/parse/schema.py
new file mode 100644
index 00000000..a10260bc
--- /dev/null
+++ b/forks/boltz/src/boltz/data/parse/schema.py
@@ -0,0 +1,1826 @@
+from collections.abc import Mapping
+from dataclasses import dataclass
+from pathlib import Path
+from typing import Optional
+
+import click
+import numpy as np
+from Bio import Align
+from chembl_structure_pipeline.exclude_flag import exclude_flag
+from chembl_structure_pipeline.standardizer import standardize_mol
+from rdkit import Chem, rdBase
+from rdkit.Chem import AllChem, HybridizationType
+from rdkit.Chem.MolStandardize import rdMolStandardize
+from rdkit.Chem.rdchem import BondStereo, Conformer, Mol
+from rdkit.Chem.rdDistGeom import GetMoleculeBoundsMatrix
+from rdkit.Chem.rdMolDescriptors import CalcNumHeavyAtoms
+from scipy.optimize import linear_sum_assignment
+
+from boltz.data import const
+from boltz.data.mol import load_molecules
+from boltz.data.parse.mmcif import parse_mmcif
+from boltz.data.types import (
+    AffinityInfo,
+    Atom,
+    AtomV2,
+    Bond,
+    BondV2,
+    Chain,
+    ChainInfo,
+    ChiralAtomConstraint,
+    Connection,
+    Coords,
+    Ensemble,
+    InferenceOptions,
+    Interface,
+    PlanarBondConstraint,
+    PlanarRing5Constraint,
+    PlanarRing6Constraint,
+    RDKitBoundsConstraint,
+    Record,
+    Residue,
+    ResidueConstraints,
+    StereoBondConstraint,
+    Structure,
+    StructureInfo,
+    StructureV2,
+    Target,
+    TemplateInfo,
+)
+
+####################################################################################################
+# DATACLASSES
+####################################################################################################
+
+
+@dataclass(frozen=True)
+class ParsedAtom:
+    """A parsed atom object."""
+
+    name: str
+    element: int
+    charge: int
+    coords: tuple[float, float, float]
+    conformer: tuple[float, float, float]
+    is_present: bool
+    chirality: int
+
+
+@dataclass(frozen=True)
+class ParsedBond:
+    """A parsed bond object."""
+
+    atom_1: int
+    atom_2: int
+    type: int
+
+
+@dataclass(frozen=True)
+class ParsedRDKitBoundsConstraint:
+    """A parsed RDKit bounds constraint object."""
+
+    atom_idxs: tuple[int, int]
+    is_bond: bool
+    is_angle: bool
+    upper_bound: float
+    lower_bound: float
+
+
+@dataclass(frozen=True)
+class ParsedChiralAtomConstraint:
+    """A parsed chiral atom constraint object."""
+
+    atom_idxs: tuple[int, int, int, int]
+    is_reference: bool
+    is_r: bool
+
+
+@dataclass(frozen=True)
+class ParsedStereoBondConstraint:
+    """A parsed stereo bond constraint object."""
+
+    atom_idxs: tuple[int, int, int, int]
+    is_check: bool
+    is_e: bool
+
+
+@dataclass(frozen=True)
+class ParsedPlanarBondConstraint:
+    """A parsed planar bond constraint object."""
+
+    atom_idxs: tuple[int, int, int, int, int, int]
+
+
+@dataclass(frozen=True)
+class ParsedPlanarRing5Constraint:
+    """A parsed planar bond constraint object."""
+
+    atom_idxs: tuple[int, int, int, int, int]
+
+
+@dataclass(frozen=True)
+class ParsedPlanarRing6Constraint:
+    """A parsed planar bond constraint object."""
+
+    atom_idxs: tuple[int, int, int, int, int, int]
+
+
+@dataclass(frozen=True)
+class ParsedResidue:
+    """A parsed residue object."""
+
+    name: str
+    type: int
+    idx: int
+    atoms: list[ParsedAtom]
+    bonds: list[ParsedBond]
+    orig_idx: Optional[int]
+    atom_center: int
+    atom_disto: int
+    is_standard: bool
+    is_present: bool
+    rdkit_bounds_constraints: Optional[list[ParsedRDKitBoundsConstraint]] = None
+    chiral_atom_constraints: Optional[list[ParsedChiralAtomConstraint]] = None
+    stereo_bond_constraints: Optional[list[ParsedStereoBondConstraint]] = None
+    planar_bond_constraints: Optional[list[ParsedPlanarBondConstraint]] = None
+    planar_ring_5_constraints: Optional[list[ParsedPlanarRing5Constraint]] = None
+    planar_ring_6_constraints: Optional[list[ParsedPlanarRing6Constraint]] = None
+
+
+@dataclass(frozen=True)
+class ParsedChain:
+    """A parsed chain object."""
+
+    entity: str
+    type: int
+    residues: list[ParsedResidue]
+    cyclic_period: int
+    sequence: Optional[str] = None
+    affinity: Optional[bool] = False
+    affinity_mw: Optional[float] = None
+
+
+@dataclass(frozen=True)
+class Alignment:
+    """A parsed alignment object."""
+
+    query_st: int
+    query_en: int
+    template_st: int
+    template_en: int
+
+
+####################################################################################################
+# HELPERS
+####################################################################################################
+
+
+def convert_atom_name(name: str) -> tuple[int, int, int, int]:
+    """Convert an atom name to a standard format.
+
+    Parameters
+    ----------
+    name : str
+        The atom name.
+
+    Returns
+    -------
+    Tuple[int, int, int, int]
+        The converted atom name.
+
+    """
+    name = name.strip()
+    name = [ord(c) - 32 for c in name]
+    name = name + [0] * (4 - len(name))
+    return tuple(name)
+
+
+def compute_3d_conformer(mol: Mol, version: str = "v3") -> bool:
+    """Generate 3D coordinates using EKTDG method.
+
+    Taken from `pdbeccdutils.core.component.Component`.
+
+    Parameters
+    ----------
+    mol: Mol
+        The RDKit molecule to process
+    version: str, optional
+        The ETKDG version, defaults ot v3
+
+    Returns
+    -------
+    bool
+        Whether computation was successful.
+
+    """
+    if version == "v3":
+        options = AllChem.ETKDGv3()
+    elif version == "v2":
+        options = AllChem.ETKDGv2()
+    else:
+        options = AllChem.ETKDGv2()
+
+    options.clearConfs = False
+    conf_id = -1
+
+    try:
+        conf_id = AllChem.EmbedMolecule(mol, options)
+
+        if conf_id == -1:
+            print(
+                f"WARNING: RDKit ETKDGv3 failed to generate a conformer for molecule "
+                f"{Chem.MolToSmiles(AllChem.RemoveHs(mol))}, so the program will start with random coordinates. "
+                f"Note that the performance of the model under this behaviour was not tested."
+            )
+            options.useRandomCoords = True
+            conf_id = AllChem.EmbedMolecule(mol, options)
+
+        AllChem.UFFOptimizeMolecule(mol, confId=conf_id, maxIters=1000)
+
+    except RuntimeError:
+        pass  # Force field issue here
+    except ValueError:
+        pass  # sanitization issue here
+
+    if conf_id != -1:
+        conformer = mol.GetConformer(conf_id)
+        conformer.SetProp("name", "Computed")
+        conformer.SetProp("coord_generation", f"ETKDG{version}")
+
+        return True
+
+    return False
+
+
+def get_conformer(mol: Mol) -> Conformer:
+    """Retrieve an rdkit object for a deemed conformer.
+
+    Inspired by `pdbeccdutils.core.component.Component`.
+
+    Parameters
+    ----------
+    mol: Mol
+        The molecule to process.
+
+    Returns
+    -------
+    Conformer
+        The desired conformer, if any.
+
+    Raises
+    ------
+    ValueError
+        If there are no conformers of the given tyoe.
+
+    """
+    # Try using the computed conformer
+    for c in mol.GetConformers():
+        try:
+            if c.GetProp("name") == "Computed":
+                return c
+        except KeyError:  # noqa: PERF203
+            pass
+
+    # Fallback to the ideal coordinates
+    for c in mol.GetConformers():
+        try:
+            if c.GetProp("name") == "Ideal":
+                return c
+        except KeyError:  # noqa: PERF203
+            pass
+
+    # Fallback to boltz2 format
+    conf_ids = [int(conf.GetId()) for conf in mol.GetConformers()]
+    if len(conf_ids) > 0:
+        conf_id = conf_ids[0]
+        conformer = mol.GetConformer(conf_id)
+        return conformer
+
+    msg = "Conformer does not exist."
+    raise ValueError(msg)
+
+
+def compute_geometry_constraints(mol: Mol, idx_map):
+    if mol.GetNumAtoms() <= 1:
+        return []
+
+    # Ensure RingInfo is initialized
+    mol.UpdatePropertyCache(strict=False)
+    Chem.GetSymmSSSR(mol)  # Compute ring information
+
+    bounds = GetMoleculeBoundsMatrix(
+        mol,
+        set15bounds=True,
+        scaleVDW=True,
+        doTriangleSmoothing=True,
+        useMacrocycle14config=False,
+    )
+    bonds = set(
+        tuple(sorted(b)) for b in mol.GetSubstructMatches(Chem.MolFromSmarts("*~*"))
+    )
+    angles = set(
+        tuple(sorted([a[0], a[2]]))
+        for a in mol.GetSubstructMatches(Chem.MolFromSmarts("*~*~*"))
+    )
+
+    constraints = []
+    for i, j in zip(*np.triu_indices(mol.GetNumAtoms(), k=1)):
+        if i in idx_map and j in idx_map:
+            constraint = ParsedRDKitBoundsConstraint(
+                atom_idxs=(idx_map[i], idx_map[j]),
+                is_bond=tuple(sorted([i, j])) in bonds,
+                is_angle=tuple(sorted([i, j])) in angles,
+                upper_bound=bounds[i, j],
+                lower_bound=bounds[j, i],
+            )
+            constraints.append(constraint)
+    return constraints
+
+
+def compute_chiral_atom_constraints(mol, idx_map):
+    constraints = []
+    if all([atom.HasProp("_CIPRank") for atom in mol.GetAtoms()]):
+        for center_idx, orientation in Chem.FindMolChiralCenters(
+            mol, includeUnassigned=False
+        ):
+            center = mol.GetAtomWithIdx(center_idx)
+            neighbors = [
+                (neighbor.GetIdx(), int(neighbor.GetProp("_CIPRank")))
+                for neighbor in center.GetNeighbors()
+            ]
+            neighbors = sorted(
+                neighbors, key=lambda neighbor: neighbor[1], reverse=True
+            )
+            neighbors = tuple(neighbor[0] for neighbor in neighbors)
+            is_r = orientation == "R"
+
+            if len(neighbors) > 4 or center.GetHybridization() != HybridizationType.SP3:
+                continue
+
+            atom_idxs = (*neighbors[:3], center_idx)
+            if all(i in idx_map for i in atom_idxs):
+                constraints.append(
+                    ParsedChiralAtomConstraint(
+                        atom_idxs=tuple(idx_map[i] for i in atom_idxs),
+                        is_reference=True,
+                        is_r=is_r,
+                    )
+                )
+
+            if len(neighbors) == 4:
+                for skip_idx in range(3):
+                    chiral_set = neighbors[:skip_idx] + neighbors[skip_idx + 1 :]
+                    if skip_idx % 2 == 0:
+                        atom_idxs = chiral_set[::-1] + (center_idx,)
+                    else:
+                        atom_idxs = chiral_set + (center_idx,)
+                    if all(i in idx_map for i in atom_idxs):
+                        constraints.append(
+                            ParsedChiralAtomConstraint(
+                                atom_idxs=tuple(idx_map[i] for i in atom_idxs),
+                                is_reference=False,
+                                is_r=is_r,
+                            )
+                        )
+    return constraints
+
+
+def compute_stereo_bond_constraints(mol, idx_map):
+    constraints = []
+    if all([atom.HasProp("_CIPRank") for atom in mol.GetAtoms()]):
+        for bond in mol.GetBonds():
+            stereo = bond.GetStereo()
+            if stereo in {BondStereo.STEREOE, BondStereo.STEREOZ}:
+                start_atom_idx, end_atom_idx = (
+                    bond.GetBeginAtomIdx(),
+                    bond.GetEndAtomIdx(),
+                )
+                start_neighbors = [
+                    (neighbor.GetIdx(), int(neighbor.GetProp("_CIPRank")))
+                    for neighbor in mol.GetAtomWithIdx(start_atom_idx).GetNeighbors()
+                    if neighbor.GetIdx() != end_atom_idx
+                ]
+                start_neighbors = sorted(
+                    start_neighbors, key=lambda neighbor: neighbor[1], reverse=True
+                )
+                start_neighbors = [neighbor[0] for neighbor in start_neighbors]
+                end_neighbors = [
+                    (neighbor.GetIdx(), int(neighbor.GetProp("_CIPRank")))
+                    for neighbor in mol.GetAtomWithIdx(end_atom_idx).GetNeighbors()
+                    if neighbor.GetIdx() != start_atom_idx
+                ]
+                end_neighbors = sorted(
+                    end_neighbors, key=lambda neighbor: neighbor[1], reverse=True
+                )
+                end_neighbors = [neighbor[0] for neighbor in end_neighbors]
+                is_e = stereo == BondStereo.STEREOE
+
+                atom_idxs = (
+                    start_neighbors[0],
+                    start_atom_idx,
+                    end_atom_idx,
+                    end_neighbors[0],
+                )
+                if all(i in idx_map for i in atom_idxs):
+                    constraints.append(
+                        ParsedStereoBondConstraint(
+                            atom_idxs=tuple(idx_map[i] for i in atom_idxs),
+                            is_check=True,
+                            is_e=is_e,
+                        )
+                    )
+
+                if len(start_neighbors) == 2 and len(end_neighbors) == 2:
+                    atom_idxs = (
+                        start_neighbors[1],
+                        start_atom_idx,
+                        end_atom_idx,
+                        end_neighbors[1],
+                    )
+                    if all(i in idx_map for i in atom_idxs):
+                        constraints.append(
+                            ParsedStereoBondConstraint(
+                                atom_idxs=tuple(idx_map[i] for i in atom_idxs),
+                                is_check=False,
+                                is_e=is_e,
+                            )
+                        )
+    return constraints
+
+
+def compute_flatness_constraints(mol, idx_map):
+    planar_double_bond_smarts = Chem.MolFromSmarts("[C;X3;^2](*)(*)=[C;X3;^2](*)(*)")
+    aromatic_ring_5_smarts = Chem.MolFromSmarts("[ar5^2]1[ar5^2][ar5^2][ar5^2][ar5^2]1")
+    aromatic_ring_6_smarts = Chem.MolFromSmarts(
+        "[ar6^2]1[ar6^2][ar6^2][ar6^2][ar6^2][ar6^2]1"
+    )
+
+    planar_double_bond_constraints = []
+    aromatic_ring_5_constraints = []
+    aromatic_ring_6_constraints = []
+    for match in mol.GetSubstructMatches(planar_double_bond_smarts):
+        if all(i in idx_map for i in match):
+            planar_double_bond_constraints.append(
+                ParsedPlanarBondConstraint(atom_idxs=tuple(idx_map[i] for i in match))
+            )
+    for match in mol.GetSubstructMatches(aromatic_ring_5_smarts):
+        if all(i in idx_map for i in match):
+            aromatic_ring_5_constraints.append(
+                ParsedPlanarRing5Constraint(atom_idxs=tuple(idx_map[i] for i in match))
+            )
+    for match in mol.GetSubstructMatches(aromatic_ring_6_smarts):
+        if all(i in idx_map for i in match):
+            aromatic_ring_6_constraints.append(
+                ParsedPlanarRing6Constraint(atom_idxs=tuple(idx_map[i] for i in match))
+            )
+
+    return (
+        planar_double_bond_constraints,
+        aromatic_ring_5_constraints,
+        aromatic_ring_6_constraints,
+    )
+
+
+def get_global_alignment_score(query: str, template: str) -> float:
+    """Align a sequence to a template.
+
+    Parameters
+    ----------
+    query : str
+        The query sequence.
+    template : str
+        The template sequence.
+
+    Returns
+    -------
+    float
+        The global alignment score.
+
+    """
+    aligner = Align.PairwiseAligner(scoring="blastp")
+    aligner.mode = "global"
+    score = aligner.align(query, template)[0].score
+    return score
+
+
+def get_local_alignments(query: str, template: str) -> list[Alignment]:
+    """Align a sequence to a template.
+
+    Parameters
+    ----------
+    query : str
+        The query sequence.
+    template : str
+        The template sequence.
+
+    Returns
+    -------
+    Alignment
+        The alignment between the query and template.
+
+    """
+    aligner = Align.PairwiseAligner(scoring="blastp")
+    aligner.mode = "local"
+    aligner.open_gap_score = -1000
+    aligner.extend_gap_score = -1000
+
+    alignments = []
+    for result in aligner.align(query, template):
+        coordinates = result.coordinates
+        alignment = Alignment(
+            query_st=int(coordinates[0][0]),
+            query_en=int(coordinates[0][1]),
+            template_st=int(coordinates[1][0]),
+            template_en=int(coordinates[1][1]),
+        )
+        alignments.append(alignment)
+
+    return alignments
+
+
+def get_template_records_from_search(
+    template_id: str,
+    chain_ids: list[str],
+    sequences: dict[str, str],
+    template_chain_ids: list[str],
+    template_sequences: dict[str, str],
+    force: bool = False,
+    threshold: Optional[float] = None,
+) -> list[TemplateInfo]:
+    """Get template records from an alignment."""
+    # Compute pairwise scores
+    score_matrix = []
+    for chain_id in chain_ids:
+        row = []
+        for template_chain_id in template_chain_ids:
+            chain_seq = sequences[chain_id]
+            template_seq = template_sequences[template_chain_id]
+            score = get_global_alignment_score(chain_seq, template_seq)
+            row.append(score)
+        score_matrix.append(row)
+
+    # Find optimal mapping
+    row_ind, col_ind = linear_sum_assignment(score_matrix, maximize=True)
+
+    # Get alignment records
+    template_records = []
+
+    for row_idx, col_idx in zip(row_ind, col_ind):
+        chain_id = chain_ids[row_idx]
+        template_chain_id = template_chain_ids[col_idx]
+        chain_seq = sequences[chain_id]
+        template_seq = template_sequences[template_chain_id]
+        alignments = get_local_alignments(chain_seq, template_seq)
+
+        for alignment in alignments:
+            template_record = TemplateInfo(
+                name=template_id,
+                query_chain=chain_id,
+                query_st=alignment.query_st,
+                query_en=alignment.query_en,
+                template_chain=template_chain_id,
+                template_st=alignment.template_st,
+                template_en=alignment.template_en,
+                force=force,
+                threshold=threshold,
+            )
+            template_records.append(template_record)
+
+    return template_records
+
+
+def get_template_records_from_matching(
+    template_id: str,
+    chain_ids: list[str],
+    sequences: dict[str, str],
+    template_chain_ids: list[str],
+    template_sequences: dict[str, str],
+    force: bool = False,
+    threshold: Optional[float] = None,
+) -> list[TemplateInfo]:
+    """Get template records from a given matching."""
+    template_records = []
+
+    for chain_id, template_chain_id in zip(chain_ids, template_chain_ids):
+        # Align the sequences
+        chain_seq = sequences[chain_id]
+        template_seq = template_sequences[template_chain_id]
+        alignments = get_local_alignments(chain_seq, template_seq)
+        for alignment in alignments:
+            template_record = TemplateInfo(
+                name=template_id,
+                query_chain=chain_id,
+                query_st=alignment.query_st,
+                query_en=alignment.query_en,
+                template_chain=template_chain_id,
+                template_st=alignment.template_st,
+                template_en=alignment.template_en,
+                force=force,
+                threshold=threshold,
+            )
+            template_records.append(template_record)
+
+    return template_records
+
+
+def get_mol(ccd: str, mols: dict, moldir: str) -> Mol:
+    """Get mol from CCD code.
+
+    Return mol with ccd from mols if it is in mols. Otherwise load it from moldir,
+    add it to mols, and return the mol.
+    """
+    mol = mols.get(ccd)
+    if mol is None:
+        mol = load_molecules(moldir, [ccd])[ccd]
+    return mol
+
+
+####################################################################################################
+# PARSING
+####################################################################################################
+
+
+def parse_ccd_residue(
+    name: str, ref_mol: Mol, res_idx: int, drop_leaving_atoms: bool = False
+) -> Optional[ParsedResidue]:
+    """Parse an MMCIF ligand.
+
+    First tries to get the SMILES string from the RCSB.
+    Then, tries to infer atom ordering using RDKit.
+
+    Parameters
+    ----------
+    name: str
+        The name of the molecule to parse.
+    ref_mol: Mol
+        The reference molecule to parse.
+    res_idx : int
+        The residue index.
+
+    Returns
+    -------
+    ParsedResidue, optional
+       The output ParsedResidue, if successful.
+
+    """
+    unk_chirality = const.chirality_type_ids[const.unk_chirality_type]
+
+    # Check if this is a single heavy atom CCD residue
+    if CalcNumHeavyAtoms(ref_mol) == 1:
+        # Remove hydrogens
+        ref_mol = AllChem.RemoveHs(ref_mol, sanitize=False)
+
+        pos = (0, 0, 0)
+        ref_atom = ref_mol.GetAtoms()[0]
+        chirality_type = const.chirality_type_ids.get(
+            str(ref_atom.GetChiralTag()), unk_chirality
+        )
+        atom = ParsedAtom(
+            name=ref_atom.GetProp("name"),
+            element=ref_atom.GetAtomicNum(),
+            charge=ref_atom.GetFormalCharge(),
+            coords=pos,
+            conformer=(0, 0, 0),
+            is_present=True,
+            chirality=chirality_type,
+        )
+        unk_prot_id = const.unk_token_ids["PROTEIN"]
+        residue = ParsedResidue(
+            name=name,
+            type=unk_prot_id,
+            atoms=[atom],
+            bonds=[],
+            idx=res_idx,
+            orig_idx=None,
+            atom_center=0,  # Placeholder, no center
+            atom_disto=0,  # Placeholder, no center
+            is_standard=False,
+            is_present=True,
+        )
+        return residue
+
+    # Get reference conformer coordinates
+    conformer = get_conformer(ref_mol)
+
+    # Parse each atom in order of the reference mol
+    atoms = []
+    atom_idx = 0
+    idx_map = {}  # Used for bonds later
+
+    for i, atom in enumerate(ref_mol.GetAtoms()):
+        # Ignore Hydrogen atoms
+        if atom.GetAtomicNum() == 1:
+            continue
+
+        # Get atom name, charge, element and reference coordinates
+        atom_name = atom.GetProp("name")
+
+        # Drop leaving atoms for non-canonical amino acids.
+        if drop_leaving_atoms and int(atom.GetProp("leaving_atom")):
+            continue
+
+        charge = atom.GetFormalCharge()
+        element = atom.GetAtomicNum()
+        ref_coords = conformer.GetAtomPosition(atom.GetIdx())
+        ref_coords = (ref_coords.x, ref_coords.y, ref_coords.z)
+        chirality_type = const.chirality_type_ids.get(
+            str(atom.GetChiralTag()), unk_chirality
+        )
+
+        # Get PDB coordinates, if any
+        coords = (0, 0, 0)
+        atom_is_present = True
+
+        # Add atom to list
+        atoms.append(
+            ParsedAtom(
+                name=atom_name,
+                element=element,
+                charge=charge,
+                coords=coords,
+                conformer=ref_coords,
+                is_present=atom_is_present,
+                chirality=chirality_type,
+            )
+        )
+        idx_map[i] = atom_idx
+        atom_idx += 1
+
+    # Load bonds
+    bonds = []
+    unk_bond = const.bond_type_ids[const.unk_bond_type]
+    for bond in ref_mol.GetBonds():
+        idx_1 = bond.GetBeginAtomIdx()
+        idx_2 = bond.GetEndAtomIdx()
+
+        # Skip bonds with atoms ignored
+        if (idx_1 not in idx_map) or (idx_2 not in idx_map):
+            continue
+
+        idx_1 = idx_map[idx_1]
+        idx_2 = idx_map[idx_2]
+        start = min(idx_1, idx_2)
+        end = max(idx_1, idx_2)
+        bond_type = bond.GetBondType().name
+        bond_type = const.bond_type_ids.get(bond_type, unk_bond)
+        bonds.append(ParsedBond(start, end, bond_type))
+
+    rdkit_bounds_constraints = compute_geometry_constraints(ref_mol, idx_map)
+    chiral_atom_constraints = compute_chiral_atom_constraints(ref_mol, idx_map)
+    stereo_bond_constraints = compute_stereo_bond_constraints(ref_mol, idx_map)
+    planar_bond_constraints, planar_ring_5_constraints, planar_ring_6_constraints = (
+        compute_flatness_constraints(ref_mol, idx_map)
+    )
+
+    unk_prot_id = const.unk_token_ids["PROTEIN"]
+    return ParsedResidue(
+        name=name,
+        type=unk_prot_id,
+        atoms=atoms,
+        bonds=bonds,
+        idx=res_idx,
+        atom_center=0,
+        atom_disto=0,
+        orig_idx=None,
+        is_standard=False,
+        is_present=True,
+        rdkit_bounds_constraints=rdkit_bounds_constraints,
+        chiral_atom_constraints=chiral_atom_constraints,
+        stereo_bond_constraints=stereo_bond_constraints,
+        planar_bond_constraints=planar_bond_constraints,
+        planar_ring_5_constraints=planar_ring_5_constraints,
+        planar_ring_6_constraints=planar_ring_6_constraints,
+    )
+
+
+def parse_polymer(
+    sequence: list[str],
+    raw_sequence: str,
+    entity: str,
+    chain_type: str,
+    components: dict[str, Mol],
+    cyclic: bool,
+    mol_dir: Path,
+) -> Optional[ParsedChain]:
+    """Process a sequence into a chain object.
+
+    Performs alignment of the full sequence to the polymer
+    residues. Loads coordinates and masks for the atoms in
+    the polymer, following the ordering in const.atom_order.
+
+    Parameters
+    ----------
+    sequence : list[str]
+        The full sequence of the polymer.
+    entity : str
+        The entity id.
+    entity_type : str
+        The entity type.
+    components : dict[str, Mol]
+        The preprocessed PDB components dictionary.
+
+    Returns
+    -------
+    ParsedChain, optional
+        The output chain, if successful.
+
+    Raises
+    ------
+    ValueError
+        If the alignment fails.
+
+    """
+    ref_res = set(const.tokens)
+    unk_chirality = const.chirality_type_ids[const.unk_chirality_type]
+
+    # Get coordinates and masks
+    parsed = []
+    for res_idx, res_name in enumerate(sequence):
+        # Check if modified residue
+        # Map MSE to MET
+        res_corrected = res_name if res_name != "MSE" else "MET"
+
+        # Handle non-standard residues
+        if res_corrected not in ref_res:
+            ref_mol = get_mol(res_corrected, components, mol_dir)
+            residue = parse_ccd_residue(
+                name=res_corrected,
+                ref_mol=ref_mol,
+                res_idx=res_idx,
+                drop_leaving_atoms=True,
+            )
+            parsed.append(residue)
+            continue
+
+        # Load ref residue
+        ref_mol = get_mol(res_corrected, components, mol_dir)
+        ref_mol = AllChem.RemoveHs(ref_mol, sanitize=False)
+        ref_conformer = get_conformer(ref_mol)
+
+        # Only use reference atoms set in constants
+        ref_name_to_atom = {a.GetProp("name"): a for a in ref_mol.GetAtoms()}
+        ref_atoms = [ref_name_to_atom[a] for a in const.ref_atoms[res_corrected]]
+
+        # Iterate, always in the same order
+        atoms: list[ParsedAtom] = []
+
+        for ref_atom in ref_atoms:
+            # Get atom name
+            atom_name = ref_atom.GetProp("name")
+            idx = ref_atom.GetIdx()
+
+            # Get conformer coordinates
+            ref_coords = ref_conformer.GetAtomPosition(idx)
+            ref_coords = (ref_coords.x, ref_coords.y, ref_coords.z)
+
+            # Set 0 coordinate
+            atom_is_present = True
+            coords = (0, 0, 0)
+
+            # Add atom to list
+            atoms.append(
+                ParsedAtom(
+                    name=atom_name,
+                    element=ref_atom.GetAtomicNum(),
+                    charge=ref_atom.GetFormalCharge(),
+                    coords=coords,
+                    conformer=ref_coords,
+                    is_present=atom_is_present,
+                    chirality=const.chirality_type_ids.get(
+                        str(ref_atom.GetChiralTag()), unk_chirality
+                    ),
+                )
+            )
+
+        atom_center = const.res_to_center_atom_id[res_corrected]
+        atom_disto = const.res_to_disto_atom_id[res_corrected]
+        parsed.append(
+            ParsedResidue(
+                name=res_corrected,
+                type=const.token_ids[res_corrected],
+                atoms=atoms,
+                bonds=[],
+                idx=res_idx,
+                atom_center=atom_center,
+                atom_disto=atom_disto,
+                is_standard=True,
+                is_present=True,
+                orig_idx=None,
+            )
+        )
+
+    if cyclic:
+        cyclic_period = len(sequence)
+    else:
+        cyclic_period = 0
+
+    # Return polymer object
+    return ParsedChain(
+        entity=entity,
+        residues=parsed,
+        type=chain_type,
+        cyclic_period=cyclic_period,
+        sequence=raw_sequence,
+    )
+
+
+def token_spec_to_ids(
+    chain_name, residue_index_or_atom_name, chain_to_idx, atom_idx_map, chains
+):
+    if chains[chain_name].type == const.chain_type_ids["NONPOLYMER"]:
+        # Non-polymer chains are indexed by atom name
+        _, _, atom_idx = atom_idx_map[(chain_name, 0, residue_index_or_atom_name)]
+        return (chain_to_idx[chain_name], atom_idx)
+    else:
+        # Polymer chains are indexed by residue index
+        return chain_to_idx[chain_name], residue_index_or_atom_name - 1
+
+
+def parse_boltz_schema(  # noqa: C901, PLR0915, PLR0912
+    name: str,
+    schema: dict,
+    ccd: Mapping[str, Mol],
+    mol_dir: Optional[Path] = None,
+    boltz_2: bool = False,
+) -> Target:
+    """Parse a Boltz input yaml / json.
+
+    The input file should be a dictionary with the following format:
+
+    version: 1
+    sequences:
+        - protein:
+            id: A
+            sequence: "MADQLTEEQIAEFKEAFSLF"
+            msa: path/to/msa1.a3m
+        - protein:
+            id: [B, C]
+            sequence: "AKLSILPWGHC"
+            msa: path/to/msa2.a3m
+        - rna:
+            id: D
+            sequence: "GCAUAGC"
+        - ligand:
+            id: E
+            smiles: "CC1=CC=CC=C1"
+    constraints:
+        - bond:
+            atom1: [A, 1, CA]
+            atom2: [A, 2, N]
+        - pocket:
+            binder: E
+            contacts: [[B, 1], [B, 2]]
+            max_distance: 6
+        - contact:
+            token1: [A, 1]
+            token2: [B, 1]
+            max_distance: 6
+    templates:
+        - cif: path/to/template.cif
+    properties:
+        - affinity:
+            binder: E
+
+    Parameters
+    ----------
+    name : str
+        A name for the input.
+    schema : dict
+        The input schema.
+    components : dict
+        Dictionary of CCD components.
+    mol_dir: Path
+        Path to the directory containing the molecules.
+    boltz2: bool
+        Whether to parse the input for Boltz2.
+
+    Returns
+    -------
+    Target
+        The parsed target.
+
+    """
+    # Assert version 1
+    version = schema.get("version", 1)
+    if version != 1:
+        msg = f"Invalid version {version} in input!"
+        raise ValueError(msg)
+
+    # Disable rdkit warnings
+    blocker = rdBase.BlockLogs()  # noqa: F841
+
+    # First group items that have the same type, sequence and modifications
+    items_to_group = {}
+    chain_name_to_entity_type = {}
+
+    for item in schema["sequences"]:
+        # Get entity type
+        entity_type = next(iter(item.keys())).lower()
+        if entity_type not in {"protein", "dna", "rna", "ligand"}:
+            msg = f"Invalid entity type: {entity_type}"
+            raise ValueError(msg)
+
+        # Get sequence
+        if entity_type in {"protein", "dna", "rna"}:
+            seq = str(item[entity_type]["sequence"])
+        elif entity_type == "ligand":
+            assert "smiles" in item[entity_type] or "ccd" in item[entity_type]
+            assert "smiles" not in item[entity_type] or "ccd" not in item[entity_type]
+            if "smiles" in item[entity_type]:
+                seq = str(item[entity_type]["smiles"])
+            else:
+                seq = str(item[entity_type]["ccd"])
+
+        # Group items by entity
+        items_to_group.setdefault((entity_type, seq), []).append(item)
+
+        # Map chain names to entity types
+        chain_names = item[entity_type]["id"]
+        chain_names = [chain_names] if isinstance(chain_names, str) else chain_names
+        for chain_name in chain_names:
+            chain_name_to_entity_type[chain_name] = entity_type
+
+    # Check if any affinity ligand is present
+    affinity_ligands = set()
+    properties = schema.get("properties", [])
+    if properties and not boltz_2:
+        msg = "Affinity prediction is only supported for Boltz2!"
+        raise ValueError(msg)
+
+    for prop in properties:
+        prop_type = next(iter(prop.keys())).lower()
+        if prop_type == "affinity":
+            binder = prop["affinity"]["binder"]
+            if not isinstance(binder, str):
+                # TODO: support multi residue ligands and ccd's
+                msg = "Binder must be a single chain."
+                raise ValueError(msg)
+
+            if binder not in chain_name_to_entity_type:
+                msg = f"Could not find binder with name {binder} in the input!"
+                raise ValueError(msg)
+
+            if chain_name_to_entity_type[binder] != "ligand":
+                msg = (
+                    f"Chain {binder} is not a ligand! "
+                    "Affinity is currently only supported for ligands."
+                )
+                raise ValueError(msg)
+
+            affinity_ligands.add(binder)
+
+    # Check only one affinity ligand is present
+    if len(affinity_ligands) > 1:
+        msg = "Only one affinity ligand is currently supported!"
+        raise ValueError(msg)
+
+    # Go through entities and parse them
+    extra_mols: dict[str, Mol] = {}
+    chains: dict[str, ParsedChain] = {}
+    chain_to_msa: dict[str, str] = {}
+    entity_to_seq: dict[str, str] = {}
+    is_msa_custom = False
+    is_msa_auto = False
+    ligand_id = 1
+    for entity_id, items in enumerate(items_to_group.values()):
+        # Get entity type and sequence
+        entity_type = next(iter(items[0].keys())).lower()
+
+        # Get ids
+        ids = []
+        for item in items:
+            if isinstance(item[entity_type]["id"], str):
+                ids.append(item[entity_type]["id"])
+            elif isinstance(item[entity_type]["id"], list):
+                ids.extend(item[entity_type]["id"])
+
+        # Check if any affinity ligand is present
+        if len(ids) == 1:
+            affinity = ids[0] in affinity_ligands
+        elif (len(ids) > 1) and any(x in affinity_ligands for x in ids):
+            msg = "Cannot compute affinity for a ligand that has multiple copies!"
+            raise ValueError(msg)
+        else:
+            affinity = False
+
+        # Ensure all the items share the same msa
+        msa = -1
+        if entity_type == "protein":
+            # Get the msa, default to 0, meaning auto-generated
+            msa = items[0][entity_type].get("msa", 0)
+            if (msa is None) or (msa == ""):
+                msa = 0
+
+            # Check if all MSAs are the same within the same entity
+            for item in items:
+                item_msa = item[entity_type].get("msa", 0)
+                if (item_msa is None) or (item_msa == ""):
+                    item_msa = 0
+
+                if item_msa != msa:
+                    msg = "All proteins with the same sequence must share the same MSA!"
+                    raise ValueError(msg)
+
+            # Set the MSA, warn if passed in single-sequence mode
+            if msa == "empty":
+                msa = -1
+                msg = (
+                    "Found explicit empty MSA for some proteins, will run "
+                    "these in single sequence mode. Keep in mind that the "
+                    "model predictions will be suboptimal without an MSA."
+                )
+                click.echo(msg)
+
+            if msa not in (0, -1):
+                is_msa_custom = True
+            elif msa == 0:
+                is_msa_auto = True
+
+        # Parse a polymer
+        if entity_type in {"protein", "dna", "rna"}:
+            # Get token map
+            if entity_type == "rna":
+                token_map = const.rna_letter_to_token
+            elif entity_type == "dna":
+                token_map = const.dna_letter_to_token
+            elif entity_type == "protein":
+                token_map = const.prot_letter_to_token
+            else:
+                msg = f"Unknown polymer type: {entity_type}"
+                raise ValueError(msg)
+
+            # Get polymer info
+            chain_type = const.chain_type_ids[entity_type.upper()]
+            unk_token = const.unk_token[entity_type.upper()]
+
+            # Extract sequence
+            raw_seq = items[0][entity_type]["sequence"]
+            entity_to_seq[entity_id] = raw_seq
+
+            # Convert sequence to tokens
+            seq = [token_map.get(c, unk_token) for c in list(raw_seq)]
+
+            # Apply modifications
+            for mod in items[0][entity_type].get("modifications", []):
+                code = mod["ccd"]
+                idx = mod["position"] - 1  # 1-indexed
+                seq[idx] = code
+
+            cyclic = items[0][entity_type].get("cyclic", False)
+
+            # Parse a polymer
+            parsed_chain = parse_polymer(
+                sequence=seq,
+                raw_sequence=raw_seq,
+                entity=entity_id,
+                chain_type=chain_type,
+                components=ccd,
+                cyclic=cyclic,
+                mol_dir=mol_dir,
+            )
+
+        # Parse a non-polymer
+        elif (entity_type == "ligand") and "ccd" in (items[0][entity_type]):
+            seq = items[0][entity_type]["ccd"]
+
+            if isinstance(seq, str):
+                seq = [seq]
+
+            if affinity and len(seq) > 1:
+                msg = "Cannot compute affinity for multi residue ligands!"
+                raise ValueError(msg)
+
+            residues = []
+            affinity_mw = None
+            for res_idx, code in enumerate(seq):
+                # Get mol
+                ref_mol = get_mol(code, ccd, mol_dir)
+
+                if affinity:
+                    affinity_mw = AllChem.Descriptors.MolWt(ref_mol)
+
+                # Parse residue
+                residue = parse_ccd_residue(
+                    name=code,
+                    ref_mol=ref_mol,
+                    res_idx=res_idx,
+                )
+                residues.append(residue)
+
+            # Create multi ligand chain
+            parsed_chain = ParsedChain(
+                entity=entity_id,
+                residues=residues,
+                type=const.chain_type_ids["NONPOLYMER"],
+                cyclic_period=0,
+                sequence=None,
+                affinity=affinity,
+                affinity_mw=affinity_mw,
+            )
+
+            assert not items[0][entity_type].get("cyclic", False), (
+                "Cyclic flag is not supported for ligands"
+            )
+
+        elif (entity_type == "ligand") and ("smiles" in items[0][entity_type]):
+            seq = items[0][entity_type]["smiles"]
+
+            if affinity:
+                seq = standardize(seq)
+
+            mol = AllChem.MolFromSmiles(seq)
+            mol = AllChem.AddHs(mol)
+
+            # Set atom names
+            canonical_order = AllChem.CanonicalRankAtoms(mol)
+            for atom, can_idx in zip(mol.GetAtoms(), canonical_order):
+                atom_name = atom.GetSymbol().upper() + str(can_idx + 1)
+                if len(atom_name) > 4:
+                    msg = (
+                        f"{seq} has an atom with a name longer than "
+                        f"4 characters: {atom_name}."
+                    )
+                    raise ValueError(msg)
+                atom.SetProp("name", atom_name)
+
+            success = compute_3d_conformer(mol)
+            if not success:
+                msg = f"Failed to compute 3D conformer for {seq}"
+                raise ValueError(msg)
+
+            mol_no_h = AllChem.RemoveHs(mol, sanitize=False)
+            affinity_mw = AllChem.Descriptors.MolWt(mol_no_h) if affinity else None
+            extra_mols[f"LIG{ligand_id}"] = mol_no_h
+            residue = parse_ccd_residue(
+                name=f"LIG{ligand_id}",
+                ref_mol=mol,
+                res_idx=0,
+            )
+
+            ligand_id += 1
+            parsed_chain = ParsedChain(
+                entity=entity_id,
+                residues=[residue],
+                type=const.chain_type_ids["NONPOLYMER"],
+                cyclic_period=0,
+                sequence=None,
+                affinity=affinity,
+                affinity_mw=affinity_mw,
+            )
+
+            assert not items[0][entity_type].get("cyclic", False), (
+                "Cyclic flag is not supported for ligands"
+            )
+
+        else:
+            msg = f"Invalid entity type: {entity_type}"
+            raise ValueError(msg)
+
+        # Add as many chains as provided ids
+        for item in items:
+            ids = item[entity_type]["id"]
+            if isinstance(ids, str):
+                ids = [ids]
+            for chain_name in ids:
+                chains[chain_name] = parsed_chain
+                chain_to_msa[chain_name] = msa
+
+    # Check if msa is custom or auto
+    if is_msa_custom and is_msa_auto:
+        msg = "Cannot mix custom and auto-generated MSAs in the same input!"
+        raise ValueError(msg)
+
+    # If no chains parsed fail
+    if not chains:
+        msg = "No chains parsed!"
+        raise ValueError(msg)
+
+    # Create tables
+    atom_data = []
+    bond_data = []
+    res_data = []
+    chain_data = []
+    protein_chains = set()
+    affinity_info = None
+
+    rdkit_bounds_constraint_data = []
+    chiral_atom_constraint_data = []
+    stereo_bond_constraint_data = []
+    planar_bond_constraint_data = []
+    planar_ring_5_constraint_data = []
+    planar_ring_6_constraint_data = []
+
+    # Convert parsed chains to tables
+    atom_idx = 0
+    res_idx = 0
+    asym_id = 0
+    sym_count = {}
+    chain_to_idx = {}
+
+    # Keep a mapping of (chain_name, residue_idx, atom_name) to atom_idx
+    atom_idx_map = {}
+
+    for asym_id, (chain_name, chain) in enumerate(chains.items()):
+        # Compute number of atoms and residues
+        res_num = len(chain.residues)
+        atom_num = sum(len(res.atoms) for res in chain.residues)
+
+        # Save protein chains for later
+        if chain.type == const.chain_type_ids["PROTEIN"]:
+            protein_chains.add(chain_name)
+
+        # Add affinity info
+        if chain.affinity and affinity_info is not None:
+            msg = "Cannot compute affinity for multiple ligands!"
+            raise ValueError(msg)
+
+        if chain.affinity:
+            affinity_info = AffinityInfo(
+                chain_id=asym_id,
+                mw=chain.affinity_mw,
+            )
+
+        # Find all copies of this chain in the assembly
+        entity_id = int(chain.entity)
+        sym_id = sym_count.get(entity_id, 0)
+        chain_data.append(
+            (
+                chain_name,
+                chain.type,
+                entity_id,
+                sym_id,
+                asym_id,
+                atom_idx,
+                atom_num,
+                res_idx,
+                res_num,
+                chain.cyclic_period,
+            )
+        )
+        chain_to_idx[chain_name] = asym_id
+        sym_count[entity_id] = sym_id + 1
+
+        # Add residue, atom, bond, data
+        for res in chain.residues:
+            atom_center = atom_idx + res.atom_center
+            atom_disto = atom_idx + res.atom_disto
+            res_data.append(
+                (
+                    res.name,
+                    res.type,
+                    res.idx,
+                    atom_idx,
+                    len(res.atoms),
+                    atom_center,
+                    atom_disto,
+                    res.is_standard,
+                    res.is_present,
+                )
+            )
+
+            if res.rdkit_bounds_constraints is not None:
+                for constraint in res.rdkit_bounds_constraints:
+                    rdkit_bounds_constraint_data.append(  # noqa: PERF401
+                        (
+                            tuple(
+                                c_atom_idx + atom_idx
+                                for c_atom_idx in constraint.atom_idxs
+                            ),
+                            constraint.is_bond,
+                            constraint.is_angle,
+                            constraint.upper_bound,
+                            constraint.lower_bound,
+                        )
+                    )
+            if res.chiral_atom_constraints is not None:
+                for constraint in res.chiral_atom_constraints:
+                    chiral_atom_constraint_data.append(  # noqa: PERF401
+                        (
+                            tuple(
+                                c_atom_idx + atom_idx
+                                for c_atom_idx in constraint.atom_idxs
+                            ),
+                            constraint.is_reference,
+                            constraint.is_r,
+                        )
+                    )
+            if res.stereo_bond_constraints is not None:
+                for constraint in res.stereo_bond_constraints:
+                    stereo_bond_constraint_data.append(  # noqa: PERF401
+                        (
+                            tuple(
+                                c_atom_idx + atom_idx
+                                for c_atom_idx in constraint.atom_idxs
+                            ),
+                            constraint.is_check,
+                            constraint.is_e,
+                        )
+                    )
+            if res.planar_bond_constraints is not None:
+                for constraint in res.planar_bond_constraints:
+                    planar_bond_constraint_data.append(  # noqa: PERF401
+                        (
+                            tuple(
+                                c_atom_idx + atom_idx
+                                for c_atom_idx in constraint.atom_idxs
+                            ),
+                        )
+                    )
+            if res.planar_ring_5_constraints is not None:
+                for constraint in res.planar_ring_5_constraints:
+                    planar_ring_5_constraint_data.append(  # noqa: PERF401
+                        (
+                            tuple(
+                                c_atom_idx + atom_idx
+                                for c_atom_idx in constraint.atom_idxs
+                            ),
+                        )
+                    )
+            if res.planar_ring_6_constraints is not None:
+                for constraint in res.planar_ring_6_constraints:
+                    planar_ring_6_constraint_data.append(  # noqa: PERF401
+                        (
+                            tuple(
+                                c_atom_idx + atom_idx
+                                for c_atom_idx in constraint.atom_idxs
+                            ),
+                        )
+                    )
+
+            for bond in res.bonds:
+                atom_1 = atom_idx + bond.atom_1
+                atom_2 = atom_idx + bond.atom_2
+                bond_data.append(
+                    (
+                        asym_id,
+                        asym_id,
+                        res_idx,
+                        res_idx,
+                        atom_1,
+                        atom_2,
+                        bond.type,
+                    )
+                )
+
+            for atom in res.atoms:
+                # Add atom to map
+                atom_idx_map[(chain_name, res.idx, atom.name)] = (
+                    asym_id,
+                    res_idx,
+                    atom_idx,
+                )
+
+                # Add atom to data
+                atom_data.append(
+                    (
+                        atom.name,
+                        atom.element,
+                        atom.charge,
+                        atom.coords,
+                        atom.conformer,
+                        atom.is_present,
+                        atom.chirality,
+                    )
+                )
+                atom_idx += 1
+
+            res_idx += 1
+
+    # Parse constraints
+    connections = []
+    pocket_constraints = []
+    contact_constraints = []
+    constraints = schema.get("constraints", [])
+    for constraint in constraints:
+        if "bond" in constraint:
+            if "atom1" not in constraint["bond"] or "atom2" not in constraint["bond"]:
+                msg = f"Bond constraint was not properly specified"
+                raise ValueError(msg)
+
+            c1, r1, a1 = tuple(constraint["bond"]["atom1"])
+            c2, r2, a2 = tuple(constraint["bond"]["atom2"])
+            c1, r1, a1 = atom_idx_map[(c1, r1 - 1, a1)]  # 1-indexed
+            c2, r2, a2 = atom_idx_map[(c2, r2 - 1, a2)]  # 1-indexed
+            connections.append((c1, c2, r1, r2, a1, a2))
+        elif "pocket" in constraint:
+            if (
+                "binder" not in constraint["pocket"]
+                or "contacts" not in constraint["pocket"]
+            ):
+                msg = f"Pocket constraint was not properly specified"
+                raise ValueError(msg)
+
+            if len(pocket_constraints) > 0 and not boltz_2:
+                msg = f"Only one pocket binders is supported in Boltz-1!"
+                raise ValueError(msg)
+
+            max_distance = constraint["pocket"].get("max_distance", 6.0)
+            if max_distance != 6.0 and not boltz_2:
+                msg = f"Max distance != 6.0 is not supported in Boltz-1!"
+                raise ValueError(msg)
+
+            binder = constraint["pocket"]["binder"]
+            binder = chain_to_idx[binder]
+
+            contacts = []
+            for chain_name, residue_index_or_atom_name in constraint["pocket"][
+                "contacts"
+            ]:
+                contact = token_spec_to_ids(
+                    chain_name,
+                    residue_index_or_atom_name,
+                    chain_to_idx,
+                    atom_idx_map,
+                    chains,
+                )
+                contacts.append(contact)
+
+            force = constraint["pocket"].get("force", False)
+            pocket_constraints.append((binder, contacts, max_distance, force))
+        elif "contact" in constraint:
+            if (
+                "token1" not in constraint["contact"]
+                or "token2" not in constraint["contact"]
+            ):
+                msg = f"Contact constraint was not properly specified"
+                raise ValueError(msg)
+
+            if not boltz_2:
+                msg = f"Contact constraint is not supported in Boltz-1!"
+                raise ValueError(msg)
+
+            max_distance = constraint["contact"].get("max_distance", 6.0)
+
+            chain_name1, residue_index_or_atom_name1 = constraint["contact"]["token1"]
+            token1 = token_spec_to_ids(
+                chain_name1,
+                residue_index_or_atom_name1,
+                chain_to_idx,
+                atom_idx_map,
+                chains,
+            )
+            chain_name2, residue_index_or_atom_name2 = constraint["contact"]["token2"]
+            token2 = token_spec_to_ids(
+                chain_name2,
+                residue_index_or_atom_name2,
+                chain_to_idx,
+                atom_idx_map,
+                chains,
+            )
+            force = constraint["contact"].get("force", False)
+
+            contact_constraints.append((token1, token2, max_distance, force))
+        else:
+            msg = f"Invalid constraint: {constraint}"
+            raise ValueError(msg)
+
+    # Get protein sequences in this YAML
+    protein_seqs = {name: chains[name].sequence for name in protein_chains}
+
+    # Parse templates
+    template_schema = schema.get("templates", [])
+    if template_schema and not boltz_2:
+        msg = "Templates are not supported in Boltz 1.0!"
+        raise ValueError(msg)
+
+    templates = {}
+    template_records = []
+    for template in template_schema:
+        if "cif" not in template:
+            msg = "Template was not properly specified, missing CIF path!"
+            raise ValueError(msg)
+
+        path = template["cif"]
+        template_id = Path(path).stem
+        chain_ids = template.get("chain_id", None)
+        template_chain_ids = template.get("template_id", None)
+
+        # Check validity of input
+        matched = False
+
+        if chain_ids is not None and not isinstance(chain_ids, list):
+            chain_ids = [chain_ids]
+        if template_chain_ids is not None and not isinstance(template_chain_ids, list):
+            template_chain_ids = [template_chain_ids]
+
+        if (
+            template_chain_ids is not None
+            and chain_ids is not None
+        ):
+           
+                if len(template_chain_ids) == len(chain_ids):
+                     if len(template_chain_ids) > 0 and len(chain_ids) > 0:
+                        matched = True
+                else:
+                    msg = (
+                        "When providing both the chain_id and template_id, the number of"
+                        "template_ids provided must match the number of chain_ids!"
+                    )
+                    raise ValueError(msg)
+
+        # Get relevant chains ids
+        if chain_ids is None:
+            chain_ids = list(protein_chains)
+
+        for chain_id in chain_ids:
+            if chain_id not in protein_chains:
+                msg = (
+                    f"Chain {chain_id} assigned for template"
+                    f"{template_id} is not one of the protein chains!"
+                )
+                raise ValueError(msg)
+
+        # Get relevant template chain ids
+        parsed_template = parse_mmcif(
+            path,
+            mols=ccd,
+            moldir=mol_dir,
+            use_assembly=False,
+            compute_interfaces=False,
+        )
+        template_proteins = {
+            str(c["name"])
+            for c in parsed_template.data.chains
+            if c["mol_type"] == const.chain_type_ids["PROTEIN"]
+        }
+        if template_chain_ids is None:
+            template_chain_ids = list(template_proteins)
+
+        for chain_id in template_chain_ids:
+            if chain_id not in template_proteins:
+                msg = (
+                    f"Template chain {chain_id} assigned for template"
+                    f"{template_id} is not one of the protein chains!"
+                )
+                raise ValueError(msg)
+
+        force = template.get("force", False)
+        if force:
+            if "threshold" in template:
+                threshold = template["threshold"]
+            else:
+                msg = f"Template {template_id} must have threshold specified if force is set to True"
+                raise ValueError(msg)
+        else:
+            threshold = float("inf")
+        # Compute template records
+
+        if matched:
+            template_records.extend(
+                get_template_records_from_matching(
+                    template_id=template_id,
+                    chain_ids=chain_ids,
+                    sequences=protein_seqs,
+                    template_chain_ids=template_chain_ids,
+                    template_sequences=parsed_template.sequences,
+                    force=force,
+                    threshold=threshold,
+                )
+            )
+        else:
+            template_records.extend(
+                get_template_records_from_search(
+                    template_id=template_id,
+                    chain_ids=chain_ids,
+                    sequences=protein_seqs,
+                    template_chain_ids=template_chain_ids,
+                    template_sequences=parsed_template.sequences,
+                    force=force,
+                    threshold=threshold,
+                )
+            )
+        # Save template
+        templates[template_id] = parsed_template.data
+
+    # Convert into datatypes
+    residues = np.array(res_data, dtype=Residue)
+    chains = np.array(chain_data, dtype=Chain)
+    interfaces = np.array([], dtype=Interface)
+    mask = np.ones(len(chain_data), dtype=bool)
+    rdkit_bounds_constraints = np.array(
+        rdkit_bounds_constraint_data, dtype=RDKitBoundsConstraint
+    )
+    chiral_atom_constraints = np.array(
+        chiral_atom_constraint_data, dtype=ChiralAtomConstraint
+    )
+    stereo_bond_constraints = np.array(
+        stereo_bond_constraint_data, dtype=StereoBondConstraint
+    )
+    planar_bond_constraints = np.array(
+        planar_bond_constraint_data, dtype=PlanarBondConstraint
+    )
+    planar_ring_5_constraints = np.array(
+        planar_ring_5_constraint_data, dtype=PlanarRing5Constraint
+    )
+    planar_ring_6_constraints = np.array(
+        planar_ring_6_constraint_data, dtype=PlanarRing6Constraint
+    )
+
+    if boltz_2:
+        atom_data = [(a[0], a[3], a[5], 0.0, 1.0) for a in atom_data]
+        connections = [(*c, const.bond_type_ids["COVALENT"]) for c in connections]
+        bond_data = bond_data + connections
+        atoms = np.array(atom_data, dtype=AtomV2)
+        bonds = np.array(bond_data, dtype=BondV2)
+        coords = [(x,) for x in atoms["coords"]]
+        coords = np.array(coords, Coords)
+        ensemble = np.array([(0, len(coords))], dtype=Ensemble)
+        data = StructureV2(
+            atoms=atoms,
+            bonds=bonds,
+            residues=residues,
+            chains=chains,
+            interfaces=interfaces,
+            mask=mask,
+            coords=coords,
+            ensemble=ensemble,
+        )
+    else:
+        bond_data = [(b[4], b[5], b[6]) for b in bond_data]
+        atom_data = [(convert_atom_name(a[0]), *a[1:]) for a in atom_data]
+        atoms = np.array(atom_data, dtype=Atom)
+        bonds = np.array(bond_data, dtype=Bond)
+        connections = np.array(connections, dtype=Connection)
+        data = Structure(
+            atoms=atoms,
+            bonds=bonds,
+            residues=residues,
+            chains=chains,
+            connections=connections,
+            interfaces=interfaces,
+            mask=mask,
+        )
+
+    # Create metadata
+    struct_info = StructureInfo(num_chains=len(chains))
+    chain_infos = []
+    for chain in chains:
+        chain_info = ChainInfo(
+            chain_id=int(chain["asym_id"]),
+            chain_name=chain["name"],
+            mol_type=int(chain["mol_type"]),
+            cluster_id=-1,
+            msa_id=chain_to_msa[chain["name"]],
+            num_residues=int(chain["res_num"]),
+            valid=True,
+            entity_id=int(chain["entity_id"]),
+        )
+        chain_infos.append(chain_info)
+
+    options = InferenceOptions(
+        pocket_constraints=pocket_constraints, contact_constraints=contact_constraints
+    )
+    record = Record(
+        id=name,
+        structure=struct_info,
+        chains=chain_infos,
+        interfaces=[],
+        inference_options=options,
+        templates=template_records,
+        affinity=affinity_info,
+    )
+
+    residue_constraints = ResidueConstraints(
+        rdkit_bounds_constraints=rdkit_bounds_constraints,
+        chiral_atom_constraints=chiral_atom_constraints,
+        stereo_bond_constraints=stereo_bond_constraints,
+        planar_bond_constraints=planar_bond_constraints,
+        planar_ring_5_constraints=planar_ring_5_constraints,
+        planar_ring_6_constraints=planar_ring_6_constraints,
+    )
+    return Target(
+        record=record,
+        structure=data,
+        sequences=entity_to_seq,
+        residue_constraints=residue_constraints,
+        templates=templates,
+        extra_mols=extra_mols,
+    )
+
+
+def standardize(smiles: str) -> Optional[str]:
+    """Standardize a molecule and return its SMILES and a flag indicating whether the molecule is valid.
+    This version has exception handling, which the original in mol-finder/data doesn't have. I didn't change the mol-finder/data
+    since there are a lot of other functions that depend on it and I didn't want to break them.
+    """
+    LARGEST_FRAGMENT_CHOOSER = rdMolStandardize.LargestFragmentChooser()
+
+    mol = Chem.MolFromSmiles(smiles, sanitize=False)
+
+    exclude = exclude_flag(mol, includeRDKitSanitization=False)
+
+    if exclude:
+        raise ValueError("Molecule is excluded")
+
+    # Standardize with ChEMBL data curation pipeline. During standardization, the molecule may be broken
+    # Choose molecule with largest component
+    mol = LARGEST_FRAGMENT_CHOOSER.choose(mol)
+    # Standardize with ChEMBL data curation pipeline. During standardization, the molecule may be broken
+    mol = standardize_mol(mol)
+    smiles = Chem.MolToSmiles(mol)
+
+    # Check if molecule can be parsed by RDKit (in rare cases, the molecule may be broken during standardization)
+    if Chem.MolFromSmiles(smiles) is None:
+        raise ValueError("Molecule is broken")
+
+    return smiles
diff --git a/forks/boltz/src/boltz/data/parse/yaml.py b/forks/boltz/src/boltz/data/parse/yaml.py
new file mode 100644
index 00000000..a08b7abf
--- /dev/null
+++ b/forks/boltz/src/boltz/data/parse/yaml.py
@@ -0,0 +1,68 @@
+from pathlib import Path
+
+import yaml
+from rdkit.Chem.rdchem import Mol
+
+from boltz.data.parse.schema import parse_boltz_schema
+from boltz.data.types import Target
+
+
+def parse_yaml(
+    path: Path,
+    ccd: dict[str, Mol],
+    mol_dir: Path,
+    boltz2: bool = False,
+) -> Target:
+    """Parse a Boltz input yaml / json.
+
+    The input file should be a yaml file with the following format:
+
+    sequences:
+        - protein:
+            id: A
+            sequence: "MADQLTEEQIAEFKEAFSLF"
+        - protein:
+            id: [B, C]
+            sequence: "AKLSILPWGHC"
+        - rna:
+            id: D
+            sequence: "GCAUAGC"
+        - ligand:
+            id: E
+            smiles: "CC1=CC=CC=C1"
+        - ligand:
+            id: [F, G]
+            ccd: []
+    constraints:
+        - bond:
+            atom1: [A, 1, CA]
+            atom2: [A, 2, N]
+        - pocket:
+            binder: E
+            contacts: [[B, 1], [B, 2]]
+    templates:
+        - path: /path/to/template.pdb
+          ids: [A] # optional, specify which chains to template
+
+    version: 1
+
+    Parameters
+    ----------
+    path : Path
+        Path to the YAML input format.
+    components : Dict
+        Dictionary of CCD components.
+    boltz2 : bool
+        Whether to parse the input for Boltz2.
+
+    Returns
+    -------
+    Target
+        The parsed target.
+
+    """
+    with path.open("r") as file:
+        data = yaml.safe_load(file)
+
+    name = path.stem
+    return parse_boltz_schema(name, data, ccd, mol_dir, boltz2)
diff --git a/forks/boltz/src/boltz/data/sample/__init__.py b/forks/boltz/src/boltz/data/sample/__init__.py
new file mode 100644
index 00000000..e69de29b
diff --git a/forks/boltz/src/boltz/data/sample/cluster.py b/forks/boltz/src/boltz/data/sample/cluster.py
new file mode 100644
index 00000000..fb5c2e66
--- /dev/null
+++ b/forks/boltz/src/boltz/data/sample/cluster.py
@@ -0,0 +1,283 @@
+from typing import Dict, Iterator, List
+
+import numpy as np
+from numpy.random import RandomState
+
+from boltz.data import const
+from boltz.data.types import ChainInfo, InterfaceInfo, Record
+from boltz.data.sample.sampler import Sample, Sampler
+
+
+def get_chain_cluster(chain: ChainInfo, record: Record) -> str:  # noqa: ARG001
+    """Get the cluster id for a chain.
+
+    Parameters
+    ----------
+    chain : ChainInfo
+        The chain id to get the cluster id for.
+    record : Record
+        The record the interface is part of.
+
+    Returns
+    -------
+    str
+        The cluster id of the chain.
+
+    """
+    return chain.cluster_id
+
+
+def get_interface_cluster(interface: InterfaceInfo, record: Record) -> str:
+    """Get the cluster id for an interface.
+
+    Parameters
+    ----------
+    interface : InterfaceInfo
+        The interface to get the cluster id for.
+    record : Record
+        The record the interface is part of.
+
+    Returns
+    -------
+    str
+        The cluster id of the interface.
+
+    """
+    chain1 = record.chains[interface.chain_1]
+    chain2 = record.chains[interface.chain_2]
+
+    cluster_1 = str(chain1.cluster_id)
+    cluster_2 = str(chain2.cluster_id)
+
+    cluster_id = (cluster_1, cluster_2)
+    cluster_id = tuple(sorted(cluster_id))
+
+    return cluster_id
+
+
+def get_chain_weight(
+    chain: ChainInfo,
+    record: Record,  # noqa: ARG001
+    clusters: Dict[str, int],
+    beta_chain: float,
+    alpha_prot: float,
+    alpha_nucl: float,
+    alpha_ligand: float,
+) -> float:
+    """Get the weight of a chain.
+
+    Parameters
+    ----------
+    chain : ChainInfo
+        The chain to get the weight for.
+    record : Record
+        The record the chain is part of.
+    clusters : Dict[str, int]
+        The cluster sizes.
+    beta_chain : float
+        The beta value for chains.
+    alpha_prot : float
+        The alpha value for proteins.
+    alpha_nucl : float
+        The alpha value for nucleic acids.
+    alpha_ligand : float
+        The alpha value for ligands.
+
+    Returns
+    -------
+    float
+        The weight of the chain.
+
+    """
+    prot_id = const.chain_type_ids["PROTEIN"]
+    rna_id = const.chain_type_ids["RNA"]
+    dna_id = const.chain_type_ids["DNA"]
+    ligand_id = const.chain_type_ids["NONPOLYMER"]
+
+    weight = beta_chain / clusters[chain.cluster_id]
+    if chain.mol_type == prot_id:
+        weight *= alpha_prot
+    elif chain.mol_type in [rna_id, dna_id]:
+        weight *= alpha_nucl
+    elif chain.mol_type == ligand_id:
+        weight *= alpha_ligand
+
+    return weight
+
+
+def get_interface_weight(
+    interface: InterfaceInfo,
+    record: Record,
+    clusters: Dict[str, int],
+    beta_interface: float,
+    alpha_prot: float,
+    alpha_nucl: float,
+    alpha_ligand: float,
+) -> float:
+    """Get the weight of an interface.
+
+    Parameters
+    ----------
+    interface : InterfaceInfo
+        The interface to get the weight for.
+    record : Record
+        The record the interface is part of.
+    clusters : Dict[str, int]
+        The cluster sizes.
+    beta_interface : float
+        The beta value for interfaces.
+    alpha_prot : float
+        The alpha value for proteins.
+    alpha_nucl : float
+        The alpha value for nucleic acids.
+    alpha_ligand : float
+        The alpha value for ligands.
+
+    Returns
+    -------
+    float
+        The weight of the interface.
+
+    """
+    prot_id = const.chain_type_ids["PROTEIN"]
+    rna_id = const.chain_type_ids["RNA"]
+    dna_id = const.chain_type_ids["DNA"]
+    ligand_id = const.chain_type_ids["NONPOLYMER"]
+
+    chain1 = record.chains[interface.chain_1]
+    chain2 = record.chains[interface.chain_2]
+
+    n_prot = (chain1.mol_type) == prot_id
+    n_nuc = chain1.mol_type in [rna_id, dna_id]
+    n_ligand = chain1.mol_type == ligand_id
+
+    n_prot += chain2.mol_type == prot_id
+    n_nuc += chain2.mol_type in [rna_id, dna_id]
+    n_ligand += chain2.mol_type == ligand_id
+
+    weight = beta_interface / clusters[get_interface_cluster(interface, record)]
+    weight *= alpha_prot * n_prot + alpha_nucl * n_nuc + alpha_ligand * n_ligand
+    return weight
+
+
+class ClusterSampler(Sampler):
+    """The weighted sampling approach, as described in AF3.
+
+    Each chain / interface is given a weight according
+    to the following formula, and sampled accordingly:
+
+    w = b / n_clust *(a_prot * n_prot + a_nuc * n_nuc
+        + a_ligand * n_ligand)
+
+    """
+
+    def __init__(
+        self,
+        alpha_prot: float = 3.0,
+        alpha_nucl: float = 3.0,
+        alpha_ligand: float = 1.0,
+        beta_chain: float = 0.5,
+        beta_interface: float = 1.0,
+    ) -> None:
+        """Initialize the sampler.
+
+        Parameters
+        ----------
+        alpha_prot : float, optional
+            The alpha value for proteins.
+        alpha_nucl : float, optional
+            The alpha value for nucleic acids.
+        alpha_ligand : float, optional
+            The alpha value for ligands.
+        beta_chain : float, optional
+            The beta value for chains.
+        beta_interface : float, optional
+            The beta value for interfaces.
+
+        """
+        self.alpha_prot = alpha_prot
+        self.alpha_nucl = alpha_nucl
+        self.alpha_ligand = alpha_ligand
+        self.beta_chain = beta_chain
+        self.beta_interface = beta_interface
+
+    def sample(self, records: List[Record], random: RandomState) -> Iterator[Sample]:  # noqa: C901, PLR0912
+        """Sample a structure from the dataset infinitely.
+
+        Parameters
+        ----------
+        records : List[Record]
+            The records to sample from.
+        random : RandomState
+            The random state for reproducibility.
+
+        Yields
+        ------
+        Sample
+            A data sample.
+
+        """
+        # Compute chain cluster sizes
+        chain_clusters: Dict[str, int] = {}
+        for record in records:
+            for chain in record.chains:
+                if not chain.valid:
+                    continue
+                cluster_id = get_chain_cluster(chain, record)
+                if cluster_id not in chain_clusters:
+                    chain_clusters[cluster_id] = 0
+                chain_clusters[cluster_id] += 1
+
+        # Compute interface clusters sizes
+        interface_clusters: Dict[str, int] = {}
+        for record in records:
+            for interface in record.interfaces:
+                if not interface.valid:
+                    continue
+                cluster_id = get_interface_cluster(interface, record)
+                if cluster_id not in interface_clusters:
+                    interface_clusters[cluster_id] = 0
+                interface_clusters[cluster_id] += 1
+
+        # Compute weights
+        items, weights = [], []
+        for record in records:
+            for chain_id, chain in enumerate(record.chains):
+                if not chain.valid:
+                    continue
+                weight = get_chain_weight(
+                    chain,
+                    record,
+                    chain_clusters,
+                    self.beta_chain,
+                    self.alpha_prot,
+                    self.alpha_nucl,
+                    self.alpha_ligand,
+                )
+                items.append((record, 0, chain_id))
+                weights.append(weight)
+
+            for int_id, interface in enumerate(record.interfaces):
+                if not interface.valid:
+                    continue
+                weight = get_interface_weight(
+                    interface,
+                    record,
+                    interface_clusters,
+                    self.beta_interface,
+                    self.alpha_prot,
+                    self.alpha_nucl,
+                    self.alpha_ligand,
+                )
+                items.append((record, 1, int_id))
+                weights.append(weight)
+
+        # Sample infinitely
+        weights = np.array(weights) / np.sum(weights)
+        while True:
+            item_idx = random.choice(len(items), p=weights)
+            record, kind, index = items[item_idx]
+            if kind == 0:
+                yield Sample(record=record, chain_id=index)
+            else:
+                yield Sample(record=record, interface_id=index)
diff --git a/forks/boltz/src/boltz/data/sample/distillation.py b/forks/boltz/src/boltz/data/sample/distillation.py
new file mode 100644
index 00000000..9314f510
--- /dev/null
+++ b/forks/boltz/src/boltz/data/sample/distillation.py
@@ -0,0 +1,57 @@
+from typing import Iterator, List
+
+from numpy.random import RandomState
+
+from boltz.data.types import Record
+from boltz.data.sample.sampler import Sample, Sampler
+
+
+class DistillationSampler(Sampler):
+    """A sampler for monomer distillation data."""
+
+    def __init__(self, small_size: int = 200, small_prob: float = 0.01) -> None:
+        """Initialize the sampler.
+
+        Parameters
+        ----------
+        small_size : int, optional
+            The maximum size to be considered small.
+        small_prob : float, optional
+            The probability of sampling a small item.
+
+        """
+        self._size = small_size
+        self._prob = small_prob
+
+    def sample(self, records: List[Record], random: RandomState) -> Iterator[Sample]:
+        """Sample a structure from the dataset infinitely.
+
+        Parameters
+        ----------
+        records : List[Record]
+            The records to sample from.
+        random : RandomState
+            The random state for reproducibility.
+
+        Yields
+        ------
+        Sample
+            A data sample.
+
+        """
+        # Remove records with invalid chains
+        records = [r for r in records if r.chains[0].valid]
+
+        # Split in small and large proteins. We assume that there is only
+        # one chain per record, as is the case for monomer distillation
+        small = [r for r in records if r.chains[0].num_residues <= self._size]
+        large = [r for r in records if r.chains[0].num_residues > self._size]
+
+        # Sample infinitely
+        while True:
+            # Sample small or large
+            samples = small if random.rand() < self._prob else large
+
+            # Sample item from the list
+            index = random.randint(0, len(samples))
+            yield Sample(record=samples[index])
diff --git a/forks/boltz/src/boltz/data/sample/random.py b/forks/boltz/src/boltz/data/sample/random.py
new file mode 100644
index 00000000..e2ee2314
--- /dev/null
+++ b/forks/boltz/src/boltz/data/sample/random.py
@@ -0,0 +1,39 @@
+from dataclasses import replace
+from typing import Iterator, List
+
+from numpy.random import RandomState
+
+from boltz.data.types import Record
+from boltz.data.sample.sampler import Sample, Sampler
+
+
+class RandomSampler(Sampler):
+    """A simple random sampler with replacement."""
+
+    def sample(self, records: List[Record], random: RandomState) -> Iterator[Sample]:
+        """Sample a structure from the dataset infinitely.
+
+        Parameters
+        ----------
+        records : List[Record]
+            The records to sample from.
+        random : RandomState
+            The random state for reproducibility.
+
+        Yields
+        ------
+        Sample
+            A data sample.
+
+        """
+        while True:
+            # Sample item from the list
+            index = random.randint(0, len(records))
+            record = records[index]
+
+            # Remove invalid chains and interfaces
+            chains = [c for c in record.chains if c.valid]
+            interfaces = [i for i in record.interfaces if i.valid]
+            record = replace(record, chains=chains, interfaces=interfaces)
+
+            yield Sample(record=record)
diff --git a/forks/boltz/src/boltz/data/sample/sampler.py b/forks/boltz/src/boltz/data/sample/sampler.py
new file mode 100644
index 00000000..6c6ab6dd
--- /dev/null
+++ b/forks/boltz/src/boltz/data/sample/sampler.py
@@ -0,0 +1,49 @@
+from abc import ABC, abstractmethod
+from dataclasses import dataclass
+from typing import Iterator, List, Optional
+
+from numpy.random import RandomState
+
+from boltz.data.types import Record
+
+
+@dataclass
+class Sample:
+    """A sample with optional chain and interface IDs.
+
+    Attributes
+    ----------
+    record : Record
+        The record.
+    chain_id : Optional[int]
+        The chain ID.
+    interface_id : Optional[int]
+        The interface ID.
+    """
+
+    record: Record
+    chain_id: Optional[int] = None
+    interface_id: Optional[int] = None
+
+
+class Sampler(ABC):
+    """Abstract base class for samplers."""
+
+    @abstractmethod
+    def sample(self, records: List[Record], random: RandomState) -> Iterator[Sample]:
+        """Sample a structure from the dataset infinitely.
+
+        Parameters
+        ----------
+        records : List[Record]
+            The records to sample from.
+        random : RandomState
+            The random state for reproducibility.
+
+        Yields
+        ------
+        Sample
+            A data sample.
+
+        """
+        raise NotImplementedError
diff --git a/forks/boltz/src/boltz/data/tokenize/__init__.py b/forks/boltz/src/boltz/data/tokenize/__init__.py
new file mode 100644
index 00000000..e69de29b
diff --git a/forks/boltz/src/boltz/data/tokenize/boltz.py b/forks/boltz/src/boltz/data/tokenize/boltz.py
new file mode 100644
index 00000000..06c12645
--- /dev/null
+++ b/forks/boltz/src/boltz/data/tokenize/boltz.py
@@ -0,0 +1,217 @@
+from dataclasses import dataclass
+
+import numpy as np
+
+from boltz.data import const
+from boltz.data.tokenize.tokenizer import Tokenizer
+from boltz.data.types import Input, Token, TokenBond, Tokenized
+
+
+@dataclass
+class TokenData:
+    """TokenData datatype."""
+
+    token_idx: int
+    atom_idx: int
+    atom_num: int
+    res_idx: int
+    res_type: int
+    sym_id: int
+    asym_id: int
+    entity_id: int
+    mol_type: int
+    center_idx: int
+    disto_idx: int
+    center_coords: np.ndarray
+    disto_coords: np.ndarray
+    resolved_mask: bool
+    disto_mask: bool
+    cyclic_period: int
+
+
+def token_astuple(token: TokenData) -> tuple:
+    """Convert a TokenData object to a tuple."""
+    return (
+        token.token_idx,
+        token.atom_idx,
+        token.atom_num,
+        token.res_idx,
+        token.res_type,
+        token.sym_id,
+        token.asym_id,
+        token.entity_id,
+        token.mol_type,
+        token.center_idx,
+        token.disto_idx,
+        token.center_coords,
+        token.disto_coords,
+        token.resolved_mask,
+        token.disto_mask,
+        token.cyclic_period,
+    )
+
+
+class BoltzTokenizer(Tokenizer):
+    """Tokenize an input structure for training."""
+
+    def tokenize(self, data: Input) -> Tokenized:
+        """Tokenize the input data.
+
+        Parameters
+        ----------
+        data : Input
+            The input data.
+
+        Returns
+        -------
+        Tokenized
+            The tokenized data.
+
+        """
+        # Get structure data
+        struct = data.structure
+
+        # Create token data
+        token_data = []
+
+        # Keep track of atom_idx to token_idx
+        token_idx = 0
+        atom_to_token = {}
+
+        # Filter to valid chains only
+        chains = struct.chains[struct.mask]
+
+        for chain in chains:
+            # Get residue indices
+            res_start = chain["res_idx"]
+            res_end = chain["res_idx"] + chain["res_num"]
+
+            for res in struct.residues[res_start:res_end]:
+                # Get atom indices
+                atom_start = res["atom_idx"]
+                atom_end = res["atom_idx"] + res["atom_num"]
+
+                # Standard residues are tokens
+                if res["is_standard"]:
+                    # Get center and disto atoms
+                    center = struct.atoms[res["atom_center"]]
+                    disto = struct.atoms[res["atom_disto"]]
+
+                    # Token is present if centers are
+                    is_present = res["is_present"] & center["is_present"]
+                    is_disto_present = res["is_present"] & disto["is_present"]
+
+                    # Apply chain transformation
+                    c_coords = center["coords"]
+                    d_coords = disto["coords"]
+
+                    # Create token
+                    token = TokenData(
+                        token_idx=token_idx,
+                        atom_idx=res["atom_idx"],
+                        atom_num=res["atom_num"],
+                        res_idx=res["res_idx"],
+                        res_type=res["res_type"],
+                        sym_id=chain["sym_id"],
+                        asym_id=chain["asym_id"],
+                        entity_id=chain["entity_id"],
+                        mol_type=chain["mol_type"],
+                        center_idx=res["atom_center"],
+                        disto_idx=res["atom_disto"],
+                        center_coords=c_coords,
+                        disto_coords=d_coords,
+                        resolved_mask=is_present,
+                        disto_mask=is_disto_present,
+                        cyclic_period=chain["cyclic_period"],
+                    )
+                    token_data.append(token_astuple(token))
+
+                    # Update atom_idx to token_idx
+                    atom_to_token.update(
+                        dict.fromkeys(range(atom_start, atom_end), token_idx))
+
+                    token_idx += 1
+
+                # Non-standard are tokenized per atom
+                else:
+                    # We use the unk protein token as res_type
+                    unk_token = const.unk_token["PROTEIN"]
+                    unk_id = const.token_ids[unk_token]
+
+                    # Get atom coordinates
+                    atom_data = struct.atoms[atom_start:atom_end]
+                    atom_coords = atom_data["coords"]
+
+                    # Tokenize each atom
+                    for i, atom in enumerate(atom_data):
+                        # Token is present if atom is
+                        is_present = res["is_present"] & atom["is_present"]
+                        index = atom_start + i
+
+                        # Create token
+                        token = TokenData(
+                            token_idx=token_idx,
+                            atom_idx=index,
+                            atom_num=1,
+                            res_idx=res["res_idx"],
+                            res_type=unk_id,
+                            sym_id=chain["sym_id"],
+                            asym_id=chain["asym_id"],
+                            entity_id=chain["entity_id"],
+                            mol_type=chain["mol_type"],
+                            center_idx=index,
+                            disto_idx=index,
+                            center_coords=atom_coords[i],
+                            disto_coords=atom_coords[i],
+                            resolved_mask=is_present,
+                            disto_mask=is_present,
+                            cyclic_period=chain[
+                                "cyclic_period"
+                            ],  # Enforced to be False in chain parser
+                        )
+                        token_data.append(token_astuple(token))
+
+                        # Update atom_idx to token_idx
+                        atom_to_token[index] = token_idx
+                        token_idx += 1
+
+        # Create token bonds
+        token_bonds = []
+
+        # Add atom-atom bonds from ligands
+        for bond in struct.bonds:
+            if (
+                bond["atom_1"] not in atom_to_token
+                or bond["atom_2"] not in atom_to_token
+            ):
+                continue
+            token_bond = (
+                atom_to_token[bond["atom_1"]],
+                atom_to_token[bond["atom_2"]],
+            )
+            token_bonds.append(token_bond)
+
+        # Add connection bonds (covalent)
+        for conn in struct.connections:
+            if (
+                conn["atom_1"] not in atom_to_token
+                or conn["atom_2"] not in atom_to_token
+            ):
+                continue
+            token_bond = (
+                atom_to_token[conn["atom_1"]],
+                atom_to_token[conn["atom_2"]],
+            )
+            token_bonds.append(token_bond)
+
+        token_data = np.array(token_data, dtype=Token)
+        token_bonds = np.array(token_bonds, dtype=TokenBond)
+        tokenized = Tokenized(
+            tokens=token_data,
+            bonds=token_bonds,
+            structure=data.structure,
+            msa=data.msa,
+            record=data.record,
+            residue_constraints=data.residue_constraints,
+        )
+        return tokenized
diff --git a/forks/boltz/src/boltz/data/tokenize/boltz2.py b/forks/boltz/src/boltz/data/tokenize/boltz2.py
new file mode 100644
index 00000000..7371d6ae
--- /dev/null
+++ b/forks/boltz/src/boltz/data/tokenize/boltz2.py
@@ -0,0 +1,426 @@
+from dataclasses import dataclass
+from typing import Optional
+
+import numpy as np
+
+from boltz.data import const
+from boltz.data.tokenize.tokenizer import Tokenizer
+from boltz.data.types import (
+    AffinityInfo,
+    Input,
+    StructureV2,
+    TokenBondV2,
+    Tokenized,
+    TokenV2,
+)
+
+
+@dataclass
+class TokenData:
+    """TokenData datatype."""
+
+    token_idx: int
+    atom_idx: int
+    atom_num: int
+    res_idx: int
+    res_type: int
+    res_name: str
+    sym_id: int
+    asym_id: int
+    entity_id: int
+    mol_type: int
+    center_idx: int
+    disto_idx: int
+    center_coords: np.ndarray
+    disto_coords: np.ndarray
+    resolved_mask: bool
+    disto_mask: bool
+    modified: bool
+    frame_rot: np.ndarray
+    frame_t: np.ndarray
+    frame_mask: bool
+    cyclic_period: int
+    affinity_mask: bool = False
+
+
+def token_astuple(token: TokenData) -> tuple:
+    """Convert a TokenData object to a tuple."""
+    return (
+        token.token_idx,
+        token.atom_idx,
+        token.atom_num,
+        token.res_idx,
+        token.res_type,
+        token.res_name,
+        token.sym_id,
+        token.asym_id,
+        token.entity_id,
+        token.mol_type,
+        token.center_idx,
+        token.disto_idx,
+        token.center_coords,
+        token.disto_coords,
+        token.resolved_mask,
+        token.disto_mask,
+        token.modified,
+        token.frame_rot,
+        token.frame_t,
+        token.frame_mask,
+        token.cyclic_period,
+        token.affinity_mask,
+    )
+
+
+def compute_frame(
+    n: np.ndarray,
+    ca: np.ndarray,
+    c: np.ndarray,
+) -> tuple[np.ndarray, np.ndarray]:
+    """Compute the frame for a residue.
+
+    Parameters
+    ----------
+    n : np.ndarray
+        The N atom.
+    ca : np.ndarray
+        The C atom.
+    c : np.ndarray
+        The CA atom.
+
+    Returns
+    -------
+    np.ndarray
+        The frame.
+
+    """
+    v1 = c - ca
+    v2 = n - ca
+    e1 = v1 / (np.linalg.norm(v1) + 1e-10)
+    u2 = v2 - e1 * np.dot(e1.T, v2)
+    e2 = u2 / (np.linalg.norm(u2) + 1e-10)
+    e3 = np.cross(e1, e2)
+    rot = np.column_stack([e1, e2, e3])
+    t = ca
+    return rot, t
+
+
+def get_unk_token(chain: np.ndarray) -> int:
+    """Get the unk token for a residue.
+
+    Parameters
+    ----------
+    chain : np.ndarray
+        The chain.
+
+    Returns
+    -------
+    int
+        The unk token.
+
+    """
+    if chain["mol_type"] == const.chain_type_ids["DNA"]:
+        unk_token = const.unk_token["DNA"]
+    elif chain["mol_type"] == const.chain_type_ids["RNA"]:
+        unk_token = const.unk_token["RNA"]
+    else:
+        unk_token = const.unk_token["PROTEIN"]
+
+    res_id = const.token_ids[unk_token]
+    return res_id
+
+
+def tokenize_structure(  # noqa: C901, PLR0915
+    struct: StructureV2,
+    affinity: Optional[AffinityInfo] = None,
+) -> tuple[np.ndarray, np.ndarray]:
+    """Tokenize a structure.
+
+    Parameters
+    ----------
+    struct : StructureV2
+        The structure to tokenize.
+    affinity : Optional[AffinityInfo]
+        The affinity information.
+
+    Returns
+    -------
+    np.ndarray
+        The tokenized data.
+    np.ndarray
+        The tokenized bonds.
+
+    """
+    # Create token data
+    token_data = []
+
+    # Keep track of atom_idx to token_idx
+    token_idx = 0
+    atom_to_token = {}
+
+    # Filter to valid chains only
+    chains = struct.chains[struct.mask]
+
+    # Ensemble atom id start in coords table.
+    # For cropper and other operations, hardcoded to 0th conformer.
+    offset = struct.ensemble[0]["atom_coord_idx"]
+
+    for chain in chains:
+        # Get residue indices
+        res_start = chain["res_idx"]
+        res_end = chain["res_idx"] + chain["res_num"]
+        is_protein = chain["mol_type"] == const.chain_type_ids["PROTEIN"]
+        affinity_mask = (affinity is not None) and (
+            int(chain["asym_id"]) == int(affinity.chain_id)
+        )
+
+        for res in struct.residues[res_start:res_end]:
+            # Get atom indices
+            atom_start = res["atom_idx"]
+            atom_end = res["atom_idx"] + res["atom_num"]
+
+            # Standard residues are tokens
+            if res["is_standard"]:
+                # Get center and disto atoms
+                center = struct.atoms[res["atom_center"]]
+                disto = struct.atoms[res["atom_disto"]]
+
+                # Token is present if centers are
+                is_present = res["is_present"] & center["is_present"]
+                is_disto_present = res["is_present"] & disto["is_present"]
+
+                # Apply chain transformation
+                # Apply chain transformation
+                c_coords = struct.coords[offset + res["atom_center"]]["coords"]
+                d_coords = struct.coords[offset + res["atom_disto"]]["coords"]
+
+                # If protein, compute frame, only used for templates
+                frame_rot = np.eye(3).flatten()
+                frame_t = np.zeros(3)
+                frame_mask = False
+
+                if is_protein:
+                    # Get frame atoms
+                    atom_st = res["atom_idx"]
+                    atom_en = res["atom_idx"] + res["atom_num"]
+                    atoms = struct.atoms[atom_st:atom_en]
+
+                    # Atoms are always in the order N, CA, C
+                    atom_n = atoms[0]
+                    atom_ca = atoms[1]
+                    atom_c = atoms[2]
+
+                    # Compute frame and mask
+                    frame_mask = atom_ca["is_present"]
+                    frame_mask &= atom_c["is_present"]
+                    frame_mask &= atom_n["is_present"]
+                    frame_mask = bool(frame_mask)
+                    if frame_mask:
+                        frame_rot, frame_t = compute_frame(
+                            atom_n["coords"],
+                            atom_ca["coords"],
+                            atom_c["coords"],
+                        )
+                        frame_rot = frame_rot.flatten()
+
+                # Create token
+                token = TokenData(
+                    token_idx=token_idx,
+                    atom_idx=res["atom_idx"],
+                    atom_num=res["atom_num"],
+                    res_idx=res["res_idx"],
+                    res_type=res["res_type"],
+                    res_name=res["name"],
+                    sym_id=chain["sym_id"],
+                    asym_id=chain["asym_id"],
+                    entity_id=chain["entity_id"],
+                    mol_type=chain["mol_type"],
+                    center_idx=res["atom_center"],
+                    disto_idx=res["atom_disto"],
+                    center_coords=c_coords,
+                    disto_coords=d_coords,
+                    resolved_mask=is_present,
+                    disto_mask=is_disto_present,
+                    modified=False,
+                    frame_rot=frame_rot,
+                    frame_t=frame_t,
+                    frame_mask=frame_mask,
+                    cyclic_period=chain["cyclic_period"],
+                    affinity_mask=affinity_mask,
+                )
+                token_data.append(token_astuple(token))
+
+                # Update atom_idx to token_idx
+                atom_to_token.update(
+                    dict.fromkeys(range(atom_start, atom_end), token_idx)
+                )
+
+                token_idx += 1
+
+            # Non-standard are tokenized per atom
+            elif chain["mol_type"] == const.chain_type_ids["NONPOLYMER"]:
+                # We use the unk protein token as res_type
+                unk_token = const.unk_token["PROTEIN"]
+                unk_id = const.token_ids[unk_token]
+
+                # Get atom coordinates
+                atom_data = struct.atoms[atom_start:atom_end]
+                atom_coords = struct.coords[offset + atom_start : offset + atom_end][
+                    "coords"
+                ]
+
+                # Tokenize each atom
+                for i, atom in enumerate(atom_data):
+                    # Token is present if atom is
+                    is_present = res["is_present"] & atom["is_present"]
+                    index = atom_start + i
+
+                    # Create token
+                    token = TokenData(
+                        token_idx=token_idx,
+                        atom_idx=index,
+                        atom_num=1,
+                        res_idx=res["res_idx"],
+                        res_type=unk_id,
+                        res_name=res["name"],
+                        sym_id=chain["sym_id"],
+                        asym_id=chain["asym_id"],
+                        entity_id=chain["entity_id"],
+                        mol_type=chain["mol_type"],
+                        center_idx=index,
+                        disto_idx=index,
+                        center_coords=atom_coords[i],
+                        disto_coords=atom_coords[i],
+                        resolved_mask=is_present,
+                        disto_mask=is_present,
+                        modified=chain["mol_type"]
+                        != const.chain_type_ids["NONPOLYMER"],
+                        frame_rot=np.eye(3).flatten(),
+                        frame_t=np.zeros(3),
+                        frame_mask=False,
+                        cyclic_period=chain["cyclic_period"],
+                        affinity_mask=affinity_mask,
+                    )
+                    token_data.append(token_astuple(token))
+
+                    # Update atom_idx to token_idx
+                    atom_to_token[index] = token_idx
+                    token_idx += 1
+
+            # Modified residues in Boltz-2 are tokenized at residue level
+            else:
+                res_type = get_unk_token(chain)
+
+                # Get center and disto atoms
+                center = struct.atoms[res["atom_center"]]
+                disto = struct.atoms[res["atom_disto"]]
+
+                # Token is present if centers are
+                is_present = res["is_present"] & center["is_present"]
+                is_disto_present = res["is_present"] & disto["is_present"]
+
+                # Apply chain transformation
+                c_coords = struct.coords[offset + res["atom_center"]]["coords"]
+                d_coords = struct.coords[offset + res["atom_disto"]]["coords"]
+
+                # Create token
+                token = TokenData(
+                    token_idx=token_idx,
+                    atom_idx=res["atom_idx"],
+                    atom_num=res["atom_num"],
+                    res_idx=res["res_idx"],
+                    res_type=res_type,
+                    res_name=res["name"],
+                    sym_id=chain["sym_id"],
+                    asym_id=chain["asym_id"],
+                    entity_id=chain["entity_id"],
+                    mol_type=chain["mol_type"],
+                    center_idx=res["atom_center"],
+                    disto_idx=res["atom_disto"],
+                    center_coords=c_coords,
+                    disto_coords=d_coords,
+                    resolved_mask=is_present,
+                    disto_mask=is_disto_present,
+                    modified=True,
+                    frame_rot=np.eye(3).flatten(),
+                    frame_t=np.zeros(3),
+                    frame_mask=False,
+                    cyclic_period=chain["cyclic_period"],
+                    affinity_mask=affinity_mask,
+                )
+                token_data.append(token_astuple(token))
+
+                # Update atom_idx to token_idx
+                atom_to_token.update(
+                    dict.fromkeys(range(atom_start, atom_end), token_idx)
+                )
+
+                token_idx += 1
+
+    # Create token bonds
+    token_bonds = []
+
+    # Add atom-atom bonds from ligands
+    for bond in struct.bonds:
+        if bond["atom_1"] not in atom_to_token or bond["atom_2"] not in atom_to_token:
+            continue
+        token_bond = (
+            atom_to_token[bond["atom_1"]],
+            atom_to_token[bond["atom_2"]],
+            bond["type"] + 1,
+        )
+        token_bonds.append(token_bond)
+
+    token_data = np.array(token_data, dtype=TokenV2)
+    token_bonds = np.array(token_bonds, dtype=TokenBondV2)
+
+    return token_data, token_bonds
+
+
+class Boltz2Tokenizer(Tokenizer):
+    """Tokenize an input structure for training."""
+
+    def tokenize(self, data: Input) -> Tokenized:
+        """Tokenize the input data.
+
+        Parameters
+        ----------
+        data : Input
+            The input data.
+
+        Returns
+        -------
+        Tokenized
+            The tokenized data.
+
+        """
+        # Tokenize the structure
+        token_data, token_bonds = tokenize_structure(
+            data.structure, data.record.affinity
+        )
+
+        # Tokenize the templates
+        if data.templates is not None:
+            template_tokens = {}
+            template_bonds = {}
+            for template_id, template in data.templates.items():
+                tmpl_token_data, tmpl_token_bonds = tokenize_structure(template)
+                template_tokens[template_id] = tmpl_token_data
+                template_bonds[template_id] = tmpl_token_bonds
+        else:
+            template_tokens = None
+            template_bonds = None
+
+        # Create the tokenized data
+        tokenized = Tokenized(
+            tokens=token_data,
+            bonds=token_bonds,
+            structure=data.structure,
+            msa=data.msa,
+            record=data.record,
+            residue_constraints=data.residue_constraints,
+            templates=data.templates,
+            template_tokens=template_tokens,
+            template_bonds=template_bonds,
+            extra_mols=data.extra_mols,
+        )
+        return tokenized
diff --git a/forks/boltz/src/boltz/data/tokenize/tokenizer.py b/forks/boltz/src/boltz/data/tokenize/tokenizer.py
new file mode 100644
index 00000000..dce81229
--- /dev/null
+++ b/forks/boltz/src/boltz/data/tokenize/tokenizer.py
@@ -0,0 +1,24 @@
+from abc import ABC, abstractmethod
+
+from boltz.data.types import Input, Tokenized
+
+
+class Tokenizer(ABC):
+    """Tokenize an input structure for training."""
+
+    @abstractmethod
+    def tokenize(self, data: Input) -> Tokenized:
+        """Tokenize the input data.
+
+        Parameters
+        ----------
+        data : Input
+            The input data.
+
+        Returns
+        -------
+        Tokenized
+            The tokenized data.
+
+        """
+        raise NotImplementedError
diff --git a/forks/boltz/src/boltz/data/types.py b/forks/boltz/src/boltz/data/types.py
new file mode 100644
index 00000000..1ce26b55
--- /dev/null
+++ b/forks/boltz/src/boltz/data/types.py
@@ -0,0 +1,784 @@
+import json
+from dataclasses import asdict, dataclass
+from pathlib import Path
+from typing import Optional, Union
+
+import numpy as np
+from mashumaro.mixins.dict import DataClassDictMixin
+from rdkit.Chem import Mol
+
+####################################################################################################
+# SERIALIZABLE
+####################################################################################################
+
+
+class NumpySerializable:
+    """Serializable datatype."""
+
+    @classmethod
+    def load(cls: "NumpySerializable", path: Path) -> "NumpySerializable":
+        """Load the object from an NPZ file.
+
+        Parameters
+        ----------
+        path : Path
+            The path to the file.
+
+        Returns
+        -------
+        Serializable
+            The loaded object.
+
+        """
+        return cls(**np.load(path, allow_pickle=True))
+
+    def dump(self, path: Path) -> None:
+        """Dump the object to an NPZ file.
+
+        Parameters
+        ----------
+        path : Path
+            The path to the file.
+
+        """
+        np.savez_compressed(str(path), **asdict(self))
+
+
+class JSONSerializable(DataClassDictMixin):
+    """Serializable datatype."""
+
+    @classmethod
+    def load(cls: "JSONSerializable", path: Path) -> "JSONSerializable":
+        """Load the object from a JSON file.
+
+        Parameters
+        ----------
+        path : Path
+            The path to the file.
+
+        Returns
+        -------
+        Serializable
+            The loaded object.
+
+        """
+        with path.open("r") as f:
+            return cls.from_dict(json.load(f))
+
+    def dump(self, path: Path) -> None:
+        """Dump the object to a JSON file.
+
+        Parameters
+        ----------
+        path : Path
+            The path to the file.
+
+        """
+        with path.open("w") as f:
+            json.dump(self.to_dict(), f)
+
+
+####################################################################################################
+# STRUCTURE
+####################################################################################################
+
+Atom = [
+    ("name", np.dtype("4i1")),
+    ("element", np.dtype("i1")),
+    ("charge", np.dtype("i1")),
+    ("coords", np.dtype("3f4")),
+    ("conformer", np.dtype("3f4")),
+    ("is_present", np.dtype("?")),
+    ("chirality", np.dtype("i1")),
+]
+
+AtomV2 = [
+    ("name", np.dtype("<U4")),
+    ("coords", np.dtype("3f4")),
+    ("is_present", np.dtype("?")),
+    ("bfactor", np.dtype("f4")),
+    ("plddt", np.dtype("f4")),
+]
+
+Bond = [
+    ("atom_1", np.dtype("i4")),
+    ("atom_2", np.dtype("i4")),
+    ("type", np.dtype("i1")),
+]
+
+BondV2 = [
+    ("chain_1", np.dtype("i4")),
+    ("chain_2", np.dtype("i4")),
+    ("res_1", np.dtype("i4")),
+    ("res_2", np.dtype("i4")),
+    ("atom_1", np.dtype("i4")),
+    ("atom_2", np.dtype("i4")),
+    ("type", np.dtype("i1")),
+]
+
+Residue = [
+    ("name", np.dtype("<U5")),
+    ("res_type", np.dtype("i1")),
+    ("res_idx", np.dtype("i4")),
+    ("atom_idx", np.dtype("i4")),
+    ("atom_num", np.dtype("i4")),
+    ("atom_center", np.dtype("i4")),
+    ("atom_disto", np.dtype("i4")),
+    ("is_standard", np.dtype("?")),
+    ("is_present", np.dtype("?")),
+]
+
+Chain = [
+    ("name", np.dtype("<U5")),
+    ("mol_type", np.dtype("i1")),
+    ("entity_id", np.dtype("i4")),
+    ("sym_id", np.dtype("i4")),
+    ("asym_id", np.dtype("i4")),
+    ("atom_idx", np.dtype("i4")),
+    ("atom_num", np.dtype("i4")),
+    ("res_idx", np.dtype("i4")),
+    ("res_num", np.dtype("i4")),
+    ("cyclic_period", np.dtype("i4")),
+]
+
+Connection = [
+    ("chain_1", np.dtype("i4")),
+    ("chain_2", np.dtype("i4")),
+    ("res_1", np.dtype("i4")),
+    ("res_2", np.dtype("i4")),
+    ("atom_1", np.dtype("i4")),
+    ("atom_2", np.dtype("i4")),
+]
+
+Interface = [
+    ("chain_1", np.dtype("i4")),
+    ("chain_2", np.dtype("i4")),
+]
+
+Coords = [
+    ("coords", np.dtype("3f4")),
+]
+
+Ensemble = [
+    ("atom_coord_idx", np.dtype("i4")),
+    ("atom_num", np.dtype("i4")),
+]
+
+
+@dataclass(frozen=True)
+class Structure(NumpySerializable):
+    """Structure datatype."""
+
+    atoms: np.ndarray
+    bonds: np.ndarray
+    residues: np.ndarray
+    chains: np.ndarray
+    connections: np.ndarray
+    interfaces: np.ndarray
+    mask: np.ndarray
+
+    @classmethod
+    def load(cls: "Structure", path: Path) -> "Structure":
+        """Load a structure from an NPZ file.
+
+        Parameters
+        ----------
+        path : Path
+            The path to the file.
+
+        Returns
+        -------
+        Structure
+            The loaded structure.
+
+        """
+        structure = np.load(path)
+        return cls(
+            atoms=structure["atoms"],
+            bonds=structure["bonds"],
+            residues=structure["residues"],
+            chains=structure["chains"],
+            connections=structure["connections"].astype(Connection),
+            interfaces=structure["interfaces"],
+            mask=structure["mask"],
+        )
+
+    def remove_invalid_chains(self) -> "Structure":  # noqa: PLR0915
+        """Remove invalid chains.
+
+        Parameters
+        ----------
+        structure : Structure
+            The structure to process.
+
+        Returns
+        -------
+        Structure
+            The structure with masked chains removed.
+
+        """
+        entity_counter = {}
+        atom_idx, res_idx, chain_idx = 0, 0, 0
+        atoms, residues, chains = [], [], []
+        atom_map, res_map, chain_map = {}, {}, {}
+        for i, chain in enumerate(self.chains):
+            # Skip masked chains
+            if not self.mask[i]:
+                continue
+
+            # Update entity counter
+            entity_id = chain["entity_id"]
+            if entity_id not in entity_counter:
+                entity_counter[entity_id] = 0
+            else:
+                entity_counter[entity_id] += 1
+
+            # Update the chain
+            new_chain = chain.copy()
+            new_chain["atom_idx"] = atom_idx
+            new_chain["res_idx"] = res_idx
+            new_chain["asym_id"] = chain_idx
+            new_chain["sym_id"] = entity_counter[entity_id]
+            chains.append(new_chain)
+            chain_map[i] = chain_idx
+            chain_idx += 1
+
+            # Add the chain residues
+            res_start = chain["res_idx"]
+            res_end = chain["res_idx"] + chain["res_num"]
+            for j, res in enumerate(self.residues[res_start:res_end]):
+                # Update the residue
+                new_res = res.copy()
+                new_res["atom_idx"] = atom_idx
+                new_res["atom_center"] = (
+                    atom_idx + new_res["atom_center"] - res["atom_idx"]
+                )
+                new_res["atom_disto"] = (
+                    atom_idx + new_res["atom_disto"] - res["atom_idx"]
+                )
+                residues.append(new_res)
+                res_map[res_start + j] = res_idx
+                res_idx += 1
+
+                # Update the atoms
+                start = res["atom_idx"]
+                end = res["atom_idx"] + res["atom_num"]
+                atoms.append(self.atoms[start:end])
+                atom_map.update({k: atom_idx + k - start for k in range(start, end)})
+                atom_idx += res["atom_num"]
+
+        # Concatenate the tables
+        atoms = np.concatenate(atoms, dtype=Atom)
+        residues = np.array(residues, dtype=Residue)
+        chains = np.array(chains, dtype=Chain)
+
+        # Update bonds
+        bonds = []
+        for bond in self.bonds:
+            atom_1 = bond["atom_1"]
+            atom_2 = bond["atom_2"]
+            if (atom_1 in atom_map) and (atom_2 in atom_map):
+                new_bond = bond.copy()
+                new_bond["atom_1"] = atom_map[atom_1]
+                new_bond["atom_2"] = atom_map[atom_2]
+                bonds.append(new_bond)
+
+        # Update connections
+        connections = []
+        for connection in self.connections:
+            chain_1 = connection["chain_1"]
+            chain_2 = connection["chain_2"]
+            res_1 = connection["res_1"]
+            res_2 = connection["res_2"]
+            atom_1 = connection["atom_1"]
+            atom_2 = connection["atom_2"]
+            if (atom_1 in atom_map) and (atom_2 in atom_map):
+                new_connection = connection.copy()
+                new_connection["chain_1"] = chain_map[chain_1]
+                new_connection["chain_2"] = chain_map[chain_2]
+                new_connection["res_1"] = res_map[res_1]
+                new_connection["res_2"] = res_map[res_2]
+                new_connection["atom_1"] = atom_map[atom_1]
+                new_connection["atom_2"] = atom_map[atom_2]
+                connections.append(new_connection)
+
+        # Create arrays
+        bonds = np.array(bonds, dtype=Bond)
+        connections = np.array(connections, dtype=Connection)
+        interfaces = np.array([], dtype=Interface)
+        mask = np.ones(len(chains), dtype=bool)
+
+        return Structure(
+            atoms=atoms,
+            bonds=bonds,
+            residues=residues,
+            chains=chains,
+            connections=connections,
+            interfaces=interfaces,
+            mask=mask,
+        )
+
+
+@dataclass(frozen=True)
+class StructureV2(NumpySerializable):
+    """Structure datatype."""
+
+    atoms: np.ndarray
+    bonds: np.ndarray
+    residues: np.ndarray
+    chains: np.ndarray
+    interfaces: np.ndarray
+    mask: np.ndarray
+    coords: np.ndarray
+    ensemble: np.ndarray
+    pocket: Optional[np.ndarray] = None
+
+    def remove_invalid_chains(self) -> "StructureV2":  # noqa: PLR0915
+        """Remove invalid chains.
+
+        Parameters
+        ----------
+        structure : Structure
+            The structure to process.
+
+        Returns
+        -------
+        Structure
+            The structure with masked chains removed.
+
+        """
+        entity_counter = {}
+        atom_idx, res_idx, chain_idx = 0, 0, 0
+        atoms, residues, chains = [], [], []
+        atom_map, res_map, chain_map = {}, {}, {}
+        for i, chain in enumerate(self.chains):
+            # Skip masked chains
+            if not self.mask[i]:
+                continue
+
+            # Update entity counter
+            entity_id = chain["entity_id"]
+            if entity_id not in entity_counter:
+                entity_counter[entity_id] = 0
+            else:
+                entity_counter[entity_id] += 1
+
+            # Update the chain
+            new_chain = chain.copy()
+            new_chain["atom_idx"] = atom_idx
+            new_chain["res_idx"] = res_idx
+            new_chain["asym_id"] = chain_idx
+            new_chain["sym_id"] = entity_counter[entity_id]
+            chains.append(new_chain)
+            chain_map[i] = chain_idx
+            chain_idx += 1
+
+            # Add the chain residues
+            res_start = chain["res_idx"]
+            res_end = chain["res_idx"] + chain["res_num"]
+            for j, res in enumerate(self.residues[res_start:res_end]):
+                # Update the residue
+                new_res = res.copy()
+                new_res["atom_idx"] = atom_idx
+                new_res["atom_center"] = (
+                    atom_idx + new_res["atom_center"] - res["atom_idx"]
+                )
+                new_res["atom_disto"] = (
+                    atom_idx + new_res["atom_disto"] - res["atom_idx"]
+                )
+                residues.append(new_res)
+                res_map[res_start + j] = res_idx
+                res_idx += 1
+
+                # Update the atoms
+                start = res["atom_idx"]
+                end = res["atom_idx"] + res["atom_num"]
+                atoms.append(self.atoms[start:end])
+                atom_map.update({k: atom_idx + k - start for k in range(start, end)})
+                atom_idx += res["atom_num"]
+
+        # Concatenate the tables
+        atoms = np.concatenate(atoms, dtype=AtomV2)
+        residues = np.array(residues, dtype=Residue)
+        chains = np.array(chains, dtype=Chain)
+
+        # Update bonds
+        bonds = []
+        for bond in self.bonds:
+            chain_1 = bond["chain_1"]
+            chain_2 = bond["chain_2"]
+            res_1 = bond["res_1"]
+            res_2 = bond["res_2"]
+            atom_1 = bond["atom_1"]
+            atom_2 = bond["atom_2"]
+            if (atom_1 in atom_map) and (atom_2 in atom_map):
+                new_bond = bond.copy()
+                new_bond["chain_1"] = chain_map[chain_1]
+                new_bond["chain_2"] = chain_map[chain_2]
+                new_bond["res_1"] = res_map[res_1]
+                new_bond["res_2"] = res_map[res_2]
+                new_bond["atom_1"] = atom_map[atom_1]
+                new_bond["atom_2"] = atom_map[atom_2]
+                bonds.append(new_bond)
+
+        # Create arrays
+        bonds = np.array(bonds, dtype=BondV2)
+        interfaces = np.array([], dtype=Interface)
+        mask = np.ones(len(chains), dtype=bool)
+        coords = [(x,) for x in atoms["coords"]]
+        coords = np.array(coords, dtype=Coords)
+        ensemble = np.array([(0, len(coords))], dtype=Ensemble)
+
+        return StructureV2(
+            atoms=atoms,
+            bonds=bonds,
+            residues=residues,
+            chains=chains,
+            interfaces=interfaces,
+            mask=mask,
+            coords=coords,
+            ensemble=ensemble,
+        )
+
+
+####################################################################################################
+# MSA
+####################################################################################################
+
+
+MSAResidue = [
+    ("res_type", np.dtype("i1")),
+]
+
+MSADeletion = [
+    ("res_idx", np.dtype("i2")),
+    ("deletion", np.dtype("i2")),
+]
+
+MSASequence = [
+    ("seq_idx", np.dtype("i2")),
+    ("taxonomy", np.dtype("i4")),
+    ("res_start", np.dtype("i4")),
+    ("res_end", np.dtype("i4")),
+    ("del_start", np.dtype("i4")),
+    ("del_end", np.dtype("i4")),
+]
+
+
+@dataclass(frozen=True)
+class MSA(NumpySerializable):
+    """MSA datatype."""
+
+    sequences: np.ndarray
+    deletions: np.ndarray
+    residues: np.ndarray
+
+
+####################################################################################################
+# RECORD
+####################################################################################################
+
+
+@dataclass(frozen=True)
+class StructureInfo:
+    """StructureInfo datatype."""
+
+    resolution: Optional[float] = None
+    method: Optional[str] = None
+    deposited: Optional[str] = None
+    released: Optional[str] = None
+    revised: Optional[str] = None
+    num_chains: Optional[int] = None
+    num_interfaces: Optional[int] = None
+    pH: Optional[float] = None
+    temperature: Optional[float] = None
+
+
+@dataclass(frozen=False)
+class ChainInfo:
+    """ChainInfo datatype."""
+
+    chain_id: int
+    chain_name: str
+    mol_type: int
+    cluster_id: Union[str, int]
+    msa_id: Union[str, int]
+    num_residues: int
+    valid: bool = True
+    entity_id: Optional[Union[str, int]] = None
+
+
+@dataclass(frozen=True)
+class InterfaceInfo:
+    """InterfaceInfo datatype."""
+
+    chain_1: int
+    chain_2: int
+    valid: bool = True
+
+
+@dataclass(frozen=True)
+class InferenceOptions:
+    """InferenceOptions datatype."""
+
+    pocket_constraints: Optional[
+        list[tuple[int, list[tuple[int, int]], float, bool]]
+    ] = None
+    contact_constraints: Optional[
+        list[tuple[tuple[int, int], tuple[int, int], float, bool]]
+    ] = None
+
+
+@dataclass(frozen=True)
+class MDInfo:
+    """MDInfo datatype."""
+
+    forcefield: Optional[list[str]]
+    temperature: Optional[float]  # Kelvin
+    pH: Optional[float]
+    pressure: Optional[float]  # bar
+    prod_ensemble: Optional[str]
+    solvent: Optional[str]
+    ion_concentration: Optional[float]  # mM
+    time_step: Optional[float]  # fs
+    sample_frame_time: Optional[float]  # ps
+    sim_time: Optional[float]  # ns
+    coarse_grained: Optional[bool] = False
+
+
+@dataclass(frozen=True)
+class TemplateInfo:
+    """InterfaceInfo datatype."""
+
+    name: str
+    query_chain: str
+    query_st: int
+    query_en: int
+    template_chain: str
+    template_st: int
+    template_en: int
+    force: bool = False
+    threshold: Optional[float] = float("inf")
+
+
+@dataclass(frozen=True)
+class AffinityInfo:
+    """AffinityInfo datatype."""
+
+    chain_id: int
+    mw: float
+
+
+@dataclass(frozen=True)
+class Record(JSONSerializable):
+    """Record datatype."""
+
+    id: str
+    structure: StructureInfo
+    chains: list[ChainInfo]
+    interfaces: list[InterfaceInfo]
+    inference_options: Optional[InferenceOptions] = None
+    templates: Optional[list[TemplateInfo]] = None
+    md: Optional[MDInfo] = None
+    affinity: Optional[AffinityInfo] = None
+
+
+####################################################################################################
+# RESIDUE CONSTRAINTS
+####################################################################################################
+
+
+RDKitBoundsConstraint = [
+    ("atom_idxs", np.dtype("2i4")),
+    ("is_bond", np.dtype("?")),
+    ("is_angle", np.dtype("?")),
+    ("upper_bound", np.dtype("f4")),
+    ("lower_bound", np.dtype("f4")),
+]
+
+ChiralAtomConstraint = [
+    ("atom_idxs", np.dtype("4i4")),
+    ("is_reference", np.dtype("?")),
+    ("is_r", np.dtype("?")),
+]
+
+StereoBondConstraint = [
+    ("atom_idxs", np.dtype("4i4")),
+    ("is_reference", np.dtype("?")),
+    ("is_e", np.dtype("?")),
+]
+
+PlanarBondConstraint = [
+    ("atom_idxs", np.dtype("6i4")),
+]
+
+PlanarRing5Constraint = [
+    ("atom_idxs", np.dtype("5i4")),
+]
+
+PlanarRing6Constraint = [
+    ("atom_idxs", np.dtype("6i4")),
+]
+
+
+@dataclass(frozen=True)
+class ResidueConstraints(NumpySerializable):
+    """ResidueConstraints datatype."""
+
+    rdkit_bounds_constraints: np.ndarray
+    chiral_atom_constraints: np.ndarray
+    stereo_bond_constraints: np.ndarray
+    planar_bond_constraints: np.ndarray
+    planar_ring_5_constraints: np.ndarray
+    planar_ring_6_constraints: np.ndarray
+
+
+####################################################################################################
+# TARGET
+####################################################################################################
+
+
+@dataclass(frozen=True)
+class Target:
+    """Target datatype."""
+
+    record: Record
+    structure: Structure
+    sequences: Optional[dict[str, str]] = None
+    residue_constraints: Optional[ResidueConstraints] = None
+    templates: Optional[dict[str, StructureV2]] = None
+    extra_mols: Optional[dict[str, Mol]] = None
+
+
+@dataclass(frozen=True)
+class Manifest(JSONSerializable):
+    """Manifest datatype."""
+
+    records: list[Record]
+
+    @classmethod
+    def load(cls: "JSONSerializable", path: Path) -> "JSONSerializable":
+        """Load the object from a JSON file.
+
+        Parameters
+        ----------
+        path : Path
+            The path to the file.
+
+        Returns
+        -------
+        Serializable
+            The loaded object.
+
+        Raises
+        ------
+        TypeError
+            If the file is not a valid manifest file.
+
+        """
+        with path.open("r") as f:
+            data = json.load(f)
+            if isinstance(data, dict):
+                manifest = cls.from_dict(data)
+            elif isinstance(data, list):
+                records = [Record.from_dict(r) for r in data]
+                manifest = cls(records=records)
+            else:
+                msg = "Invalid manifest file."
+                raise TypeError(msg)
+
+        return manifest
+
+
+####################################################################################################
+# INPUT
+####################################################################################################
+
+
+@dataclass(frozen=True, slots=True)
+class Input:
+    """Input datatype."""
+
+    structure: Structure
+    msa: dict[str, MSA]
+    record: Optional[Record] = None
+    residue_constraints: Optional[ResidueConstraints] = None
+    templates: Optional[dict[str, StructureV2]] = None
+    extra_mols: Optional[dict[str, Mol]] = None
+
+
+####################################################################################################
+# TOKENS
+####################################################################################################
+
+Token = [
+    ("token_idx", np.dtype("i4")),
+    ("atom_idx", np.dtype("i4")),
+    ("atom_num", np.dtype("i4")),
+    ("res_idx", np.dtype("i4")),
+    ("res_type", np.dtype("i1")),
+    ("sym_id", np.dtype("i4")),
+    ("asym_id", np.dtype("i4")),
+    ("entity_id", np.dtype("i4")),
+    ("mol_type", np.dtype("i1")),
+    ("center_idx", np.dtype("i4")),
+    ("disto_idx", np.dtype("i4")),
+    ("center_coords", np.dtype("3f4")),
+    ("disto_coords", np.dtype("3f4")),
+    ("resolved_mask", np.dtype("?")),
+    ("disto_mask", np.dtype("?")),
+    ("cyclic_period", np.dtype("i4")),
+]
+
+TokenBond = [
+    ("token_1", np.dtype("i4")),
+    ("token_2", np.dtype("i4")),
+]
+
+
+TokenV2 = [
+    ("token_idx", np.dtype("i4")),
+    ("atom_idx", np.dtype("i4")),
+    ("atom_num", np.dtype("i4")),
+    ("res_idx", np.dtype("i4")),
+    ("res_type", np.dtype("i4")),
+    ("res_name", np.dtype("<U8")),
+    ("sym_id", np.dtype("i4")),
+    ("asym_id", np.dtype("i4")),
+    ("entity_id", np.dtype("i4")),
+    ("mol_type", np.dtype("i4")),  # the total bytes need to be divisible by 4
+    ("center_idx", np.dtype("i4")),
+    ("disto_idx", np.dtype("i4")),
+    ("center_coords", np.dtype("3f4")),
+    ("disto_coords", np.dtype("3f4")),
+    ("resolved_mask", np.dtype("?")),
+    ("disto_mask", np.dtype("?")),
+    ("modified", np.dtype("?")),
+    ("frame_rot", np.dtype("9f4")),
+    ("frame_t", np.dtype("3f4")),
+    ("frame_mask", np.dtype("i4")),
+    ("cyclic_period", np.dtype("i4")),
+    ("affinity_mask", np.dtype("?")),
+]
+
+TokenBondV2 = [
+    ("token_1", np.dtype("i4")),
+    ("token_2", np.dtype("i4")),
+    ("type", np.dtype("i1")),
+]
+
+
+@dataclass(frozen=True)
+class Tokenized:
+    """Tokenized datatype."""
+
+    tokens: np.ndarray
+    bonds: np.ndarray
+    structure: Structure
+    msa: dict[str, MSA]
+    record: Optional[Record] = None
+    residue_constraints: Optional[ResidueConstraints] = None
+    templates: Optional[dict[str, StructureV2]] = None
+    template_tokens: Optional[dict[str, np.ndarray]] = None
+    template_bonds: Optional[dict[str, np.ndarray]] = None
+    extra_mols: Optional[dict[str, Mol]] = None
diff --git a/forks/boltz/src/boltz/data/write/__init__.py b/forks/boltz/src/boltz/data/write/__init__.py
new file mode 100644
index 00000000..e69de29b
diff --git a/forks/boltz/src/boltz/data/write/mmcif.py b/forks/boltz/src/boltz/data/write/mmcif.py
new file mode 100644
index 00000000..cfd3a6e4
--- /dev/null
+++ b/forks/boltz/src/boltz/data/write/mmcif.py
@@ -0,0 +1,306 @@
+import io
+import re
+from collections.abc import Iterator
+from typing import Optional
+
+import ihm
+import modelcif
+from modelcif import Assembly, AsymUnit, Entity, System, dumper
+from modelcif.model import AbInitioModel, Atom, ModelGroup
+from rdkit import Chem
+from torch import Tensor
+
+from boltz.data import const
+from boltz.data.types import Structure
+
+
+def to_mmcif(
+    structure: Structure,
+    plddts: Optional[Tensor] = None,
+    boltz2: bool = False,
+) -> str:  # noqa: C901, PLR0915, PLR0912
+    """Write a structure into an MMCIF file.
+
+    Parameters
+    ----------
+    structure : Structure
+        The input structure
+
+    Returns
+    -------
+    str
+        the output MMCIF file
+
+    """
+    system = System()
+
+    # Load periodic table for element mapping
+    periodic_table = Chem.GetPeriodicTable()
+
+    # Map entities to chain_ids
+    entity_to_chains = {}
+    entity_to_moltype = {}
+
+    for chain in structure.chains:
+        entity_id = chain["entity_id"]
+        mol_type = chain["mol_type"]
+        entity_to_chains.setdefault(entity_id, []).append(chain)
+        entity_to_moltype[entity_id] = mol_type
+
+    # Map entities to sequences
+    sequences = {}
+    for entity in entity_to_chains:
+        # Get the first chain
+        chain = entity_to_chains[entity][0]
+
+        # Get the sequence
+        res_start = chain["res_idx"]
+        res_end = chain["res_idx"] + chain["res_num"]
+        residues = structure.residues[res_start:res_end]
+        sequence = [str(res["name"]) for res in residues]
+        sequences[entity] = sequence
+
+    # Create entity objects
+    lig_entity = None
+    entities_map = {}
+    for entity, sequence in sequences.items():
+        mol_type = entity_to_moltype[entity]
+
+        if mol_type == const.chain_type_ids["PROTEIN"]:
+            alphabet = ihm.LPeptideAlphabet()
+            chem_comp = lambda x: ihm.LPeptideChemComp(id=x, code=x, code_canonical="X")  # noqa: E731
+        elif mol_type == const.chain_type_ids["DNA"]:
+            alphabet = ihm.DNAAlphabet()
+            chem_comp = lambda x: ihm.DNAChemComp(id=x, code=x, code_canonical="N")  # noqa: E731
+        elif mol_type == const.chain_type_ids["RNA"]:
+            alphabet = ihm.RNAAlphabet()
+            chem_comp = lambda x: ihm.RNAChemComp(id=x, code=x, code_canonical="N")  # noqa: E731
+        elif len(sequence) > 1:
+            alphabet = {}
+            chem_comp = lambda x: ihm.SaccharideChemComp(id=x)  # noqa: E731
+        else:
+            alphabet = {}
+            chem_comp = lambda x: ihm.NonPolymerChemComp(id=x)  # noqa: E731
+
+        # Handle smiles
+        if len(sequence) == 1 and (sequence[0] == "LIG"):
+            if lig_entity is None:
+                seq = [chem_comp(sequence[0])]
+                lig_entity = Entity(seq)
+            model_e = lig_entity
+        else:
+            seq = [
+                alphabet[item] if item in alphabet else chem_comp(item)
+                for item in sequence
+            ]
+            model_e = Entity(seq)
+
+        for chain in entity_to_chains[entity]:
+            chain_idx = chain["asym_id"]
+            entities_map[chain_idx] = model_e
+
+    # We don't assume that symmetry is perfect, so we dump everything
+    # into the asymmetric unit, and produce just a single assembly
+    asym_unit_map = {}
+    for chain in structure.chains:
+        # Define the model assembly
+        chain_idx = chain["asym_id"]
+        chain_tag = str(chain["name"])
+        entity = entities_map[chain_idx]
+        if entity.type == "water":
+            asym = ihm.WaterAsymUnit(
+                entity,
+                1,
+                details="Model subunit %s" % chain_tag,
+                id=chain_tag,
+            )
+        else:
+            asym = AsymUnit(
+                entity,
+                details="Model subunit %s" % chain_tag,
+                id=chain_tag,
+            )
+        asym_unit_map[chain_idx] = asym
+    modeled_assembly = Assembly(asym_unit_map.values(), name="Modeled assembly")
+
+    class _LocalPLDDT(modelcif.qa_metric.Local, modelcif.qa_metric.PLDDT):
+        name = "pLDDT"
+        software = None
+        description = "Predicted lddt"
+
+    class _MyModel(AbInitioModel):
+        def get_atoms(self) -> Iterator[Atom]:
+            # Index into plddt tensor for current residue.
+            res_num = 0
+            # Tracks non-ligand plddt tensor indices,
+            # Initializing to -1 handles case where ligand is resnum 0
+            prev_polymer_resnum = -1
+            # Tracks ligand indices.
+            ligand_index_offset = 0
+
+            # Add all atom sites.
+            for chain in structure.chains:
+                # We rename the chains in alphabetical order
+                het = chain["mol_type"] == const.chain_type_ids["NONPOLYMER"]
+                chain_idx = chain["asym_id"]
+                res_start = chain["res_idx"]
+                res_end = chain["res_idx"] + chain["res_num"]
+
+                record_type = (
+                    "ATOM"
+                    if chain["mol_type"] != const.chain_type_ids["NONPOLYMER"]
+                    else "HETATM"
+                )
+
+                residues = structure.residues[res_start:res_end]
+                for residue in residues:
+                    res_name = str(residue["name"])
+                    atom_start = residue["atom_idx"]
+                    atom_end = residue["atom_idx"] + residue["atom_num"]
+                    atoms = structure.atoms[atom_start:atom_end]
+                    atom_coords = atoms["coords"]
+                    for i, atom in enumerate(atoms):
+                        # This should not happen on predictions, but just in case.
+                        if not atom["is_present"]:
+                            continue
+
+                        if boltz2:
+                            atom_name = str(atom["name"])
+                            atom_key = re.sub(r"\d", "", atom_name)
+                            if atom_key in const.ambiguous_atoms:
+                                if isinstance(const.ambiguous_atoms[atom_key], str):
+                                    element = const.ambiguous_atoms[atom_key]
+                                elif res_name in const.ambiguous_atoms[atom_key]:
+                                    element = const.ambiguous_atoms[atom_key][res_name]
+                                else:
+                                    element = const.ambiguous_atoms[atom_key]["*"]
+                            else:
+                                element = atom_key[0]
+                        else:
+                            atom_name = atom["name"]
+                            atom_name = [chr(c + 32) for c in atom_name if c != 0]
+                            atom_name = "".join(atom_name)
+                            element = periodic_table.GetElementSymbol(
+                                atom["element"].item()
+                            )
+                        element = element.upper()
+                        residue_index = residue["res_idx"] + 1
+                        pos = atom_coords[i]
+
+                        if record_type != "HETATM":
+                            # The current residue plddt is stored at the res_num index unless a ligand has previouly been added.
+                            biso = (
+                                100.00
+                                if plddts is None
+                                else round(
+                                    plddts[res_num + ligand_index_offset].item() * 100,
+                                    3,
+                                )
+                            )
+                            prev_polymer_resnum = res_num
+                        else:
+                            # If not a polymer resnum, we can get index into plddts by adding offset relative to previous polymer resnum.
+                            ligand_index_offset += 1
+                            biso = (
+                                100.00
+                                if plddts is None
+                                else round(
+                                    plddts[
+                                        prev_polymer_resnum + ligand_index_offset
+                                    ].item()
+                                    * 100,
+                                    3,
+                                )
+                            )
+
+                        yield Atom(
+                            asym_unit=asym_unit_map[chain_idx],
+                            type_symbol=element,
+                            seq_id=residue_index,
+                            atom_id=atom_name,
+                            x=f"{pos[0]:.5f}",
+                            y=f"{pos[1]:.5f}",
+                            z=f"{pos[2]:.5f}",
+                            het=het,
+                            biso=biso,
+                            occupancy=1,
+                        )
+
+                    if record_type != "HETATM":
+                        res_num += 1
+
+        def add_plddt(self, plddts):
+            res_num = 0
+            prev_polymer_resnum = (
+                -1
+            )  # -1 handles case where ligand is the first residue
+            ligand_index_offset = 0
+            for chain in structure.chains:
+                chain_idx = chain["asym_id"]
+                res_start = chain["res_idx"]
+                res_end = chain["res_idx"] + chain["res_num"]
+                residues = structure.residues[res_start:res_end]
+
+                record_type = (
+                    "ATOM"
+                    if chain["mol_type"] != const.chain_type_ids["NONPOLYMER"]
+                    else "HETATM"
+                )
+
+                # We rename the chains in alphabetical order
+                for residue in residues:
+                    residue_idx = residue["res_idx"] + 1
+
+                    atom_start = residue["atom_idx"]
+                    atom_end = residue["atom_idx"] + residue["atom_num"]
+
+                    if record_type != "HETATM":
+                        # The current residue plddt is stored at the res_num index unless a ligand has previouly been added.
+                        self.qa_metrics.append(
+                            _LocalPLDDT(
+                                asym_unit_map[chain_idx].residue(residue_idx),
+                                round(
+                                    plddts[res_num + ligand_index_offset].item() * 100,
+                                    3,
+                                ),
+                            )
+                        )
+                        prev_polymer_resnum = res_num
+                    else:
+                        # If not a polymer resnum, we can get index into plddts by adding offset relative to previous polymer resnum.
+                        self.qa_metrics.append(
+                            _LocalPLDDT(
+                                asym_unit_map[chain_idx].residue(residue_idx),
+                                round(
+                                    plddts[
+                                        prev_polymer_resnum
+                                        + ligand_index_offset
+                                        + 1 : prev_polymer_resnum
+                                        + ligand_index_offset
+                                        + residue["atom_num"]
+                                        + 1
+                                    ]
+                                    .mean()
+                                    .item()
+                                    * 100,
+                                    2,
+                                ),
+                            )
+                        )
+                        ligand_index_offset += residue["atom_num"]
+
+                    if record_type != "HETATM":
+                        res_num += 1
+
+    # Add the model and modeling protocol to the file and write them out:
+    model = _MyModel(assembly=modeled_assembly, name="Model")
+    if plddts is not None:
+        model.add_plddt(plddts)
+
+    model_group = ModelGroup([model], name="All models")
+    system.model_groups.append(model_group)
+    ihm.dumper.set_line_wrap(False)
+
+    fh = io.StringIO()
+    dumper.write(fh, [system])
+    return fh.getvalue()
diff --git a/forks/boltz/src/boltz/data/write/pdb.py b/forks/boltz/src/boltz/data/write/pdb.py
new file mode 100644
index 00000000..d9240adc
--- /dev/null
+++ b/forks/boltz/src/boltz/data/write/pdb.py
@@ -0,0 +1,172 @@
+import re
+from typing import Optional
+
+from rdkit import Chem
+from torch import Tensor
+
+from boltz.data import const
+from boltz.data.types import Structure
+
+
+def to_pdb(
+    structure: Structure,
+    plddts: Optional[Tensor] = None,
+    boltz2: bool = False,
+) -> str:  # noqa: PLR0915
+    """Write a structure into a PDB file.
+
+    Parameters
+    ----------
+    structure : Structure
+        The input structure
+
+    Returns
+    -------
+    str
+        the output PDB file
+
+    """
+    pdb_lines = []
+
+    atom_index = 1
+    atom_reindex_ter = []
+
+    # Load periodic table for element mapping
+    periodic_table = Chem.GetPeriodicTable()
+
+    # Index into plddt tensor for current residue.
+    res_num = 0
+    # Tracks non-ligand plddt tensor indices,
+    # Initializing to -1 handles case where ligand is resnum 0
+    prev_polymer_resnum = -1
+    # Tracks ligand indices.
+    ligand_index_offset = 0
+
+    # Add all atom sites.
+    for chain in structure.chains:
+        # We rename the chains in alphabetical order
+        chain_idx = chain["asym_id"]
+        chain_tag = chain["name"]
+
+        res_start = chain["res_idx"]
+        res_end = chain["res_idx"] + chain["res_num"]
+
+        residues = structure.residues[res_start:res_end]
+        for residue in residues:
+            res_name = str(residue["name"])
+            atom_start = residue["atom_idx"]
+            atom_end = residue["atom_idx"] + residue["atom_num"]
+            atoms = structure.atoms[atom_start:atom_end]
+            atom_coords = atoms["coords"]
+            for i, atom in enumerate(atoms):
+                # This should not happen on predictions, but just in case.
+                if not atom["is_present"]:
+                    continue
+
+                record_type = (
+                    "ATOM"
+                    if chain["mol_type"] != const.chain_type_ids["NONPOLYMER"]
+                    else "HETATM"
+                )
+                name = str(atom["name"])
+                if boltz2:
+                    atom_name = str(atom["name"])
+                    atom_key = re.sub(r"\d", "", atom_name)
+                    if atom_key in const.ambiguous_atoms:
+                        if isinstance(const.ambiguous_atoms[atom_key], str):
+                            element = const.ambiguous_atoms[atom_key]
+                        elif res_name in const.ambiguous_atoms[atom_key]:
+                            element = const.ambiguous_atoms[atom_key][res_name]
+                        else:
+                            element = const.ambiguous_atoms[atom_key]["*"]
+                    else:
+                        element = atom_key[0]
+                else:
+                    atom_name = atom["name"]
+                    atom_name = [chr(c + 32) for c in atom_name if c != 0]
+                    atom_name = "".join(atom_name)
+                    name = atom_name
+                    element = periodic_table.GetElementSymbol(atom["element"].item())
+
+                name = name if len(name) == 4 else f" {name}"  # noqa: PLR2004
+                alt_loc = ""
+                insertion_code = ""
+                occupancy = 1.00
+                element = element.upper()
+                charge = ""
+                residue_index = residue["res_idx"] + 1
+                pos = atom_coords[i]
+                res_name_3 = (
+                    "LIG" if record_type == "HETATM" else str(residue["name"][:3])
+                )
+
+                if record_type != "HETATM":
+                    # The current residue plddt is stored at the res_num index unless a ligand has previouly been added.
+                    b_factor = (
+                        100.00
+                        if plddts is None
+                        else round(
+                            plddts[res_num + ligand_index_offset].item() * 100, 2
+                        )
+                    )
+                    prev_polymer_resnum = res_num
+                else:
+                    # If not a polymer resnum, we can get index into plddts by adding offset relative to previous polymer resnum.
+                    ligand_index_offset += 1
+                    b_factor = (
+                        100.00
+                        if plddts is None
+                        else round(
+                            plddts[prev_polymer_resnum + ligand_index_offset].item()
+                            * 100,
+                            2,
+                        )
+                    )
+
+                # PDB is a columnar format, every space matters here!
+                atom_line = (
+                    f"{record_type:<6}{atom_index:>5} {name:<4}{alt_loc:>1}"
+                    f"{res_name_3:>3} {chain_tag:>1}"
+                    f"{residue_index:>4}{insertion_code:>1}   "
+                    f"{pos[0]:>8.3f}{pos[1]:>8.3f}{pos[2]:>8.3f}"
+                    f"{occupancy:>6.2f}{b_factor:>6.2f}          "
+                    f"{element:>2}{charge:>2}"
+                )
+                pdb_lines.append(atom_line)
+                atom_reindex_ter.append(atom_index)
+                atom_index += 1
+
+            if record_type != "HETATM":
+                res_num += 1
+
+        should_terminate = chain_idx < (len(structure.chains) - 1)
+        if should_terminate:
+            # Close the chain.
+            chain_end = "TER"
+            chain_termination_line = (
+                f"{chain_end:<6}{atom_index:>5}      "
+                f"{res_name_3:>3} "
+                f"{chain_tag:>1}{residue_index:>4}"
+            )
+            pdb_lines.append(chain_termination_line)
+            atom_index += 1
+
+    # Dump CONECT records.
+    all_bonds = list(structure.bonds)
+    if hasattr(structure, "connections"):
+        all_bonds.extend(list(structure.connections))
+
+    for bond in all_bonds:
+        atom1 = structure.atoms[bond["atom_1"]]
+        atom2 = structure.atoms[bond["atom_2"]]
+        if not atom1["is_present"] or not atom2["is_present"]:
+            continue
+        atom1_idx = atom_reindex_ter[bond["atom_1"]]
+        atom2_idx = atom_reindex_ter[bond["atom_2"]]
+        conect_line = f"CONECT{atom1_idx:>5}{atom2_idx:>5}"
+        pdb_lines.append(conect_line)
+
+    pdb_lines.append("END")
+    pdb_lines.append("")
+    pdb_lines = [line.ljust(80) for line in pdb_lines]
+    return "\n".join(pdb_lines)
diff --git a/forks/boltz/src/boltz/data/write/utils.py b/forks/boltz/src/boltz/data/write/utils.py
new file mode 100644
index 00000000..617d8710
--- /dev/null
+++ b/forks/boltz/src/boltz/data/write/utils.py
@@ -0,0 +1,23 @@
+import string
+from collections.abc import Iterator
+
+
+def generate_tags() -> Iterator[str]:
+    """Generate chain tags.
+
+    Yields
+    ------
+    str
+        The next chain tag
+
+    """
+    for i in range(1, 4):
+        for j in range(len(string.ascii_uppercase) ** i):
+            tag = ""
+            for k in range(i):
+                tag += string.ascii_uppercase[
+                    j
+                    // (len(string.ascii_uppercase) ** k)
+                    % len(string.ascii_uppercase)
+                ]
+            yield tag
diff --git a/forks/boltz/src/boltz/data/write/writer.py b/forks/boltz/src/boltz/data/write/writer.py
new file mode 100644
index 00000000..984be2ae
--- /dev/null
+++ b/forks/boltz/src/boltz/data/write/writer.py
@@ -0,0 +1,343 @@
+import json
+from dataclasses import asdict, replace
+from pathlib import Path
+from typing import Literal
+
+import numpy as np
+import torch
+from pytorch_lightning import LightningModule, Trainer
+from pytorch_lightning.callbacks import BasePredictionWriter
+from torch import Tensor
+
+from boltz.data.types import Coords, Interface, Record, Structure, StructureV2
+from boltz.data.write.mmcif import to_mmcif
+from boltz.data.write.pdb import to_pdb
+
+
+class BoltzWriter(BasePredictionWriter):
+    """Custom writer for predictions."""
+
+    def __init__(
+        self,
+        data_dir: str,
+        output_dir: str,
+        output_format: Literal["pdb", "mmcif"] = "mmcif",
+        boltz2: bool = False,
+        write_embeddings: bool = False,
+    ) -> None:
+        """Initialize the writer.
+
+        Parameters
+        ----------
+        output_dir : str
+            The directory to save the predictions.
+
+        """
+        super().__init__(write_interval="batch")
+        if output_format not in ["pdb", "mmcif"]:
+            msg = f"Invalid output format: {output_format}"
+            raise ValueError(msg)
+
+        self.data_dir = Path(data_dir)
+        self.output_dir = Path(output_dir)
+        self.output_format = output_format
+        self.failed = 0
+        self.boltz2 = boltz2
+        self.output_dir.mkdir(parents=True, exist_ok=True)
+        self.write_embeddings = write_embeddings
+
+    def write_on_batch_end(
+        self,
+        trainer: Trainer,  # noqa: ARG002
+        pl_module: LightningModule,  # noqa: ARG002
+        prediction: dict[str, Tensor],
+        batch_indices: list[int],  # noqa: ARG002
+        batch: dict[str, Tensor],
+        batch_idx: int,  # noqa: ARG002
+        dataloader_idx: int,  # noqa: ARG002
+    ) -> None:
+        """Write the predictions to disk."""
+        if prediction["exception"]:
+            self.failed += 1
+            return
+
+        # Get the records
+        records: list[Record] = batch["record"]
+
+        # Get the predictions
+        coords = prediction["coords"]
+        coords = coords.unsqueeze(0)
+
+        pad_masks = prediction["masks"]
+
+        # Get ranking
+        if "confidence_score" in prediction:
+            argsort = torch.argsort(prediction["confidence_score"], descending=True)
+            idx_to_rank = {idx.item(): rank for rank, idx in enumerate(argsort)}
+        # Handles cases where confidence summary is False
+        else:
+            idx_to_rank = {i: i for i in range(len(records))}
+
+        # Iterate over the records
+        for record, coord, pad_mask in zip(records, coords, pad_masks):
+            # Load the structure
+            path = self.data_dir / f"{record.id}.npz"
+            if self.boltz2:
+                structure: StructureV2 = StructureV2.load(path)
+            else:
+                structure: Structure = Structure.load(path)
+
+            # Compute chain map with masked removed, to be used later
+            chain_map = {}
+            for i, mask in enumerate(structure.mask):
+                if mask:
+                    chain_map[len(chain_map)] = i
+
+            # Remove masked chains completely
+            structure = structure.remove_invalid_chains()
+
+            for model_idx in range(coord.shape[0]):
+                # Get model coord
+                model_coord = coord[model_idx]
+                # Unpad
+                coord_unpad = model_coord[pad_mask.bool()]
+                coord_unpad = coord_unpad.cpu().numpy()
+
+                # New atom table
+                atoms = structure.atoms
+                atoms["coords"] = coord_unpad
+                atoms["is_present"] = True
+                if self.boltz2:
+                    structure: StructureV2
+                    coord_unpad = [(x,) for x in coord_unpad]
+                    coord_unpad = np.array(coord_unpad, dtype=Coords)
+
+                # Mew residue table
+                residues = structure.residues
+                residues["is_present"] = True
+
+                # Update the structure
+                interfaces = np.array([], dtype=Interface)
+                if self.boltz2:
+                    new_structure: StructureV2 = replace(
+                        structure,
+                        atoms=atoms,
+                        residues=residues,
+                        interfaces=interfaces,
+                        coords=coord_unpad,
+                    )
+                else:
+                    new_structure: Structure = replace(
+                        structure,
+                        atoms=atoms,
+                        residues=residues,
+                        interfaces=interfaces,
+                    )
+
+                # Update chain info
+                chain_info = []
+                for chain in new_structure.chains:
+                    old_chain_idx = chain_map[chain["asym_id"]]
+                    old_chain_info = record.chains[old_chain_idx]
+                    new_chain_info = replace(
+                        old_chain_info,
+                        chain_id=int(chain["asym_id"]),
+                        valid=True,
+                    )
+                    chain_info.append(new_chain_info)
+
+                # Save the structure
+                struct_dir = self.output_dir / record.id
+                struct_dir.mkdir(exist_ok=True)
+
+                # Get plddt's
+                plddts = None
+                if "plddt" in prediction:
+                    plddts = prediction["plddt"][model_idx]
+
+                # Create path name
+                outname = f"{record.id}_model_{idx_to_rank[model_idx]}"
+
+                # Save the structure
+                if self.output_format == "pdb":
+                    path = struct_dir / f"{outname}.pdb"
+                    with path.open("w") as f:
+                        f.write(
+                            to_pdb(new_structure, plddts=plddts, boltz2=self.boltz2)
+                        )
+                elif self.output_format == "mmcif":
+                    path = struct_dir / f"{outname}.cif"
+                    with path.open("w") as f:
+                        f.write(
+                            to_mmcif(new_structure, plddts=plddts, boltz2=self.boltz2)
+                        )
+                else:
+                    path = struct_dir / f"{outname}.npz"
+                    np.savez_compressed(path, **asdict(new_structure))
+
+                if self.boltz2 and record.affinity and idx_to_rank[model_idx] == 0:
+                    path = struct_dir / f"pre_affinity_{record.id}.npz"
+                    np.savez_compressed(path, **asdict(new_structure))
+                    np.array(atoms["coords"][:, None], dtype=Coords)
+
+                # Save confidence summary
+                if "plddt" in prediction:
+                    path = (
+                        struct_dir
+                        / f"confidence_{record.id}_model_{idx_to_rank[model_idx]}.json"
+                    )
+                    confidence_summary_dict = {}
+                    for key in [
+                        "confidence_score",
+                        "ptm",
+                        "iptm",
+                        "ligand_iptm",
+                        "protein_iptm",
+                        "complex_plddt",
+                        "complex_iplddt",
+                        "complex_pde",
+                        "complex_ipde",
+                    ]:
+                        confidence_summary_dict[key] = prediction[key][model_idx].item()
+                    confidence_summary_dict["chains_ptm"] = {
+                        idx: prediction["pair_chains_iptm"][idx][idx][model_idx].item()
+                        for idx in prediction["pair_chains_iptm"]
+                    }
+                    confidence_summary_dict["pair_chains_iptm"] = {
+                        idx1: {
+                            idx2: prediction["pair_chains_iptm"][idx1][idx2][
+                                model_idx
+                            ].item()
+                            for idx2 in prediction["pair_chains_iptm"][idx1]
+                        }
+                        for idx1 in prediction["pair_chains_iptm"]
+                    }
+                    with path.open("w") as f:
+                        f.write(
+                            json.dumps(
+                                confidence_summary_dict,
+                                indent=4,
+                            )
+                        )
+
+                    # Save plddt
+                    plddt = prediction["plddt"][model_idx]
+                    path = (
+                        struct_dir
+                        / f"plddt_{record.id}_model_{idx_to_rank[model_idx]}.npz"
+                    )
+                    np.savez_compressed(path, plddt=plddt.cpu().numpy())
+
+                # Save pae
+                if "pae" in prediction:
+                    pae = prediction["pae"][model_idx]
+                    path = (
+                        struct_dir
+                        / f"pae_{record.id}_model_{idx_to_rank[model_idx]}.npz"
+                    )
+                    np.savez_compressed(path, pae=pae.cpu().numpy())
+
+                # Save pde
+                if "pde" in prediction:
+                    pde = prediction["pde"][model_idx]
+                    path = (
+                        struct_dir
+                        / f"pde_{record.id}_model_{idx_to_rank[model_idx]}.npz"
+                    )
+                    np.savez_compressed(path, pde=pde.cpu().numpy())
+                
+            # Save embeddings
+            if self.write_embeddings and "s" in prediction and "z" in prediction:
+                s = prediction["s"].cpu().numpy()
+                z = prediction["z"].cpu().numpy()
+
+                path = (
+                    struct_dir
+                    / f"embeddings_{record.id}.npz"
+                )
+                np.savez_compressed(path, s=s, z=z)
+
+    def on_predict_epoch_end(
+        self,
+        trainer: Trainer,  # noqa: ARG002
+        pl_module: LightningModule,  # noqa: ARG002
+    ) -> None:
+        """Print the number of failed examples."""
+        # Print number of failed examples
+        print(f"Number of failed examples: {self.failed}")  # noqa: T201
+
+
+class BoltzAffinityWriter(BasePredictionWriter):
+    """Custom writer for predictions."""
+
+    def __init__(
+        self,
+        data_dir: str,
+        output_dir: str,
+    ) -> None:
+        """Initialize the writer.
+
+        Parameters
+        ----------
+        output_dir : str
+            The directory to save the predictions.
+
+        """
+        super().__init__(write_interval="batch")
+        self.failed = 0
+        self.data_dir = Path(data_dir)
+        self.output_dir = Path(output_dir)
+        self.output_dir.mkdir(parents=True, exist_ok=True)
+
+    def write_on_batch_end(
+        self,
+        trainer: Trainer,  # noqa: ARG002
+        pl_module: LightningModule,  # noqa: ARG002
+        prediction: dict[str, Tensor],
+        batch_indices: list[int],  # noqa: ARG002
+        batch: dict[str, Tensor],
+        batch_idx: int,  # noqa: ARG002
+        dataloader_idx: int,  # noqa: ARG002
+    ) -> None:
+        """Write the predictions to disk."""
+        if prediction["exception"]:
+            self.failed += 1
+            return
+        # Dump affinity summary
+        affinity_summary = {}
+        pred_affinity_value = prediction["affinity_pred_value"]
+        pred_affinity_probability = prediction["affinity_probability_binary"]
+        affinity_summary = {
+            "affinity_pred_value": pred_affinity_value.item(),
+            "affinity_probability_binary": pred_affinity_probability.item(),
+        }
+        if "affinity_pred_value1" in prediction:
+            pred_affinity_value1 = prediction["affinity_pred_value1"]
+            pred_affinity_probability1 = prediction["affinity_probability_binary1"]
+            pred_affinity_value2 = prediction["affinity_pred_value2"]
+            pred_affinity_probability2 = prediction["affinity_probability_binary2"]
+            affinity_summary["affinity_pred_value1"] = pred_affinity_value1.item()
+            affinity_summary["affinity_probability_binary1"] = (
+                pred_affinity_probability1.item()
+            )
+            affinity_summary["affinity_pred_value2"] = pred_affinity_value2.item()
+            affinity_summary["affinity_probability_binary2"] = (
+                pred_affinity_probability2.item()
+            )
+
+        # Save the affinity summary
+        struct_dir = self.output_dir / batch["record"][0].id
+        struct_dir.mkdir(exist_ok=True)
+        path = struct_dir / f"affinity_{batch['record'][0].id}.json"
+
+        with path.open("w") as f:
+            f.write(json.dumps(affinity_summary, indent=4))
+
+    def on_predict_epoch_end(
+        self,
+        trainer: Trainer,  # noqa: ARG002
+        pl_module: LightningModule,  # noqa: ARG002
+    ) -> None:
+        """Print the number of failed examples."""
+        # Print number of failed examples
+        print(f"Number of failed examples: {self.failed}")  # noqa: T201
diff --git a/forks/boltz/src/boltz/main.py b/forks/boltz/src/boltz/main.py
new file mode 100644
index 00000000..4a3750fe
--- /dev/null
+++ b/forks/boltz/src/boltz/main.py
@@ -0,0 +1,1414 @@
+import multiprocessing
+import os
+import pickle
+import platform
+import tarfile
+import urllib.request
+import warnings
+from dataclasses import asdict, dataclass
+from functools import partial
+from multiprocessing import Pool
+from pathlib import Path
+from typing import Literal, Optional
+
+import click
+import torch
+from pytorch_lightning import Trainer, seed_everything
+from pytorch_lightning.strategies import DDPStrategy
+from pytorch_lightning.utilities import rank_zero_only
+from rdkit import Chem
+from tqdm import tqdm
+
+from boltz.data import const
+from boltz.data.module.inference import BoltzInferenceDataModule
+from boltz.data.module.inferencev2 import Boltz2InferenceDataModule
+from boltz.data.mol import load_canonicals
+from boltz.data.msa.mmseqs2 import run_mmseqs2
+from boltz.data.parse.a3m import parse_a3m
+from boltz.data.parse.csv import parse_csv
+from boltz.data.parse.fasta import parse_fasta
+from boltz.data.parse.yaml import parse_yaml
+from boltz.data.types import MSA, Manifest, Record
+from boltz.data.write.writer import BoltzAffinityWriter, BoltzWriter
+from boltz.model.models.boltz1 import Boltz1
+from boltz.model.models.boltz2 import Boltz2
+
+CCD_URL = "https://huggingface.co/boltz-community/boltz-1/resolve/main/ccd.pkl"
+MOL_URL = "https://huggingface.co/boltz-community/boltz-2/resolve/main/mols.tar"
+
+BOLTZ1_URL_WITH_FALLBACK = [
+    "https://model-gateway.boltz.bio/boltz1_conf.ckpt",
+    "https://huggingface.co/boltz-community/boltz-1/resolve/main/boltz1_conf.ckpt",
+]
+
+BOLTZ2_URL_WITH_FALLBACK = [
+    "https://model-gateway.boltz.bio/boltz2_conf.ckpt",
+    "https://huggingface.co/boltz-community/boltz-2/resolve/main/boltz2_conf.ckpt",
+]
+
+BOLTZ2_AFFINITY_URL_WITH_FALLBACK = [
+    "https://model-gateway.boltz.bio/boltz2_aff.ckpt",
+    "https://huggingface.co/boltz-community/boltz-2/resolve/main/boltz2_aff.ckpt",
+]
+
+
+@dataclass
+class BoltzProcessedInput:
+    """Processed input data."""
+
+    manifest: Manifest
+    targets_dir: Path
+    msa_dir: Path
+    constraints_dir: Optional[Path] = None
+    template_dir: Optional[Path] = None
+    extra_mols_dir: Optional[Path] = None
+
+
+@dataclass
+class PairformerArgs:
+    """Pairformer arguments."""
+
+    num_blocks: int = 48
+    num_heads: int = 16
+    dropout: float = 0.0
+    activation_checkpointing: bool = False
+    offload_to_cpu: bool = False
+    v2: bool = False
+
+
+@dataclass
+class PairformerArgsV2:
+    """Pairformer arguments."""
+
+    num_blocks: int = 64
+    num_heads: int = 16
+    dropout: float = 0.0
+    activation_checkpointing: bool = False
+    offload_to_cpu: bool = False
+    v2: bool = True
+
+
+@dataclass
+class MSAModuleArgs:
+    """MSA module arguments."""
+
+    msa_s: int = 64
+    msa_blocks: int = 4
+    msa_dropout: float = 0.0
+    z_dropout: float = 0.0
+    use_paired_feature: bool = True
+    pairwise_head_width: int = 32
+    pairwise_num_heads: int = 4
+    activation_checkpointing: bool = False
+    offload_to_cpu: bool = False
+    subsample_msa: bool = False
+    num_subsampled_msa: int = 1024
+
+
+@dataclass
+class BoltzDiffusionParams:
+    """Diffusion process parameters."""
+
+    gamma_0: float = 0.605
+    gamma_min: float = 1.107
+    noise_scale: float = 0.901
+    rho: float = 8
+    step_scale: float = 1.638
+    sigma_min: float = 0.0004
+    sigma_max: float = 160.0
+    sigma_data: float = 16.0
+    P_mean: float = -1.2
+    P_std: float = 1.5
+    coordinate_augmentation: bool = True
+    alignment_reverse_diff: bool = True
+    synchronize_sigmas: bool = True
+    use_inference_model_cache: bool = True
+
+
+@dataclass
+class Boltz2DiffusionParams:
+    """Diffusion process parameters."""
+
+    gamma_0: float = 0.8
+    gamma_min: float = 1.0
+    noise_scale: float = 1.003
+    rho: float = 7
+    step_scale: float = 1.5
+    sigma_min: float = 0.0001
+    sigma_max: float = 160.0
+    sigma_data: float = 16.0
+    P_mean: float = -1.2
+    P_std: float = 1.5
+    coordinate_augmentation: bool = True
+    alignment_reverse_diff: bool = True
+    synchronize_sigmas: bool = True
+
+
+@dataclass
+class BoltzSteeringParams:
+    """Steering parameters."""
+
+    fk_steering: bool = False
+    num_particles: int = 3
+    fk_lambda: float = 4.0
+    fk_resampling_interval: int = 3
+    physical_guidance_update: bool = False
+    contact_guidance_update: bool = True
+    num_gd_steps: int = 20
+
+
+@rank_zero_only
+def download_boltz1(cache: Path) -> None:
+    """Download all the required data.
+
+    Parameters
+    ----------
+    cache : Path
+        The cache directory.
+
+    """
+    # Download CCD
+    ccd = cache / "ccd.pkl"
+    if not ccd.exists():
+        click.echo(
+            f"Downloading the CCD dictionary to {ccd}. You may "
+            "change the cache directory with the --cache flag."
+        )
+        urllib.request.urlretrieve(CCD_URL, str(ccd))  # noqa: S310
+
+    # Download model
+    model = cache / "boltz1_conf.ckpt"
+    if not model.exists():
+        click.echo(
+            f"Downloading the model weights to {model}. You may "
+            "change the cache directory with the --cache flag."
+        )
+        for i, url in enumerate(BOLTZ1_URL_WITH_FALLBACK):
+            try:
+                urllib.request.urlretrieve(url, str(model))  # noqa: S310
+                break
+            except Exception as e:  # noqa: BLE001
+                if i == len(BOLTZ1_URL_WITH_FALLBACK) - 1:
+                    msg = f"Failed to download model from all URLs. Last error: {e}"
+                    raise RuntimeError(msg) from e
+                continue
+
+
+@rank_zero_only
+def download_boltz2(cache: Path) -> None:
+    """Download all the required data.
+
+    Parameters
+    ----------
+    cache : Path
+        The cache directory.
+
+    """
+    # Download CCD
+    mols = cache / "mols"
+    tar_mols = cache / "mols.tar"
+    if not tar_mols.exists():
+        click.echo(
+            f"Downloading the CCD data to {tar_mols}. "
+            "This may take a bit of time. You may change the cache directory "
+            "with the --cache flag."
+        )
+        urllib.request.urlretrieve(MOL_URL, str(tar_mols))  # noqa: S310
+    if not mols.exists():
+        click.echo(
+            f"Extracting the CCD data to {mols}. "
+            "This may take a bit of time. You may change the cache directory "
+            "with the --cache flag."
+        )
+        with tarfile.open(str(tar_mols), "r") as tar:
+            tar.extractall(cache)  # noqa: S202
+
+    # Download model
+    model = cache / "boltz2_conf.ckpt"
+    if not model.exists():
+        click.echo(
+            f"Downloading the Boltz-2 weights to {model}. You may "
+            "change the cache directory with the --cache flag."
+        )
+        for i, url in enumerate(BOLTZ2_URL_WITH_FALLBACK):
+            try:
+                urllib.request.urlretrieve(url, str(model))  # noqa: S310
+                break
+            except Exception as e:  # noqa: BLE001
+                if i == len(BOLTZ2_URL_WITH_FALLBACK) - 1:
+                    msg = f"Failed to download model from all URLs. Last error: {e}"
+                    raise RuntimeError(msg) from e
+                continue
+
+    # Download affinity model
+    affinity_model = cache / "boltz2_aff.ckpt"
+    if not affinity_model.exists():
+        click.echo(
+            f"Downloading the Boltz-2 affinity weights to {affinity_model}. You may "
+            "change the cache directory with the --cache flag."
+        )
+        for i, url in enumerate(BOLTZ2_AFFINITY_URL_WITH_FALLBACK):
+            try:
+                urllib.request.urlretrieve(url, str(affinity_model))  # noqa: S310
+                break
+            except Exception as e:  # noqa: BLE001
+                if i == len(BOLTZ2_AFFINITY_URL_WITH_FALLBACK) - 1:
+                    msg = f"Failed to download model from all URLs. Last error: {e}"
+                    raise RuntimeError(msg) from e
+                continue
+
+
+def get_cache_path() -> str:
+    """Determine the cache path, prioritising the BOLTZ_CACHE environment variable.
+
+    Returns
+    -------
+    str: Path
+        Path to use for boltz cache location.
+
+    """
+    env_cache = os.environ.get("BOLTZ_CACHE")
+    if env_cache:
+        resolved_cache = Path(env_cache).expanduser().resolve()
+        if not resolved_cache.is_absolute():
+            msg = f"BOLTZ_CACHE must be an absolute path, got: {env_cache}"
+            raise ValueError(msg)
+        return str(resolved_cache)
+
+    return str(Path("~/.boltz").expanduser())
+
+
+def check_inputs(data: Path) -> list[Path]:
+    """Check the input data and output directory.
+
+    Parameters
+    ----------
+    data : Path
+        The input data.
+
+    Returns
+    -------
+    list[Path]
+        The list of input data.
+
+    """
+    click.echo("Checking input data.")
+
+    # Check if data is a directory
+    if data.is_dir():
+        data: list[Path] = list(data.glob("*"))
+
+        # Filter out non .fasta or .yaml files, raise
+        # an error on directory and other file types
+        for d in data:
+            if d.is_dir():
+                msg = f"Found directory {d} instead of .fasta or .yaml."
+                raise RuntimeError(msg)
+            if d.suffix.lower() not in (".fa", ".fas", ".fasta", ".yml", ".yaml"):
+                msg = (
+                    f"Unable to parse filetype {d.suffix}, "
+                    "please provide a .fasta or .yaml file."
+                )
+                raise RuntimeError(msg)
+    else:
+        data = [data]
+
+    return data
+
+
+def filter_inputs_structure(
+    manifest: Manifest,
+    outdir: Path,
+    override: bool = False,
+) -> Manifest:
+    """Filter the manifest to only include missing predictions.
+
+    Parameters
+    ----------
+    manifest : Manifest
+        The manifest of the input data.
+    outdir : Path
+        The output directory.
+    override: bool
+        Whether to override existing predictions.
+
+    Returns
+    -------
+    Manifest
+        The manifest of the filtered input data.
+
+    """
+    # Check if existing predictions are found (only top-level prediction folders)
+    pred_dir = outdir / "predictions"
+    if pred_dir.exists():
+        existing = {d.name for d in pred_dir.iterdir() if d.is_dir()}
+    else:
+        existing = set()
+
+    # Remove them from the input data
+    if existing and not override:
+        manifest = Manifest([r for r in manifest.records if r.id not in existing])
+        msg = (
+            f"Found some existing predictions ({len(existing)}), "
+            f"skipping and running only the missing ones, "
+            "if any. If you wish to override these existing "
+            "predictions, please set the --override flag."
+        )
+        click.echo(msg)
+    elif existing and override:
+        msg = f"Found {len(existing)} existing predictions, will override."
+        click.echo(msg)
+
+    return manifest
+
+
+def filter_inputs_affinity(
+    manifest: Manifest,
+    outdir: Path,
+    override: bool = False,
+) -> Manifest:
+    """Check the input data and output directory for affinity.
+
+    Parameters
+    ----------
+    manifest : Manifest
+        The manifest.
+    outdir : Path
+        The output directory.
+    override: bool
+        Whether to override existing predictions.
+
+    Returns
+    -------
+    Manifest
+        The manifest of the filtered input data.
+
+    """
+    click.echo("Checking input data for affinity.")
+
+    # Get all affinity targets
+    existing = {
+        r.id
+        for r in manifest.records
+        if r.affinity
+        and (outdir / "predictions" / r.id / f"affinity_{r.id}.json").exists()
+    }
+
+    # Remove them from the input data
+    if existing and not override:
+        manifest = Manifest([r for r in manifest.records if r.id not in existing])
+        num_skipped = len(existing)
+        msg = (
+            f"Found some existing affinity predictions ({num_skipped}), "
+            f"skipping and running only the missing ones, "
+            "if any. If you wish to override these existing "
+            "affinity predictions, please set the --override flag."
+        )
+        click.echo(msg)
+    elif existing and override:
+        msg = "Found existing affinity predictions, will override."
+        click.echo(msg)
+
+    return manifest
+
+
+def compute_msa(
+    data: dict[str, str],
+    target_id: str,
+    msa_dir: Path,
+    msa_server_url: str,
+    msa_pairing_strategy: str,
+    msa_server_username: Optional[str] = None,
+    msa_server_password: Optional[str] = None,
+    api_key_header: Optional[str] = None,
+    api_key_value: Optional[str] = None,
+) -> None:
+    """Compute the MSA for the input data.
+
+    Parameters
+    ----------
+    data : dict[str, str]
+        The input protein sequences.
+    target_id : str
+        The target id.
+    msa_dir : Path
+        The msa directory.
+    msa_server_url : str
+        The MSA server URL.
+    msa_pairing_strategy : str
+        The MSA pairing strategy.
+    msa_server_username : str, optional
+        Username for basic authentication with MSA server.
+    msa_server_password : str, optional
+        Password for basic authentication with MSA server.
+    api_key_header : str, optional
+        Custom header key for API key authentication (default: X-API-Key).
+    api_key_value : str, optional
+        Custom header value for API key authentication (overrides --api_key if set).
+
+    """
+    click.echo(f"Calling MSA server for target {target_id} with {len(data)} sequences")
+    click.echo(f"MSA server URL: {msa_server_url}")
+    click.echo(f"MSA pairing strategy: {msa_pairing_strategy}")
+    
+    # Construct auth headers if API key header/value is provided
+    auth_headers = None
+    if api_key_value:
+        key = api_key_header if api_key_header else "X-API-Key"
+        value = api_key_value
+        auth_headers = {
+            "Content-Type": "application/json",
+            key: value
+        }
+        click.echo(f"Using API key authentication for MSA server (header: {key})")
+    elif msa_server_username and msa_server_password:
+        click.echo("Using basic authentication for MSA server")
+    else:
+        click.echo("No authentication provided for MSA server")
+    
+    if len(data) > 1:
+        paired_msas = run_mmseqs2(
+            list(data.values()),
+            msa_dir / f"{target_id}_paired_tmp",
+            use_env=True,
+            use_pairing=True,
+            host_url=msa_server_url,
+            pairing_strategy=msa_pairing_strategy,
+            msa_server_username=msa_server_username,
+            msa_server_password=msa_server_password,
+            auth_headers=auth_headers,
+        )
+    else:
+        paired_msas = [""] * len(data)
+
+    unpaired_msa = run_mmseqs2(
+        list(data.values()),
+        msa_dir / f"{target_id}_unpaired_tmp",
+        use_env=True,
+        use_pairing=False,
+        host_url=msa_server_url,
+        pairing_strategy=msa_pairing_strategy,
+        msa_server_username=msa_server_username,
+        msa_server_password=msa_server_password,
+        auth_headers=auth_headers,
+    )
+
+    for idx, name in enumerate(data):
+        # Get paired sequences
+        paired = paired_msas[idx].strip().splitlines()
+        paired = paired[1::2]  # ignore headers
+        paired = paired[: const.max_paired_seqs]
+
+        # Set key per row and remove empty sequences
+        keys = [idx for idx, s in enumerate(paired) if s != "-" * len(s)]
+        paired = [s for s in paired if s != "-" * len(s)]
+
+        # Combine paired-unpaired sequences
+        unpaired = unpaired_msa[idx].strip().splitlines()
+        unpaired = unpaired[1::2]
+        unpaired = unpaired[: (const.max_msa_seqs - len(paired))]
+        if paired:
+            unpaired = unpaired[1:]  # ignore query is already present
+
+        # Combine
+        seqs = paired + unpaired
+        keys = keys + [-1] * len(unpaired)
+
+        # Dump MSA
+        csv_str = ["key,sequence"] + [f"{key},{seq}" for key, seq in zip(keys, seqs)]
+
+        msa_path = msa_dir / f"{name}.csv"
+        with msa_path.open("w") as f:
+            f.write("\n".join(csv_str))
+
+
+def process_input(  # noqa: C901, PLR0912, PLR0915, D103
+    path: Path,
+    ccd: dict,
+    msa_dir: Path,
+    mol_dir: Path,
+    boltz2: bool,
+    use_msa_server: bool,
+    msa_server_url: str,
+    msa_pairing_strategy: str,
+    msa_server_username: Optional[str],
+    msa_server_password: Optional[str],
+    api_key_header: Optional[str],
+    api_key_value: Optional[str],
+    max_msa_seqs: int,
+    processed_msa_dir: Path,
+    processed_constraints_dir: Path,
+    processed_templates_dir: Path,
+    processed_mols_dir: Path,
+    structure_dir: Path,
+    records_dir: Path,
+) -> None:
+    try:
+        # Parse data
+        if path.suffix.lower() in (".fa", ".fas", ".fasta"):
+            target = parse_fasta(path, ccd, mol_dir, boltz2)
+        elif path.suffix.lower() in (".yml", ".yaml"):
+            target = parse_yaml(path, ccd, mol_dir, boltz2)
+        elif path.is_dir():
+            msg = f"Found directory {path} instead of .fasta or .yaml, skipping."
+            raise RuntimeError(msg)  # noqa: TRY301
+        else:
+            msg = (
+                f"Unable to parse filetype {path.suffix}, "
+                "please provide a .fasta or .yaml file."
+            )
+            raise RuntimeError(msg)  # noqa: TRY301
+
+        # Get target id
+        target_id = target.record.id
+
+        # Get all MSA ids and decide whether to generate MSA
+        to_generate = {}
+        prot_id = const.chain_type_ids["PROTEIN"]
+        for chain in target.record.chains:
+            # Add to generate list, assigning entity id
+            if (chain.mol_type == prot_id) and (chain.msa_id == 0):
+                entity_id = chain.entity_id
+                msa_id = f"{target_id}_{entity_id}"
+                to_generate[msa_id] = target.sequences[entity_id]
+                chain.msa_id = msa_dir / f"{msa_id}.csv"
+
+            # We do not support msa generation for non-protein chains
+            elif chain.msa_id == 0:
+                chain.msa_id = -1
+
+        # Generate MSA
+        if to_generate and not use_msa_server:
+            msg = "Missing MSA's in input and --use_msa_server flag not set."
+            raise RuntimeError(msg)  # noqa: TRY301
+
+        if to_generate:
+            msg = f"Generating MSA for {path} with {len(to_generate)} protein entities."
+            click.echo(msg)
+            compute_msa(
+                data=to_generate,
+                target_id=target_id,
+                msa_dir=msa_dir,
+                msa_server_url=msa_server_url,
+                msa_pairing_strategy=msa_pairing_strategy,
+                msa_server_username=msa_server_username,
+                msa_server_password=msa_server_password,
+                api_key_header=api_key_header,
+                api_key_value=api_key_value,
+            )
+
+        # Parse MSA data
+        msas = sorted({c.msa_id for c in target.record.chains if c.msa_id != -1})
+        msa_id_map = {}
+        for msa_idx, msa_id in enumerate(msas):
+            # Check that raw MSA exists
+            msa_path = Path(msa_id)
+            if not msa_path.exists():
+                msg = f"MSA file {msa_path} not found."
+                raise FileNotFoundError(msg)  # noqa: TRY301
+
+            # Dump processed MSA
+            processed = processed_msa_dir / f"{target_id}_{msa_idx}.npz"
+            msa_id_map[msa_id] = f"{target_id}_{msa_idx}"
+            if not processed.exists():
+                # Parse A3M
+                if msa_path.suffix == ".a3m":
+                    msa: MSA = parse_a3m(
+                        msa_path,
+                        taxonomy=None,
+                        max_seqs=max_msa_seqs,
+                    )
+                elif msa_path.suffix == ".csv":
+                    msa: MSA = parse_csv(msa_path, max_seqs=max_msa_seqs)
+                else:
+                    msg = f"MSA file {msa_path} not supported, only a3m or csv."
+                    raise RuntimeError(msg)  # noqa: TRY301
+
+                msa.dump(processed)
+
+        # Modify records to point to processed MSA
+        for c in target.record.chains:
+            if (c.msa_id != -1) and (c.msa_id in msa_id_map):
+                c.msa_id = msa_id_map[c.msa_id]
+
+        # Dump templates
+        for template_id, template in target.templates.items():
+            name = f"{target.record.id}_{template_id}.npz"
+            template_path = processed_templates_dir / name
+            template.dump(template_path)
+
+        # Dump constraints
+        constraints_path = processed_constraints_dir / f"{target.record.id}.npz"
+        target.residue_constraints.dump(constraints_path)
+
+        # Dump extra molecules
+        Chem.SetDefaultPickleProperties(Chem.PropertyPickleOptions.AllProps)
+        with (processed_mols_dir / f"{target.record.id}.pkl").open("wb") as f:
+            pickle.dump(target.extra_mols, f)
+
+        # Dump structure
+        struct_path = structure_dir / f"{target.record.id}.npz"
+        target.structure.dump(struct_path)
+
+        # Dump record
+        record_path = records_dir / f"{target.record.id}.json"
+        target.record.dump(record_path)
+
+    except Exception as e:  # noqa: BLE001
+        import traceback
+
+        traceback.print_exc()
+        print(f"Failed to process {path}. Skipping. Error: {e}.")  # noqa: T201
+
+
+@rank_zero_only
+def process_inputs(
+    data: list[Path],
+    out_dir: Path,
+    ccd_path: Path,
+    mol_dir: Path,
+    msa_server_url: str,
+    msa_pairing_strategy: str,
+    max_msa_seqs: int = 8192,
+    use_msa_server: bool = False,
+    msa_server_username: Optional[str] = None,
+    msa_server_password: Optional[str] = None,
+    api_key_header: Optional[str] = None,
+    api_key_value: Optional[str] = None,
+    boltz2: bool = False,
+    preprocessing_threads: int = 1,
+) -> Manifest:
+    """Process the input data and output directory.
+
+    Parameters
+    ----------
+    data : list[Path]
+        The input data.
+    out_dir : Path
+        The output directory.
+    ccd_path : Path
+        The path to the CCD dictionary.
+    max_msa_seqs : int, optional
+        Max number of MSA sequences, by default 8192.
+    use_msa_server : bool, optional
+        Whether to use the MMSeqs2 server for MSA generation, by default False.
+    msa_server_username : str, optional
+        Username for basic authentication with MSA server, by default None.
+    msa_server_password : str, optional
+        Password for basic authentication with MSA server, by default None.
+    api_key_header : str, optional
+        Custom header key for API key authentication (default: X-API-Key).
+    api_key_value : str, optional
+        Custom header value for API key authentication (overrides --api_key if set).
+    boltz2: bool, optional
+        Whether to use Boltz2, by default False.
+    preprocessing_threads: int, optional
+        The number of threads to use for preprocessing, by default 1.
+
+    Returns
+    -------
+    Manifest
+        The manifest of the processed input data.
+
+    """
+    # Validate mutually exclusive authentication methods
+    has_basic_auth = msa_server_username and msa_server_password
+    has_api_key = api_key_value is not None
+    
+    if has_basic_auth and has_api_key:
+        raise ValueError(
+            "Cannot use both basic authentication (--msa_server_username/--msa_server_password) "
+            "and API key authentication (--api_key_header/--api_key_value). Please use only one authentication method."
+        )
+
+    # Check if records exist at output path
+    records_dir = out_dir / "processed" / "records"
+    if records_dir.exists():
+        # Load existing records
+        existing = [Record.load(p) for p in records_dir.glob("*.json")]
+        processed_ids = {record.id for record in existing}
+
+        # Filter to missing only
+        data = [d for d in data if d.stem not in processed_ids]
+
+        # Nothing to do, update the manifest and return
+        if data:
+            click.echo(
+                f"Found {len(existing)} existing processed inputs, skipping them."
+            )
+        else:
+            click.echo("All inputs are already processed.")
+            updated_manifest = Manifest(existing)
+            updated_manifest.dump(out_dir / "processed" / "manifest.json")
+
+    # Create output directories
+    msa_dir = out_dir / "msa"
+    records_dir = out_dir / "processed" / "records"
+    structure_dir = out_dir / "processed" / "structures"
+    processed_msa_dir = out_dir / "processed" / "msa"
+    processed_constraints_dir = out_dir / "processed" / "constraints"
+    processed_templates_dir = out_dir / "processed" / "templates"
+    processed_mols_dir = out_dir / "processed" / "mols"
+    predictions_dir = out_dir / "predictions"
+
+    out_dir.mkdir(parents=True, exist_ok=True)
+    msa_dir.mkdir(parents=True, exist_ok=True)
+    records_dir.mkdir(parents=True, exist_ok=True)
+    structure_dir.mkdir(parents=True, exist_ok=True)
+    processed_msa_dir.mkdir(parents=True, exist_ok=True)
+    processed_constraints_dir.mkdir(parents=True, exist_ok=True)
+    processed_templates_dir.mkdir(parents=True, exist_ok=True)
+    processed_mols_dir.mkdir(parents=True, exist_ok=True)
+    predictions_dir.mkdir(parents=True, exist_ok=True)
+
+    # Load CCD
+    if boltz2:
+        ccd = load_canonicals(mol_dir)
+    else:
+        with ccd_path.open("rb") as file:
+            ccd = pickle.load(file)  # noqa: S301
+
+    # Create partial function
+    process_input_partial = partial(
+        process_input,
+        ccd=ccd,
+        msa_dir=msa_dir,
+        mol_dir=mol_dir,
+        boltz2=boltz2,
+        use_msa_server=use_msa_server,
+        msa_server_url=msa_server_url,
+        msa_pairing_strategy=msa_pairing_strategy,
+        msa_server_username=msa_server_username,
+        msa_server_password=msa_server_password,
+        api_key_header=api_key_header,
+        api_key_value=api_key_value,
+        max_msa_seqs=max_msa_seqs,
+        processed_msa_dir=processed_msa_dir,
+        processed_constraints_dir=processed_constraints_dir,
+        processed_templates_dir=processed_templates_dir,
+        processed_mols_dir=processed_mols_dir,
+        structure_dir=structure_dir,
+        records_dir=records_dir,
+    )
+
+    # Parse input data
+    preprocessing_threads = min(preprocessing_threads, len(data))
+    click.echo(f"Processing {len(data)} inputs with {preprocessing_threads} threads.")
+
+    if preprocessing_threads > 1 and len(data) > 1:
+        with Pool(preprocessing_threads) as pool:
+            list(tqdm(pool.imap(process_input_partial, data), total=len(data)))
+    else:
+        for path in tqdm(data):
+            process_input_partial(path)
+
+    # Load all records and write manifest
+    records = [Record.load(p) for p in records_dir.glob("*.json")]
+    manifest = Manifest(records)
+    manifest.dump(out_dir / "processed" / "manifest.json")
+
+
+@click.group()
+def cli() -> None:
+    """Boltz."""
+    return
+
+
+@cli.command()
+@click.argument("data", type=click.Path(exists=True))
+@click.option(
+    "--out_dir",
+    type=click.Path(exists=False),
+    help="The path where to save the predictions.",
+    default="./",
+)
+@click.option(
+    "--cache",
+    type=click.Path(exists=False),
+    help=(
+        "The directory where to download the data and model. "
+        "Default is ~/.boltz, or $BOLTZ_CACHE if set."
+    ),
+    default=get_cache_path,
+)
+@click.option(
+    "--checkpoint",
+    type=click.Path(exists=True),
+    help="An optional checkpoint, will use the provided Boltz-1 model by default.",
+    default=None,
+)
+@click.option(
+    "--devices",
+    type=int,
+    help="The number of devices to use for prediction. Default is 1.",
+    default=1,
+)
+@click.option(
+    "--accelerator",
+    type=click.Choice(["gpu", "cpu", "tpu"]),
+    help="The accelerator to use for prediction. Default is gpu.",
+    default="gpu",
+)
+@click.option(
+    "--recycling_steps",
+    type=int,
+    help="The number of recycling steps to use for prediction. Default is 3.",
+    default=3,
+)
+@click.option(
+    "--sampling_steps",
+    type=int,
+    help="The number of sampling steps to use for prediction. Default is 200.",
+    default=200,
+)
+@click.option(
+    "--diffusion_samples",
+    type=int,
+    help="The number of diffusion samples to use for prediction. Default is 1.",
+    default=1,
+)
+@click.option(
+    "--max_parallel_samples",
+    type=int,
+    help="The maximum number of samples to predict in parallel. Default is None.",
+    default=5,
+)
+@click.option(
+    "--step_scale",
+    type=float,
+    help=(
+        "The step size is related to the temperature at "
+        "which the diffusion process samples the distribution. "
+        "The lower the higher the diversity among samples "
+        "(recommended between 1 and 2). "
+        "Default is 1.638 for Boltz-1 and 1.5 for Boltz-2. "
+        "If not provided, the default step size will be used."
+    ),
+    default=None,
+)
+@click.option(
+    "--write_full_pae",
+    type=bool,
+    is_flag=True,
+    help="Whether to dump the pae into a npz file. Default is True.",
+)
+@click.option(
+    "--write_full_pde",
+    type=bool,
+    is_flag=True,
+    help="Whether to dump the pde into a npz file. Default is False.",
+)
+@click.option(
+    "--output_format",
+    type=click.Choice(["pdb", "mmcif"]),
+    help="The output format to use for the predictions. Default is mmcif.",
+    default="mmcif",
+)
+@click.option(
+    "--num_workers",
+    type=int,
+    help="The number of dataloader workers to use for prediction. Default is 2.",
+    default=2,
+)
+@click.option(
+    "--override",
+    is_flag=True,
+    help="Whether to override existing found predictions. Default is False.",
+)
+@click.option(
+    "--seed",
+    type=int,
+    help="Seed to use for random number generator. Default is None (no seeding).",
+    default=None,
+)
+@click.option(
+    "--use_msa_server",
+    is_flag=True,
+    help="Whether to use the MMSeqs2 server for MSA generation. Default is False.",
+)
+@click.option(
+    "--msa_server_url",
+    type=str,
+    help="MSA server url. Used only if --use_msa_server is set. ",
+    default="https://api.colabfold.com",
+)
+@click.option(
+    "--msa_pairing_strategy",
+    type=str,
+    help=(
+        "Pairing strategy to use. Used only if --use_msa_server is set. "
+        "Options are 'greedy' and 'complete'"
+    ),
+    default="greedy",
+)
+@click.option(
+    "--msa_server_username",
+    type=str,
+    help="MSA server username for basic auth. Used only if --use_msa_server is set. Can also be set via BOLTZ_MSA_USERNAME environment variable.",
+    default=None,
+)
+@click.option(
+    "--msa_server_password",
+    type=str,
+    help="MSA server password for basic auth. Used only if --use_msa_server is set. Can also be set via BOLTZ_MSA_PASSWORD environment variable.",
+    default=None,
+)
+@click.option(
+    "--api_key_header",
+    type=str,
+    help="Custom header key for API key authentication (default: X-API-Key).",
+    default=None,
+)
+@click.option(
+    "--api_key_value",
+    type=str,
+    help="Custom header value for API key authentication.",
+    default=None,
+)
+@click.option(
+    "--use_potentials",
+    is_flag=True,
+    help="Whether to use potentials for steering. Default is False.",
+)
+@click.option(
+    "--model",
+    default="boltz2",
+    type=click.Choice(["boltz1", "boltz2"]),
+    help="The model to use for prediction. Default is boltz2.",
+)
+@click.option(
+    "--method",
+    type=str,
+    help="The method to use for prediction. Default is None.",
+    default=None,
+)
+@click.option(
+    "--preprocessing-threads",
+    type=int,
+    help="The number of threads to use for preprocessing. Default is 1.",
+    default=multiprocessing.cpu_count(),
+)
+@click.option(
+    "--affinity_mw_correction",
+    is_flag=True,
+    type=bool,
+    help="Whether to add the Molecular Weight correction to the affinity value head.",
+)
+@click.option(
+    "--sampling_steps_affinity",
+    type=int,
+    help="The number of sampling steps to use for affinity prediction. Default is 200.",
+    default=200,
+)
+@click.option(
+    "--diffusion_samples_affinity",
+    type=int,
+    help="The number of diffusion samples to use for affinity prediction. Default is 5.",
+    default=5,
+)
+@click.option(
+    "--affinity_checkpoint",
+    type=click.Path(exists=True),
+    help="An optional checkpoint, will use the provided Boltz-1 model by default.",
+    default=None,
+)
+@click.option(
+    "--max_msa_seqs",
+    type=int,
+    help="The maximum number of MSA sequences to use for prediction. Default is 8192.",
+    default=8192,
+)
+@click.option(
+    "--subsample_msa",
+    is_flag=True,
+    help="Whether to subsample the MSA. Default is True.",
+)
+@click.option(
+    "--num_subsampled_msa",
+    type=int,
+    help="The number of MSA sequences to subsample. Default is 1024.",
+    default=1024,
+)
+@click.option(
+    "--no_kernels",
+    is_flag=True,
+    help="Whether to disable the kernels. Default False",
+)
+@click.option(
+    "--write_embeddings",
+    is_flag=True,
+    help=" to dump the s and z embeddings into a npz file. Default is False.",
+)
+def predict(  # noqa: C901, PLR0915, PLR0912
+    data: str,
+    out_dir: str,
+    cache: str = "~/.boltz",
+    checkpoint: Optional[str] = None,
+    affinity_checkpoint: Optional[str] = None,
+    devices: int = 1,
+    accelerator: str = "gpu",
+    recycling_steps: int = 3,
+    sampling_steps: int = 200,
+    diffusion_samples: int = 1,
+    sampling_steps_affinity: int = 200,
+    diffusion_samples_affinity: int = 3,
+    max_parallel_samples: Optional[int] = None,
+    step_scale: Optional[float] = None,
+    write_full_pae: bool = False,
+    write_full_pde: bool = False,
+    output_format: Literal["pdb", "mmcif"] = "mmcif",
+    num_workers: int = 2,
+    override: bool = False,
+    seed: Optional[int] = None,
+    use_msa_server: bool = False,
+    msa_server_url: str = "https://api.colabfold.com",
+    msa_pairing_strategy: str = "greedy",
+    msa_server_username: Optional[str] = None,
+    msa_server_password: Optional[str] = None,
+    api_key_header: Optional[str] = None,
+    api_key_value: Optional[str] = None,
+    use_potentials: bool = False,
+    model: Literal["boltz1", "boltz2"] = "boltz2",
+    method: Optional[str] = None,
+    affinity_mw_correction: Optional[bool] = False,
+    preprocessing_threads: int = 1,
+    max_msa_seqs: int = 8192,
+    subsample_msa: bool = True,
+    num_subsampled_msa: int = 1024,
+    no_kernels: bool = False,
+    write_embeddings: bool = False,
+) -> None:
+    """Run predictions with Boltz."""
+    # If cpu, write a friendly warning
+    if accelerator == "cpu":
+        msg = "Running on CPU, this will be slow. Consider using a GPU."
+        click.echo(msg)
+
+    # Supress some lightning warnings
+    warnings.filterwarnings(
+        "ignore", ".*that has Tensor Cores. To properly utilize them.*"
+    )
+
+    # Set no grad
+    torch.set_grad_enabled(False)
+
+    # Ignore matmul precision warning
+    torch.set_float32_matmul_precision("highest")
+
+    # Set rdkit pickle logic
+    Chem.SetDefaultPickleProperties(Chem.PropertyPickleOptions.AllProps)
+
+    # Set seed if desired
+    if seed is not None:
+        seed_everything(seed)
+
+    for key in ["CUEQ_DEFAULT_CONFIG", "CUEQ_DISABLE_AOT_TUNING"]:
+        # Disable kernel tuning by default,
+        # but do not modify envvar if already set by caller
+        os.environ[key] = os.environ.get(key, "1")
+
+    # Set cache path
+    cache = Path(cache).expanduser()
+    cache.mkdir(parents=True, exist_ok=True)
+
+    # Get MSA server credentials from environment variables if not provided
+    if use_msa_server:
+        if msa_server_username is None:
+            msa_server_username = os.environ.get("BOLTZ_MSA_USERNAME")
+        if msa_server_password is None:
+            msa_server_password = os.environ.get("BOLTZ_MSA_PASSWORD")
+        if api_key_value is None:
+            api_key_value = os.environ.get("MSA_API_KEY_VALUE")
+        
+        click.echo(f"MSA server enabled: {msa_server_url}")
+        if api_key_value:
+            click.echo("MSA server authentication: using API key header")
+        elif msa_server_username and msa_server_password:
+            click.echo("MSA server authentication: using basic auth")
+        else:
+            click.echo("MSA server authentication: no credentials provided")
+
+    # Create output directories
+    data = Path(data).expanduser()
+    out_dir = Path(out_dir).expanduser()
+    out_dir = out_dir / f"boltz_results_{data.stem}"
+    out_dir.mkdir(parents=True, exist_ok=True)
+
+    # Download necessary data and model
+    if model == "boltz1":
+        download_boltz1(cache)
+    elif model == "boltz2":
+        download_boltz2(cache)
+    else:
+        msg = f"Model {model} not supported. Supported: boltz1, boltz2."
+        raise ValueError(f"Model {model} not supported.")
+
+    # Validate inputs
+    data = check_inputs(data)
+
+    # Check method
+    if method is not None:
+        if model == "boltz1":
+            msg = "Method conditioning is not supported for Boltz-1."
+            raise ValueError(msg)
+        if method.lower() not in const.method_types_ids:
+            method_names = list(const.method_types_ids.keys())
+            msg = f"Method {method} not supported. Supported: {method_names}"
+            raise ValueError(msg)
+
+    # Process inputs
+    ccd_path = cache / "ccd.pkl"
+    mol_dir = cache / "mols"
+    process_inputs(
+        data=data,
+        out_dir=out_dir,
+        ccd_path=ccd_path,
+        mol_dir=mol_dir,
+        use_msa_server=use_msa_server,
+        msa_server_url=msa_server_url,
+        msa_pairing_strategy=msa_pairing_strategy,
+        msa_server_username=msa_server_username,
+        msa_server_password=msa_server_password,
+        api_key_header=api_key_header,
+        api_key_value=api_key_value,
+        boltz2=model == "boltz2",
+        preprocessing_threads=preprocessing_threads,
+        max_msa_seqs=max_msa_seqs,
+    )
+
+    # Load manifest
+    manifest = Manifest.load(out_dir / "processed" / "manifest.json")
+
+    # Filter out existing predictions
+    filtered_manifest = filter_inputs_structure(
+        manifest=manifest,
+        outdir=out_dir,
+        override=override,
+    )
+
+    # Load processed data
+    processed_dir = out_dir / "processed"
+    processed = BoltzProcessedInput(
+        manifest=filtered_manifest,
+        targets_dir=processed_dir / "structures",
+        msa_dir=processed_dir / "msa",
+        constraints_dir=(
+            (processed_dir / "constraints")
+            if (processed_dir / "constraints").exists()
+            else None
+        ),
+        template_dir=(
+            (processed_dir / "templates")
+            if (processed_dir / "templates").exists()
+            else None
+        ),
+        extra_mols_dir=(
+            (processed_dir / "mols") if (processed_dir / "mols").exists() else None
+        ),
+    )
+
+    # Set up trainer
+    strategy = "auto"
+    if (isinstance(devices, int) and devices > 1) or (
+        isinstance(devices, list) and len(devices) > 1
+    ):
+        start_method = "fork" if platform.system() != "win32" and platform.system() != "Windows" else "spawn"
+        strategy = DDPStrategy(start_method=start_method)
+        if len(filtered_manifest.records) < devices:
+            msg = (
+                "Number of requested devices is greater "
+                "than the number of predictions, taking the minimum."
+            )
+            click.echo(msg)
+            if isinstance(devices, list):
+                devices = devices[: max(1, len(filtered_manifest.records))]
+            else:
+                devices = max(1, min(len(filtered_manifest.records), devices))
+
+    # Set up model parameters
+    if model == "boltz2":
+        diffusion_params = Boltz2DiffusionParams()
+        step_scale = 1.5 if step_scale is None else step_scale
+        diffusion_params.step_scale = step_scale
+        pairformer_args = PairformerArgsV2()
+    else:
+        diffusion_params = BoltzDiffusionParams()
+        step_scale = 1.638 if step_scale is None else step_scale
+        diffusion_params.step_scale = step_scale
+        pairformer_args = PairformerArgs()
+
+    msa_args = MSAModuleArgs(
+        subsample_msa=subsample_msa,
+        num_subsampled_msa=num_subsampled_msa,
+        use_paired_feature=model == "boltz2",
+    )
+
+    # Create prediction writer
+    pred_writer = BoltzWriter(
+        data_dir=processed.targets_dir,
+        output_dir=out_dir / "predictions",
+        output_format=output_format,
+        boltz2=model == "boltz2",
+        write_embeddings=write_embeddings,
+    )
+
+    # Set up trainer
+    trainer = Trainer(
+        default_root_dir=out_dir,
+        strategy=strategy,
+        callbacks=[pred_writer],
+        accelerator=accelerator,
+        devices=devices,
+        precision=32 if model == "boltz1" else "bf16-mixed",
+    )
+
+    if filtered_manifest.records:
+        msg = f"Running structure prediction for {len(filtered_manifest.records)} input"
+        msg += "s." if len(filtered_manifest.records) > 1 else "."
+        click.echo(msg)
+
+        # Create data module
+        if model == "boltz2":
+            data_module = Boltz2InferenceDataModule(
+                manifest=processed.manifest,
+                target_dir=processed.targets_dir,
+                msa_dir=processed.msa_dir,
+                mol_dir=mol_dir,
+                num_workers=num_workers,
+                constraints_dir=processed.constraints_dir,
+                template_dir=processed.template_dir,
+                extra_mols_dir=processed.extra_mols_dir,
+                override_method=method,
+            )
+        else:
+            data_module = BoltzInferenceDataModule(
+                manifest=processed.manifest,
+                target_dir=processed.targets_dir,
+                msa_dir=processed.msa_dir,
+                num_workers=num_workers,
+                constraints_dir=processed.constraints_dir,
+            )
+
+        # Load model
+        if checkpoint is None:
+            if model == "boltz2":
+                checkpoint = cache / "boltz2_conf.ckpt"
+            else:
+                checkpoint = cache / "boltz1_conf.ckpt"
+
+        predict_args = {
+            "recycling_steps": recycling_steps,
+            "sampling_steps": sampling_steps,
+            "diffusion_samples": diffusion_samples,
+            "max_parallel_samples": max_parallel_samples,
+            "write_confidence_summary": True,
+            "write_full_pae": write_full_pae,
+            "write_full_pde": write_full_pde,
+        }
+
+        steering_args = BoltzSteeringParams()
+        steering_args.fk_steering = use_potentials
+        steering_args.physical_guidance_update = use_potentials
+
+        model_cls = Boltz2 if model == "boltz2" else Boltz1
+        model_module = model_cls.load_from_checkpoint(
+            checkpoint,
+            strict=True,
+            predict_args=predict_args,
+            map_location="cpu",
+            diffusion_process_args=asdict(diffusion_params),
+            ema=False,
+            use_kernels=not no_kernels,
+            pairformer_args=asdict(pairformer_args),
+            msa_args=asdict(msa_args),
+            steering_args=asdict(steering_args),
+        )
+        model_module.eval()
+
+        # Compute structure predictions
+        trainer.predict(
+            model_module,
+            datamodule=data_module,
+            return_predictions=False,
+        )
+
+    # Check if affinity predictions are needed
+    if any(r.affinity for r in manifest.records):
+        # Print header
+        click.echo("\nPredicting property: affinity\n")
+
+        # Validate inputs
+        manifest_filtered = filter_inputs_affinity(
+            manifest=manifest,
+            outdir=out_dir,
+            override=override,
+        )
+        if not manifest_filtered.records:
+            click.echo("Found existing affinity predictions for all inputs, skipping.")
+            return
+
+        msg = f"Running affinity prediction for {len(manifest_filtered.records)} input"
+        msg += "s." if len(manifest_filtered.records) > 1 else "."
+        click.echo(msg)
+
+        pred_writer = BoltzAffinityWriter(
+            data_dir=processed.targets_dir,
+            output_dir=out_dir / "predictions",
+        )
+
+        data_module = Boltz2InferenceDataModule(
+            manifest=manifest_filtered,
+            target_dir=out_dir / "predictions",
+            msa_dir=processed.msa_dir,
+            mol_dir=mol_dir,
+            num_workers=num_workers,
+            constraints_dir=processed.constraints_dir,
+            template_dir=processed.template_dir,
+            extra_mols_dir=processed.extra_mols_dir,
+            override_method="other",
+            affinity=True,
+        )
+
+        predict_affinity_args = {
+            "recycling_steps": 5,
+            "sampling_steps": sampling_steps_affinity,
+            "diffusion_samples": diffusion_samples_affinity,
+            "max_parallel_samples": 1,
+            "write_confidence_summary": False,
+            "write_full_pae": False,
+            "write_full_pde": False,
+        }
+
+        # Load affinity model
+        if affinity_checkpoint is None:
+            affinity_checkpoint = cache / "boltz2_aff.ckpt"
+
+        steering_args = BoltzSteeringParams()
+        steering_args.fk_steering = False
+        steering_args.physical_guidance_update = False
+        steering_args.contact_guidance_update = False
+        
+        model_module = Boltz2.load_from_checkpoint(
+            affinity_checkpoint,
+            strict=True,
+            predict_args=predict_affinity_args,
+            map_location="cpu",
+            diffusion_process_args=asdict(diffusion_params),
+            ema=False,
+            pairformer_args=asdict(pairformer_args),
+            msa_args=asdict(msa_args),
+            steering_args=asdict(steering_args),
+            affinity_mw_correction=affinity_mw_correction,
+        )
+        model_module.eval()
+
+        trainer.callbacks[0] = pred_writer
+        trainer.predict(
+            model_module,
+            datamodule=data_module,
+            return_predictions=False,
+        )
+
+
+if __name__ == "__main__":
+    cli()
diff --git a/forks/boltz/src/boltz/model/__init__.py b/forks/boltz/src/boltz/model/__init__.py
new file mode 100644
index 00000000..e69de29b
diff --git a/forks/boltz/src/boltz/model/layers/__init__.py b/forks/boltz/src/boltz/model/layers/__init__.py
new file mode 100644
index 00000000..e69de29b
diff --git a/forks/boltz/src/boltz/model/layers/attention.py b/forks/boltz/src/boltz/model/layers/attention.py
new file mode 100644
index 00000000..2eb0cd3b
--- /dev/null
+++ b/forks/boltz/src/boltz/model/layers/attention.py
@@ -0,0 +1,132 @@
+import torch
+from einops.layers.torch import Rearrange
+from torch import Tensor, nn
+
+import boltz.model.layers.initialize as init
+
+
+class AttentionPairBias(nn.Module):
+    """Attention pair bias layer."""
+
+    def __init__(
+        self,
+        c_s: int,
+        c_z: int,
+        num_heads: int,
+        inf: float = 1e6,
+        initial_norm: bool = True,
+    ) -> None:
+        """Initialize the attention pair bias layer.
+
+        Parameters
+        ----------
+        c_s : int
+            The input sequence dimension.
+        c_z : int
+            The input pairwise dimension.
+        num_heads : int
+            The number of heads.
+        inf : float, optional
+            The inf value, by default 1e6
+        initial_norm: bool, optional
+            Whether to apply layer norm to the input, by default True
+
+        """
+        super().__init__()
+
+        assert c_s % num_heads == 0
+
+        self.c_s = c_s
+        self.num_heads = num_heads
+        self.head_dim = c_s // num_heads
+        self.inf = inf
+
+        self.initial_norm = initial_norm
+        if self.initial_norm:
+            self.norm_s = nn.LayerNorm(c_s)
+
+        self.proj_q = nn.Linear(c_s, c_s)
+        self.proj_k = nn.Linear(c_s, c_s, bias=False)
+        self.proj_v = nn.Linear(c_s, c_s, bias=False)
+        self.proj_g = nn.Linear(c_s, c_s, bias=False)
+
+        self.proj_z = nn.Sequential(
+            nn.LayerNorm(c_z),
+            nn.Linear(c_z, num_heads, bias=False),
+            Rearrange("b ... h -> b h ..."),
+        )
+
+        self.proj_o = nn.Linear(c_s, c_s, bias=False)
+        init.final_init_(self.proj_o.weight)
+
+    def forward(
+        self,
+        s: Tensor,
+        z: Tensor,
+        mask: Tensor,
+        multiplicity: int = 1,
+        to_keys=None,
+        model_cache=None,
+    ) -> Tensor:
+        """Forward pass.
+
+        Parameters
+        ----------
+        s : torch.Tensor
+            The input sequence tensor (B, S, D)
+        z : torch.Tensor
+            The input pairwise tensor (B, N, N, D)
+        mask : torch.Tensor
+            The pairwise mask tensor (B, N)
+        multiplicity : int, optional
+            The diffusion batch size, by default 1
+
+        Returns
+        -------
+        torch.Tensor
+            The output sequence tensor.
+
+        """
+        B = s.shape[0]
+
+        # Layer norms
+        if self.initial_norm:
+            s = self.norm_s(s)
+
+        if to_keys is not None:
+            k_in = to_keys(s)
+            mask = to_keys(mask.unsqueeze(-1)).squeeze(-1)
+        else:
+            k_in = s
+
+        # Compute projections
+        q = self.proj_q(s).view(B, -1, self.num_heads, self.head_dim)
+        k = self.proj_k(k_in).view(B, -1, self.num_heads, self.head_dim)
+        v = self.proj_v(k_in).view(B, -1, self.num_heads, self.head_dim)
+
+        # Caching z projection during diffusion roll-out
+        if model_cache is None or "z" not in model_cache:
+            z = self.proj_z(z)
+
+            if model_cache is not None:
+                model_cache["z"] = z
+        else:
+            z = model_cache["z"]
+        z = z.repeat_interleave(multiplicity, 0)
+
+        g = self.proj_g(s).sigmoid()
+
+        with torch.autocast("cuda", enabled=False):
+            # Compute attention weights
+            attn = torch.einsum("bihd,bjhd->bhij", q.float(), k.float())
+            attn = attn / (self.head_dim**0.5) + z.float()
+            # The pairwise mask tensor (B, N) is broadcasted to (B, 1, 1, N) and (B, H, N, N)
+            attn = attn + (1 - mask[:, None, None].float()) * -self.inf
+            attn = attn.softmax(dim=-1)
+
+            # Compute output
+            o = torch.einsum("bhij,bjhd->bihd", attn, v.float()).to(v.dtype)
+        o = o.reshape(B, -1, self.c_s)
+        o = self.proj_o(g * o)
+
+        return o
diff --git a/forks/boltz/src/boltz/model/layers/attentionv2.py b/forks/boltz/src/boltz/model/layers/attentionv2.py
new file mode 100644
index 00000000..6381f69f
--- /dev/null
+++ b/forks/boltz/src/boltz/model/layers/attentionv2.py
@@ -0,0 +1,111 @@
+from typing import Optional
+
+import torch
+from einops.layers.torch import Rearrange
+from torch import Tensor, nn
+
+import boltz.model.layers.initialize as init
+
+
+class AttentionPairBias(nn.Module):
+    """Attention pair bias layer."""
+
+    def __init__(
+        self,
+        c_s: int,
+        c_z: Optional[int] = None,
+        num_heads: Optional[int] = None,
+        inf: float = 1e6,
+        compute_pair_bias: bool = True,
+    ) -> None:
+        """Initialize the attention pair bias layer.
+
+        Parameters
+        ----------
+        c_s : int
+            The input sequence dimension.
+        c_z : int
+            The input pairwise dimension.
+        num_heads : int
+            The number of heads.
+        inf : float, optional
+            The inf value, by default 1e6
+
+        """
+        super().__init__()
+
+        assert c_s % num_heads == 0
+
+        self.c_s = c_s
+        self.num_heads = num_heads
+        self.head_dim = c_s // num_heads
+        self.inf = inf
+
+        self.proj_q = nn.Linear(c_s, c_s)
+        self.proj_k = nn.Linear(c_s, c_s, bias=False)
+        self.proj_v = nn.Linear(c_s, c_s, bias=False)
+        self.proj_g = nn.Linear(c_s, c_s, bias=False)
+
+        self.compute_pair_bias = compute_pair_bias
+        if compute_pair_bias:
+            self.proj_z = nn.Sequential(
+                nn.LayerNorm(c_z),
+                nn.Linear(c_z, num_heads, bias=False),
+                Rearrange("b ... h -> b h ..."),
+            )
+        else:
+            self.proj_z = Rearrange("b ... h -> b h ...")
+
+        self.proj_o = nn.Linear(c_s, c_s, bias=False)
+        init.final_init_(self.proj_o.weight)
+
+    def forward(
+        self,
+        s: Tensor,
+        z: Tensor,
+        mask: Tensor,
+        k_in: Tensor,
+        multiplicity: int = 1,
+    ) -> Tensor:
+        """Forward pass.
+
+        Parameters
+        ----------
+        s : torch.Tensor
+            The input sequence tensor (B, S, D)
+        z : torch.Tensor
+            The input pairwise tensor or bias (B, N, N, D)
+        mask : torch.Tensor
+            The pairwise mask tensor (B, N, N)
+
+        Returns
+        -------
+        torch.Tensor
+            The output sequence tensor.
+
+        """
+        B = s.shape[0]
+
+        # Compute projections
+        q = self.proj_q(s).view(B, -1, self.num_heads, self.head_dim)
+        k = self.proj_k(k_in).view(B, -1, self.num_heads, self.head_dim)
+        v = self.proj_v(k_in).view(B, -1, self.num_heads, self.head_dim)
+
+        bias = self.proj_z(z)
+        bias = bias.repeat_interleave(multiplicity, 0)
+
+        g = self.proj_g(s).sigmoid()
+
+        with torch.autocast("cuda", enabled=False):
+            # Compute attention weights
+            attn = torch.einsum("bihd,bjhd->bhij", q.float(), k.float())
+            attn = attn / (self.head_dim**0.5) + bias.float()
+            attn = attn + (1 - mask[:, None, None].float()) * -self.inf
+            attn = attn.softmax(dim=-1)
+
+            # Compute output
+            o = torch.einsum("bhij,bjhd->bihd", attn, v.float()).to(v.dtype)
+        o = o.reshape(B, -1, self.c_s)
+        o = self.proj_o(g * o)
+
+        return o
diff --git a/forks/boltz/src/boltz/model/layers/confidence_utils.py b/forks/boltz/src/boltz/model/layers/confidence_utils.py
new file mode 100644
index 00000000..de9eb50e
--- /dev/null
+++ b/forks/boltz/src/boltz/model/layers/confidence_utils.py
@@ -0,0 +1,231 @@
+import torch
+from torch import nn
+
+from boltz.data import const
+
+
+def compute_collinear_mask(v1, v2):
+    norm1 = torch.norm(v1, dim=1, keepdim=True)
+    norm2 = torch.norm(v2, dim=1, keepdim=True)
+    v1 = v1 / (norm1 + 1e-6)
+    v2 = v2 / (norm2 + 1e-6)
+    mask_angle = torch.abs(torch.sum(v1 * v2, dim=1)) < 0.9063
+    mask_overlap1 = norm1.reshape(-1) > 1e-2
+    mask_overlap2 = norm2.reshape(-1) > 1e-2
+    return mask_angle & mask_overlap1 & mask_overlap2
+
+
+def compute_frame_pred(
+    pred_atom_coords,
+    frames_idx_true,
+    feats,
+    multiplicity,
+    resolved_mask=None,
+    inference=False,
+):
+    with torch.amp.autocast("cuda", enabled=False):
+        asym_id_token = feats["asym_id"]
+        asym_id_atom = torch.bmm(
+            feats["atom_to_token"].float(), asym_id_token.unsqueeze(-1).float()
+        ).squeeze(-1)
+
+    B, N, _ = pred_atom_coords.shape
+    pred_atom_coords = pred_atom_coords.reshape(B // multiplicity, multiplicity, -1, 3)
+    frames_idx_pred = (
+        frames_idx_true.clone()
+        .repeat_interleave(multiplicity, 0)
+        .reshape(B // multiplicity, multiplicity, -1, 3)
+    )
+
+    # Iterate through the batch and modify the frames for nonpolymers
+    for i, pred_atom_coord in enumerate(pred_atom_coords):
+        token_idx = 0
+        atom_idx = 0
+        for id in torch.unique(asym_id_token[i]):
+            mask_chain_token = (asym_id_token[i] == id) * feats["token_pad_mask"][i]
+            mask_chain_atom = (asym_id_atom[i] == id) * feats["atom_pad_mask"][i]
+            num_tokens = int(mask_chain_token.sum().item())
+            num_atoms = int(mask_chain_atom.sum().item())
+            if (
+                feats["mol_type"][i, token_idx] != const.chain_type_ids["NONPOLYMER"]
+                or num_atoms < 3
+            ):
+                token_idx += num_tokens
+                atom_idx += num_atoms
+                continue
+            dist_mat = (
+                (
+                    pred_atom_coord[:, mask_chain_atom.bool()][:, None, :, :]
+                    - pred_atom_coord[:, mask_chain_atom.bool()][:, :, None, :]
+                )
+                ** 2
+            ).sum(-1) ** 0.5
+            if inference:
+                resolved_pair = 1 - (
+                    feats["atom_pad_mask"][i][mask_chain_atom.bool()][None, :]
+                    * feats["atom_pad_mask"][i][mask_chain_atom.bool()][:, None]
+                ).to(torch.float32)
+                resolved_pair[resolved_pair == 1] = torch.inf
+                indices = torch.sort(dist_mat + resolved_pair, axis=2).indices
+            else:
+                if resolved_mask is None:
+                    resolved_mask = feats["atom_resolved_mask"]
+                resolved_pair = 1 - (
+                    resolved_mask[i][mask_chain_atom.bool()][None, :]
+                    * resolved_mask[i][mask_chain_atom.bool()][:, None]
+                ).to(torch.float32)
+                resolved_pair[resolved_pair == 1] = torch.inf
+                indices = torch.sort(dist_mat + resolved_pair, axis=2).indices
+            frames = (
+                torch.cat(
+                    [
+                        indices[:, :, 1:2],
+                        indices[:, :, 0:1],
+                        indices[:, :, 2:3],
+                    ],
+                    dim=2,
+                )
+                + atom_idx
+            )
+            try:
+                frames_idx_pred[i, :, token_idx : token_idx + num_atoms, :] = frames
+            except Exception as e:
+                print(f"Failed to process {feats['pdb_id']} due to {e}")
+            token_idx += num_tokens
+            atom_idx += num_atoms
+
+    frames_expanded = pred_atom_coords[
+        torch.arange(0, B // multiplicity, 1)[:, None, None, None].to(
+            frames_idx_pred.device
+        ),
+        torch.arange(0, multiplicity, 1)[None, :, None, None].to(
+            frames_idx_pred.device
+        ),
+        frames_idx_pred,
+    ].reshape(-1, 3, 3)
+
+    # Compute masks for collinearity / overlap
+    mask_collinear_pred = compute_collinear_mask(
+        frames_expanded[:, 1] - frames_expanded[:, 0],
+        frames_expanded[:, 1] - frames_expanded[:, 2],
+    ).reshape(B // multiplicity, multiplicity, -1)
+    return frames_idx_pred, mask_collinear_pred * feats["token_pad_mask"][:, None, :]
+
+
+def compute_aggregated_metric(logits, end=1.0):
+    # Compute aggregated metric from logits
+    num_bins = logits.shape[-1]
+    bin_width = end / num_bins
+    bounds = torch.arange(
+        start=0.5 * bin_width, end=end, step=bin_width, device=logits.device
+    )
+    probs = nn.functional.softmax(logits, dim=-1)
+    plddt = torch.sum(
+        probs * bounds.view(*((1,) * len(probs.shape[:-1])), *bounds.shape),
+        dim=-1,
+    )
+    return plddt
+
+
+def tm_function(d, Nres):
+    d0 = 1.24 * (torch.clip(Nres, min=19) - 15) ** (1 / 3) - 1.8
+    return 1 / (1 + (d / d0) ** 2)
+
+
+def compute_ptms(logits, x_preds, feats, multiplicity):
+    # It needs to take as input the mask of the frames as they are not used to compute the PTM
+    _, mask_collinear_pred = compute_frame_pred(
+        x_preds, feats["frames_idx"], feats, multiplicity, inference=True
+    )
+    # mask overlapping, collinear tokens and ions (invalid frames)
+    mask_pad = feats["token_pad_mask"].repeat_interleave(multiplicity, 0)
+    maski = mask_collinear_pred.reshape(-1, mask_collinear_pred.shape[-1])
+    pair_mask_ptm = maski[:, :, None] * mask_pad[:, None, :] * mask_pad[:, :, None]
+    asym_id = feats["asym_id"].repeat_interleave(multiplicity, 0)
+    pair_mask_iptm = (
+        maski[:, :, None]
+        * (asym_id[:, None, :] != asym_id[:, :, None])
+        * mask_pad[:, None, :]
+        * mask_pad[:, :, None]
+    )
+    num_bins = logits.shape[-1]
+    bin_width = 32.0 / num_bins
+    end = 32.0
+    pae_value = torch.arange(
+        start=0.5 * bin_width, end=end, step=bin_width, device=logits.device
+    ).unsqueeze(0)
+    N_res = mask_pad.sum(dim=-1, keepdim=True)
+    tm_value = tm_function(pae_value, N_res).unsqueeze(1).unsqueeze(2)
+    probs = nn.functional.softmax(logits, dim=-1)
+    tm_expected_value = torch.sum(
+        probs * tm_value,
+        dim=-1,
+    )  # shape (B, N, N)
+    ptm = torch.max(
+        torch.sum(tm_expected_value * pair_mask_ptm, dim=-1)
+        / (torch.sum(pair_mask_ptm, dim=-1) + 1e-5),
+        dim=1,
+    ).values
+    iptm = torch.max(
+        torch.sum(tm_expected_value * pair_mask_iptm, dim=-1)
+        / (torch.sum(pair_mask_iptm, dim=-1) + 1e-5),
+        dim=1,
+    ).values
+
+    # compute ligand and protein iPTM
+    token_type = feats["mol_type"]
+    token_type = token_type.repeat_interleave(multiplicity, 0)
+    is_ligand_token = (token_type == const.chain_type_ids["NONPOLYMER"]).float()
+    is_protein_token = (token_type == const.chain_type_ids["PROTEIN"]).float()
+
+    ligand_iptm_mask = (
+        maski[:, :, None]
+        * (asym_id[:, None, :] != asym_id[:, :, None])
+        * mask_pad[:, None, :]
+        * mask_pad[:, :, None]
+        * (
+            (is_ligand_token[:, :, None] * is_protein_token[:, None, :])
+            + (is_protein_token[:, :, None] * is_ligand_token[:, None, :])
+        )
+    )
+    protein_ipmt_mask = (
+        maski[:, :, None]
+        * (asym_id[:, None, :] != asym_id[:, :, None])
+        * mask_pad[:, None, :]
+        * mask_pad[:, :, None]
+        * (is_protein_token[:, :, None] * is_protein_token[:, None, :])
+    )
+
+    ligand_iptm = torch.max(
+        torch.sum(tm_expected_value * ligand_iptm_mask, dim=-1)
+        / (torch.sum(ligand_iptm_mask, dim=-1) + 1e-5),
+        dim=1,
+    ).values
+    protein_iptm = torch.max(
+        torch.sum(tm_expected_value * protein_ipmt_mask, dim=-1)
+        / (torch.sum(protein_ipmt_mask, dim=-1) + 1e-5),
+        dim=1,
+    ).values
+
+    # Compute pair chain ipTM
+    chain_pair_iptm = {}
+    asym_ids_list = torch.unique(asym_id).tolist()
+    for idx1 in asym_ids_list:
+        chain_iptm = {}
+        for idx2 in asym_ids_list:
+            mask_pair_chain = (
+                maski[:, :, None]
+                * (asym_id[:, None, :] == idx1)
+                * (asym_id[:, :, None] == idx2)
+                * mask_pad[:, None, :]
+                * mask_pad[:, :, None]
+            )
+
+            chain_iptm[idx2] = torch.max(
+                torch.sum(tm_expected_value * mask_pair_chain, dim=-1)
+                / (torch.sum(mask_pair_chain, dim=-1) + 1e-5),
+                dim=1,
+            ).values
+        chain_pair_iptm[idx1] = chain_iptm
+
+    return ptm, iptm, ligand_iptm, protein_iptm, chain_pair_iptm
diff --git a/forks/boltz/src/boltz/model/layers/dropout.py b/forks/boltz/src/boltz/model/layers/dropout.py
new file mode 100644
index 00000000..f417c863
--- /dev/null
+++ b/forks/boltz/src/boltz/model/layers/dropout.py
@@ -0,0 +1,34 @@
+import torch
+from torch import Tensor
+
+
+def get_dropout_mask(
+    dropout: float,
+    z: Tensor,
+    training: bool,
+    columnwise: bool = False,
+) -> Tensor:
+    """Get the dropout mask.
+
+    Parameters
+    ----------
+    dropout : float
+        The dropout rate
+    z : torch.Tensor
+        The tensor to apply dropout to
+    training : bool
+        Whether the model is in training mode
+    columnwise : bool, optional
+        Whether to apply dropout columnwise
+
+    Returns
+    -------
+    torch.Tensor
+        The dropout mask
+
+    """
+    dropout = dropout * training
+    v = z[:, 0:1, :, 0:1] if columnwise else z[:, :, 0:1, 0:1]
+    d = torch.rand_like(v) > dropout
+    d = d * 1.0 / (1.0 - dropout)
+    return d
diff --git a/forks/boltz/src/boltz/model/layers/initialize.py b/forks/boltz/src/boltz/model/layers/initialize.py
new file mode 100644
index 00000000..ace4a302
--- /dev/null
+++ b/forks/boltz/src/boltz/model/layers/initialize.py
@@ -0,0 +1,100 @@
+"""Utility functions for initializing weights and biases."""
+
+# Copyright 2021 AlQuraishi Laboratory
+# Copyright 2021 DeepMind Technologies Limited
+#
+# Licensed under the Apache License, Version 2.0 (the "License");
+# you may not use this file except in compliance with the License.
+# You may obtain a copy of the License at
+#
+#      http://www.apache.org/licenses/LICENSE-2.0
+#
+# Unless required by applicable law or agreed to in writing, software
+# distributed under the License is distributed on an "AS IS" BASIS,
+# WITHOUT WARRANTIES OR CONDITIONS OF ANY KIND, either express or implied.
+# See the License for the specific language governing permissions and
+# limitations under the License.
+
+import math
+
+import numpy as np
+import torch
+from scipy.stats import truncnorm
+
+
+def _prod(nums):
+    out = 1
+    for n in nums:
+        out = out * n
+    return out
+
+
+def _calculate_fan(linear_weight_shape, fan="fan_in"):
+    fan_out, fan_in = linear_weight_shape
+
+    if fan == "fan_in":
+        f = fan_in
+    elif fan == "fan_out":
+        f = fan_out
+    elif fan == "fan_avg":
+        f = (fan_in + fan_out) / 2
+    else:
+        raise ValueError("Invalid fan option")
+
+    return f
+
+
+def trunc_normal_init_(weights, scale=1.0, fan="fan_in"):
+    shape = weights.shape
+    f = _calculate_fan(shape, fan)
+    scale = scale / max(1, f)
+    a = -2
+    b = 2
+    std = math.sqrt(scale) / truncnorm.std(a=a, b=b, loc=0, scale=1)
+    size = _prod(shape)
+    samples = truncnorm.rvs(a=a, b=b, loc=0, scale=std, size=size)
+    samples = np.reshape(samples, shape)
+    with torch.no_grad():
+        weights.copy_(torch.tensor(samples, device=weights.device))
+
+
+def lecun_normal_init_(weights):
+    trunc_normal_init_(weights, scale=1.0)
+
+
+def he_normal_init_(weights):
+    trunc_normal_init_(weights, scale=2.0)
+
+
+def glorot_uniform_init_(weights):
+    torch.nn.init.xavier_uniform_(weights, gain=1)
+
+
+def final_init_(weights):
+    with torch.no_grad():
+        weights.fill_(0.0)
+
+
+def gating_init_(weights):
+    with torch.no_grad():
+        weights.fill_(0.0)
+
+
+def bias_init_zero_(bias):
+    with torch.no_grad():
+        bias.fill_(0.0)
+
+
+def bias_init_one_(bias):
+    with torch.no_grad():
+        bias.fill_(1.0)
+
+
+def normal_init_(weights):
+    torch.nn.init.kaiming_normal_(weights, nonlinearity="linear")
+
+
+def ipa_point_weights_init_(weights):
+    with torch.no_grad():
+        softplus_inverse_1 = 0.541324854612918
+        weights.fill_(softplus_inverse_1)
diff --git a/forks/boltz/src/boltz/model/layers/outer_product_mean.py b/forks/boltz/src/boltz/model/layers/outer_product_mean.py
new file mode 100644
index 00000000..9a4a607d
--- /dev/null
+++ b/forks/boltz/src/boltz/model/layers/outer_product_mean.py
@@ -0,0 +1,98 @@
+import torch
+from torch import Tensor, nn
+
+import boltz.model.layers.initialize as init
+
+
+class OuterProductMean(nn.Module):
+    """Outer product mean layer."""
+
+    def __init__(self, c_in: int, c_hidden: int, c_out: int) -> None:
+        """Initialize the outer product mean layer.
+
+        Parameters
+        ----------
+        c_in : int
+            The input dimension.
+        c_hidden : int
+            The hidden dimension.
+        c_out : int
+            The output dimension.
+
+        """
+        super().__init__()
+        self.c_hidden = c_hidden
+        self.norm = nn.LayerNorm(c_in)
+        self.proj_a = nn.Linear(c_in, c_hidden, bias=False)
+        self.proj_b = nn.Linear(c_in, c_hidden, bias=False)
+        self.proj_o = nn.Linear(c_hidden * c_hidden, c_out)
+        init.final_init_(self.proj_o.weight)
+        init.final_init_(self.proj_o.bias)
+
+    def forward(self, m: Tensor, mask: Tensor, chunk_size: int = None) -> Tensor:
+        """Forward pass.
+
+        Parameters
+        ----------
+        m : torch.Tensor
+            The sequence tensor (B, S, N, c_in).
+        mask : torch.Tensor
+            The mask tensor (B, S, N).
+
+        Returns
+        -------
+        torch.Tensor
+            The output tensor (B, N, N, c_out).
+
+        """
+        # Expand mask
+        mask = mask.unsqueeze(-1).to(m)
+
+        # Compute projections
+        m = self.norm(m)
+        a = self.proj_a(m) * mask
+        b = self.proj_b(m) * mask
+
+        # Compute outer product mean
+        if chunk_size is not None and not self.training:
+            # Compute pairwise mask
+            for i in range(0, mask.shape[1], 64):
+                if i == 0:
+                    num_mask = (
+                        mask[:, i : i + 64, None, :] * mask[:, i : i + 64, :, None]
+                    ).sum(1)
+                else:
+                    num_mask += (
+                        mask[:, i : i + 64, None, :] * mask[:, i : i + 64, :, None]
+                    ).sum(1)
+            num_mask = num_mask.clamp(min=1)
+
+            # Compute squentially in chunks
+            for i in range(0, self.c_hidden, chunk_size):
+                a_chunk = a[:, :, :, i : i + chunk_size]
+                sliced_weight_proj_o = self.proj_o.weight[
+                    :, i * self.c_hidden : (i + chunk_size) * self.c_hidden
+                ]
+
+                z = torch.einsum("bsic,bsjd->bijcd", a_chunk, b)
+                z = z.reshape(*z.shape[:3], -1)
+                z = z / num_mask
+
+                # Project to output
+                if i == 0:
+                    z_out = z.to(m) @ sliced_weight_proj_o.T
+                else:
+                    z_out = z_out + z.to(m) @ sliced_weight_proj_o.T
+
+            z_out = z_out + self.proj_o.bias  # add bias
+            return z_out
+        else:
+            mask = mask[:, :, None, :] * mask[:, :, :, None]
+            num_mask = mask.sum(1).clamp(min=1)
+            z = torch.einsum("bsic,bsjd->bijcd", a.float(), b.float())
+            z = z.reshape(*z.shape[:3], -1)
+            z = z / num_mask
+
+            # Project to output
+            z = self.proj_o(z.to(m))
+            return z
diff --git a/forks/boltz/src/boltz/model/layers/pair_averaging.py b/forks/boltz/src/boltz/model/layers/pair_averaging.py
new file mode 100644
index 00000000..c0a2d5e4
--- /dev/null
+++ b/forks/boltz/src/boltz/model/layers/pair_averaging.py
@@ -0,0 +1,135 @@
+import torch
+from torch import Tensor, nn
+
+import boltz.model.layers.initialize as init
+
+
+class PairWeightedAveraging(nn.Module):
+    """Pair weighted averaging layer."""
+
+    def __init__(
+        self,
+        c_m: int,
+        c_z: int,
+        c_h: int,
+        num_heads: int,
+        inf: float = 1e6,
+    ) -> None:
+        """Initialize the pair weighted averaging layer.
+
+        Parameters
+        ----------
+        c_m: int
+            The dimension of the input sequence.
+        c_z: int
+            The dimension of the input pairwise tensor.
+        c_h: int
+            The dimension of the hidden.
+        num_heads: int
+            The number of heads.
+        inf: float
+            The value to use for masking, default 1e6.
+
+        """
+        super().__init__()
+        self.c_m = c_m
+        self.c_z = c_z
+        self.c_h = c_h
+        self.num_heads = num_heads
+        self.inf = inf
+
+        self.norm_m = nn.LayerNorm(c_m)
+        self.norm_z = nn.LayerNorm(c_z)
+
+        self.proj_m = nn.Linear(c_m, c_h * num_heads, bias=False)
+        self.proj_g = nn.Linear(c_m, c_h * num_heads, bias=False)
+        self.proj_z = nn.Linear(c_z, num_heads, bias=False)
+        self.proj_o = nn.Linear(c_h * num_heads, c_m, bias=False)
+        init.final_init_(self.proj_o.weight)
+
+    def forward(
+        self, m: Tensor, z: Tensor, mask: Tensor, chunk_heads: False = bool
+    ) -> Tensor:
+        """Forward pass.
+
+        Parameters
+        ----------
+        m : torch.Tensor
+            The input sequence tensor (B, S, N, D)
+        z : torch.Tensor
+            The input pairwise tensor (B, N, N, D)
+        mask : torch.Tensor
+            The pairwise mask tensor (B, N, N)
+
+        Returns
+        -------
+        torch.Tensor
+            The output sequence tensor (B, S, N, D)
+
+        """
+        # Compute layer norms
+        m = self.norm_m(m)
+        z = self.norm_z(z)
+
+        if chunk_heads and not self.training:
+            # Compute heads sequentially
+            o_chunks = []
+            for head_idx in range(self.num_heads):
+                sliced_weight_proj_m = self.proj_m.weight[
+                    head_idx * self.c_h : (head_idx + 1) * self.c_h, :
+                ]
+                sliced_weight_proj_g = self.proj_g.weight[
+                    head_idx * self.c_h : (head_idx + 1) * self.c_h, :
+                ]
+                sliced_weight_proj_z = self.proj_z.weight[head_idx : (head_idx + 1), :]
+                sliced_weight_proj_o = self.proj_o.weight[
+                    :, head_idx * self.c_h : (head_idx + 1) * self.c_h
+                ]
+
+                # Project input tensors
+                v: Tensor = m @ sliced_weight_proj_m.T
+                v = v.reshape(*v.shape[:3], 1, self.c_h)
+                v = v.permute(0, 3, 1, 2, 4)
+
+                # Compute weights
+                b: Tensor = z @ sliced_weight_proj_z.T
+                b = b.permute(0, 3, 1, 2)
+                b = b + (1 - mask[:, None]) * -self.inf
+                w = torch.softmax(b, dim=-1)
+
+                # Compute gating
+                g: Tensor = m @ sliced_weight_proj_g.T
+                g = g.sigmoid()
+
+                # Compute output
+                o = torch.einsum("bhij,bhsjd->bhsid", w, v)
+                o = o.permute(0, 2, 3, 1, 4)
+                o = o.reshape(*o.shape[:3], 1 * self.c_h)
+                o_chunks = g * o
+                if head_idx == 0:
+                    o_out = o_chunks @ sliced_weight_proj_o.T
+                else:
+                    o_out += o_chunks @ sliced_weight_proj_o.T
+            return o_out
+        else:
+            # Project input tensors
+            v: Tensor = self.proj_m(m)
+            v = v.reshape(*v.shape[:3], self.num_heads, self.c_h)
+            v = v.permute(0, 3, 1, 2, 4)
+
+            # Compute weights
+            b: Tensor = self.proj_z(z)
+            b = b.permute(0, 3, 1, 2)
+            b = b + (1 - mask[:, None]) * -self.inf
+            w = torch.softmax(b, dim=-1)
+
+            # Compute gating
+            g: Tensor = self.proj_g(m)
+            g = g.sigmoid()
+
+            # Compute output
+            o = torch.einsum("bhij,bhsjd->bhsid", w, v)
+            o = o.permute(0, 2, 3, 1, 4)
+            o = o.reshape(*o.shape[:3], self.num_heads * self.c_h)
+            o = self.proj_o(g * o)
+            return o
diff --git a/forks/boltz/src/boltz/model/layers/pairformer.py b/forks/boltz/src/boltz/model/layers/pairformer.py
new file mode 100644
index 00000000..7edadbfe
--- /dev/null
+++ b/forks/boltz/src/boltz/model/layers/pairformer.py
@@ -0,0 +1,335 @@
+from typing import Optional
+
+import torch
+from torch import Tensor, nn
+
+from boltz.data import const
+from boltz.model.layers.attention import AttentionPairBias
+from boltz.model.layers.attentionv2 import AttentionPairBias as AttentionPairBiasV2
+from boltz.model.layers.dropout import get_dropout_mask
+from boltz.model.layers.transition import Transition
+from boltz.model.layers.triangular_attention.attention import (
+    TriangleAttentionEndingNode,
+    TriangleAttentionStartingNode,
+)
+from boltz.model.layers.triangular_mult import (
+    TriangleMultiplicationIncoming,
+    TriangleMultiplicationOutgoing,
+)
+
+
+class PairformerLayer(nn.Module):
+    """Pairformer module."""
+
+    def __init__(
+        self,
+        token_s: int,
+        token_z: int,
+        num_heads: int = 16,
+        dropout: float = 0.25,
+        pairwise_head_width: int = 32,
+        pairwise_num_heads: int = 4,
+        post_layer_norm: bool = False,
+        v2: bool = False,
+    ) -> None:
+        super().__init__()
+        self.token_z = token_z
+        self.dropout = dropout
+        self.num_heads = num_heads
+        self.post_layer_norm = post_layer_norm
+
+        self.pre_norm_s = nn.LayerNorm(token_s)
+        if v2:
+            self.attention = AttentionPairBiasV2(token_s, token_z, num_heads)
+        else:
+            self.attention = AttentionPairBias(token_s, token_z, num_heads)
+
+        self.tri_mul_out = TriangleMultiplicationOutgoing(token_z)
+        self.tri_mul_in = TriangleMultiplicationIncoming(token_z)
+
+        self.tri_att_start = TriangleAttentionStartingNode(
+            token_z, pairwise_head_width, pairwise_num_heads, inf=1e9
+        )
+        self.tri_att_end = TriangleAttentionEndingNode(
+            token_z, pairwise_head_width, pairwise_num_heads, inf=1e9
+        )
+
+        self.transition_s = Transition(token_s, token_s * 4)
+        self.transition_z = Transition(token_z, token_z * 4)
+
+        self.s_post_norm = (
+            nn.LayerNorm(token_s) if self.post_layer_norm else nn.Identity()
+        )
+
+    def forward(
+        self,
+        s: Tensor,
+        z: Tensor,
+        mask: Tensor,
+        pair_mask: Tensor,
+        chunk_size_tri_attn: Optional[int] = None,
+        use_kernels: bool = False,
+        use_cuequiv_mul: bool = False,
+        use_cuequiv_attn: bool = False,
+    ) -> tuple[Tensor, Tensor]:
+        # Compute pairwise stack
+        dropout = get_dropout_mask(self.dropout, z, self.training)
+        z = z + dropout * self.tri_mul_out(
+            z, mask=pair_mask, use_kernels=use_cuequiv_mul or use_kernels
+        )
+
+        dropout = get_dropout_mask(self.dropout, z, self.training)
+        z = z + dropout * self.tri_mul_in(
+            z, mask=pair_mask, use_kernels=use_cuequiv_mul or use_kernels
+        )
+
+        dropout = get_dropout_mask(self.dropout, z, self.training)
+        z = z + dropout * self.tri_att_start(
+            z,
+            mask=pair_mask,
+            chunk_size=chunk_size_tri_attn,
+            use_kernels=use_cuequiv_attn or use_kernels,
+        )
+
+        dropout = get_dropout_mask(self.dropout, z, self.training, columnwise=True)
+        z = z + dropout * self.tri_att_end(
+            z,
+            mask=pair_mask,
+            chunk_size=chunk_size_tri_attn,
+            use_kernels=use_cuequiv_attn or use_kernels,
+        )
+
+        z = z + self.transition_z(z)
+
+        # Compute sequence stack
+        with torch.autocast("cuda", enabled=False):
+            s_normed = self.pre_norm_s(s.float())
+            s = s.float() + self.attention(
+                s=s_normed, z=z.float(), mask=mask.float(), k_in=s_normed
+            )
+            s = s + self.transition_s(s)
+            s = self.s_post_norm(s)
+
+        return s, z
+
+
+class PairformerModule(nn.Module):
+    """Pairformer module."""
+
+    def __init__(
+        self,
+        token_s: int,
+        token_z: int,
+        num_blocks: int,
+        num_heads: int = 16,
+        dropout: float = 0.25,
+        pairwise_head_width: int = 32,
+        pairwise_num_heads: int = 4,
+        post_layer_norm: bool = False,
+        activation_checkpointing: bool = False,
+        v2: bool = False,
+        **kwargs,
+    ) -> None:
+        super().__init__()
+        self.token_z = token_z
+        self.num_blocks = num_blocks
+        self.dropout = dropout
+        self.num_heads = num_heads
+        self.post_layer_norm = post_layer_norm
+        self.activation_checkpointing = activation_checkpointing
+
+        self.layers = nn.ModuleList()
+        for _ in range(num_blocks):
+            self.layers.append(
+                PairformerLayer(
+                    token_s,
+                    token_z,
+                    num_heads,
+                    dropout,
+                    pairwise_head_width,
+                    pairwise_num_heads,
+                    post_layer_norm,
+                    v2,
+                ),
+            )
+
+    def forward(
+        self,
+        s: Tensor,
+        z: Tensor,
+        mask: Tensor,
+        pair_mask: Tensor,
+        use_kernels: bool = False,
+    ) -> tuple[Tensor, Tensor]:
+        """Perform the forward pass.
+
+        Parameters
+        ----------
+        s : Tensor
+            The sequence stack.
+        z : Tensor
+            The pairwise stack.
+        mask : Tensor
+            The mask.
+        pair_mask : Tensor
+            The pairwise mask.
+        use_kernels : bool
+            Whether to use kernels.
+
+        """
+        if not self.training:
+            if z.shape[1] > const.chunk_size_threshold:
+                chunk_size_tri_attn = 128
+            else:
+                chunk_size_tri_attn = 512
+        else:
+            chunk_size_tri_attn = None
+
+        for layer in self.layers:
+            if self.activation_checkpointing and self.training:
+                s, z = torch.utils.checkpoint.checkpoint(
+                    layer,
+                    s,
+                    z,
+                    mask,
+                    pair_mask,
+                    chunk_size_tri_attn,
+                    use_kernels,
+                )
+            else:
+                s, z = layer(s, z, mask, pair_mask, chunk_size_tri_attn, use_kernels)
+        return s, z
+
+
+class PairformerNoSeqLayer(nn.Module):
+    """Pairformer module without sequence track."""
+
+    def __init__(
+        self,
+        token_z: int,
+        dropout: float = 0.25,
+        pairwise_head_width: int = 32,
+        pairwise_num_heads: int = 4,
+        post_layer_norm: bool = False,
+    ) -> None:
+        super().__init__()
+        self.token_z = token_z
+        self.dropout = dropout
+        self.post_layer_norm = post_layer_norm
+
+        self.tri_mul_out = TriangleMultiplicationOutgoing(token_z)
+        self.tri_mul_in = TriangleMultiplicationIncoming(token_z)
+
+        self.tri_att_start = TriangleAttentionStartingNode(
+            token_z, pairwise_head_width, pairwise_num_heads, inf=1e9
+        )
+        self.tri_att_end = TriangleAttentionEndingNode(
+            token_z, pairwise_head_width, pairwise_num_heads, inf=1e9
+        )
+
+        self.transition_z = Transition(token_z, token_z * 4)
+
+    def forward(
+        self,
+        z: Tensor,
+        pair_mask: Tensor,
+        chunk_size_tri_attn: Optional[int] = None,
+        use_kernels: bool = False,
+        use_cuequiv_mul: bool = False,
+        use_cuequiv_attn: bool = False,
+    ) -> Tensor:
+        # Compute pairwise stack
+        dropout = get_dropout_mask(self.dropout, z, self.training)
+        z = z + dropout * self.tri_mul_out(
+            z, mask=pair_mask, use_kernels=use_cuequiv_mul or use_kernels
+        )
+
+        dropout = get_dropout_mask(self.dropout, z, self.training)
+        z = z + dropout * self.tri_mul_in(
+            z, mask=pair_mask, use_kernels=use_cuequiv_mul or use_kernels
+        )
+
+        dropout = get_dropout_mask(self.dropout, z, self.training)
+        z = z + dropout * self.tri_att_start(
+            z,
+            mask=pair_mask,
+            chunk_size=chunk_size_tri_attn,
+            use_kernels=use_cuequiv_attn or use_kernels,
+        )
+
+        dropout = get_dropout_mask(self.dropout, z, self.training, columnwise=True)
+        z = z + dropout * self.tri_att_end(
+            z,
+            mask=pair_mask,
+            chunk_size=chunk_size_tri_attn,
+            use_kernels=use_cuequiv_attn or use_kernels,
+        )
+
+        z = z + self.transition_z(z)
+        return z
+
+
+class PairformerNoSeqModule(nn.Module):
+    """Pairformer module without sequence track."""
+
+    def __init__(
+        self,
+        token_z: int,
+        num_blocks: int,
+        dropout: float = 0.25,
+        pairwise_head_width: int = 32,
+        pairwise_num_heads: int = 4,
+        post_layer_norm: bool = False,
+        activation_checkpointing: bool = False,
+        **kwargs,
+    ) -> None:
+        super().__init__()
+        self.token_z = token_z
+        self.num_blocks = num_blocks
+        self.dropout = dropout
+        self.post_layer_norm = post_layer_norm
+        self.activation_checkpointing = activation_checkpointing
+
+        self.layers = nn.ModuleList()
+        for i in range(num_blocks):
+            self.layers.append(
+                PairformerNoSeqLayer(
+                    token_z,
+                    dropout,
+                    pairwise_head_width,
+                    pairwise_num_heads,
+                    post_layer_norm,
+                ),
+            )
+
+    def forward(
+        self,
+        z: Tensor,
+        pair_mask: Tensor,
+        use_kernels: bool = False,
+    ) -> Tensor:
+        if not self.training:
+            if z.shape[1] > const.chunk_size_threshold:
+                chunk_size_tri_attn = 128
+            else:
+                chunk_size_tri_attn = 512
+        else:
+            chunk_size_tri_attn = None
+
+        for layer in self.layers:
+            if self.activation_checkpointing and self.training:
+                z = torch.utils.checkpoint.checkpoint(
+                    layer,
+                    z,
+                    pair_mask,
+                    chunk_size_tri_attn,
+                    use_kernels,
+                )
+            else:
+                z = layer(
+                    z,
+                    pair_mask,
+                    chunk_size_tri_attn,
+                    use_kernels,
+                )
+        return z
diff --git a/forks/boltz/src/boltz/model/layers/relative.py b/forks/boltz/src/boltz/model/layers/relative.py
new file mode 100644
index 00000000..6aec100c
--- /dev/null
+++ b/forks/boltz/src/boltz/model/layers/relative.py
@@ -0,0 +1,58 @@
+import torch
+
+
+def compute_relative_distribution_perfect_correlation(
+    binned_distribution_1, binned_distribution_2
+):
+    """
+    Compute the relative distribution between two binned distributions with perfect correlation.
+
+    Parameters
+    ----------
+    binned_distribution_1 : torch.Tensor
+        The first binned distribution, shape (..., K).
+    binned_distribution_2 : torch.Tensor
+        The second binned distribution, shape (..., K).
+
+    Returns
+    -------
+    torch.Tensor
+        The relative distribution, shape (..., 2K - 1).
+
+    """
+    K = binned_distribution_1.shape[-1]
+    relative_distribution = torch.zeros(
+        binned_distribution_1.shape[:-1] + (2 * K - 1,),
+        device=binned_distribution_1.device,
+    )
+    zero = torch.zeros(
+        binned_distribution_1.shape[:-1] + (1,), device=binned_distribution_1.device
+    )
+
+    binned_distribution_1 = torch.cat([zero, binned_distribution_1], dim=-1)
+    binned_distribution_2 = torch.cat([zero, binned_distribution_2], dim=-1)
+
+    cumulative_1 = torch.cumsum(binned_distribution_1, dim=-1)
+    cumulative_2 = torch.cumsum(binned_distribution_2, dim=-1)
+
+    for i in range(K):
+        relative_distribution[..., K - 1 + i] = torch.sum(
+            torch.relu(
+                torch.minimum(
+                    cumulative_1[..., 1 + i :], cumulative_2[..., 1 : K + 1 - i]
+                )
+                - torch.maximum(cumulative_1[..., i:-1], cumulative_2[..., : K - i]),
+            )
+        )
+
+    for i in range(1, K):
+        relative_distribution[..., K - 1 - i] = torch.sum(
+            torch.relu(
+                torch.minimum(
+                    cumulative_2[..., 1 + i :], cumulative_1[..., 1 : K + 1 - i]
+                )
+                - torch.maximum(cumulative_2[..., i:-1], cumulative_1[..., : K - i]),
+            )
+        )
+
+    return relative_distribution
diff --git a/forks/boltz/src/boltz/model/layers/transition.py b/forks/boltz/src/boltz/model/layers/transition.py
new file mode 100644
index 00000000..8bab8093
--- /dev/null
+++ b/forks/boltz/src/boltz/model/layers/transition.py
@@ -0,0 +1,78 @@
+from typing import Optional
+
+from torch import Tensor, nn
+
+import boltz.model.layers.initialize as init
+
+
+class Transition(nn.Module):
+    """Perform a two-layer MLP."""
+
+    def __init__(
+        self,
+        dim: int = 128,
+        hidden: int = 512,
+        out_dim: Optional[int] = None,
+    ) -> None:
+        """Initialize the TransitionUpdate module.
+
+        Parameters
+        ----------
+        dim: int
+            The dimension of the input, default 128
+        hidden: int
+            The dimension of the hidden, default 512
+        out_dim: Optional[int]
+            The dimension of the output, default None
+
+        """
+        super().__init__()
+        if out_dim is None:
+            out_dim = dim
+
+        self.norm = nn.LayerNorm(dim, eps=1e-5)
+        self.fc1 = nn.Linear(dim, hidden, bias=False)
+        self.fc2 = nn.Linear(dim, hidden, bias=False)
+        self.fc3 = nn.Linear(hidden, out_dim, bias=False)
+        self.silu = nn.SiLU()
+        self.hidden = hidden
+
+        init.bias_init_one_(self.norm.weight)
+        init.bias_init_zero_(self.norm.bias)
+
+        init.lecun_normal_init_(self.fc1.weight)
+        init.lecun_normal_init_(self.fc2.weight)
+        init.final_init_(self.fc3.weight)
+
+    def forward(self, x: Tensor, chunk_size: int = None) -> Tensor:
+        """Perform a forward pass.
+
+        Parameters
+        ----------
+        x: torch.Tensor
+            The input data of shape (..., D)
+
+        Returns
+        -------
+        x: torch.Tensor
+            The output data of shape (..., D)
+
+        """
+        x = self.norm(x)
+
+        if chunk_size is None or self.training:
+            x = self.silu(self.fc1(x)) * self.fc2(x)
+            x = self.fc3(x)
+            return x
+        else:
+            # Compute in chunks
+            for i in range(0, self.hidden, chunk_size):
+                fc1_slice = self.fc1.weight[i : i + chunk_size, :]
+                fc2_slice = self.fc2.weight[i : i + chunk_size, :]
+                fc3_slice = self.fc3.weight[:, i : i + chunk_size]
+                x_chunk = self.silu((x @ fc1_slice.T)) * (x @ fc2_slice.T)
+                if i == 0:
+                    x_out = x_chunk @ fc3_slice.T
+                else:
+                    x_out = x_out + x_chunk @ fc3_slice.T
+            return x_out
diff --git a/forks/boltz/src/boltz/model/layers/triangular_attention/__init__.py b/forks/boltz/src/boltz/model/layers/triangular_attention/__init__.py
new file mode 100644
index 00000000..e69de29b
diff --git a/forks/boltz/src/boltz/model/layers/triangular_attention/attention.py b/forks/boltz/src/boltz/model/layers/triangular_attention/attention.py
new file mode 100644
index 00000000..458aaa07
--- /dev/null
+++ b/forks/boltz/src/boltz/model/layers/triangular_attention/attention.py
@@ -0,0 +1,189 @@
+# Copyright 2021 AlQuraishi Laboratory
+# Copyright 2021 DeepMind Technologies Limited
+#
+# Licensed under the Apache License, Version 2.0 (the "License");
+# you may not use this file except in compliance with the License.
+# You may obtain a copy of the License at
+#
+#      http://www.apache.org/licenses/LICENSE-2.0
+#
+# Unless required by applicable law or agreed to in writing, software
+# distributed under the License is distributed on an "AS IS" BASIS,
+# WITHOUT WARRANTIES OR CONDITIONS OF ANY KIND, either express or implied.
+# See the License for the specific language governing permissions and
+# limitations under the License.
+
+from functools import partial, partialmethod
+from typing import Optional
+
+import torch
+import torch.nn as nn
+
+from boltz.model.layers.triangular_attention.primitives import (
+    Attention,
+    LayerNorm,
+    Linear,
+)
+from boltz.model.layers.triangular_attention.utils import (
+    chunk_layer,
+    permute_final_dims,
+)
+
+
+class TriangleAttention(nn.Module):
+    """Implement Algorithm 12."""
+
+    def __init__(
+        self,
+        c_in: int,
+        c_hidden: int,
+        no_heads: int,
+        starting: bool = True,
+        inf: float = 1e9,
+    ) -> None:
+        super().__init__()
+
+        self.c_in = c_in
+        self.c_hidden = c_hidden
+        self.no_heads = no_heads
+        self.starting = starting
+        self.inf = inf
+
+        self.layer_norm = LayerNorm(self.c_in)
+
+        self.linear = Linear(c_in, self.no_heads, bias=False, init="normal")
+
+        self.mha = Attention(
+            self.c_in, self.c_in, self.c_in, self.c_hidden, self.no_heads
+        )
+
+    @torch.jit.ignore
+    def _chunk(
+        self,
+        x: torch.Tensor,
+        tri_bias: torch.Tensor,
+        mask_bias: torch.Tensor,
+        mask: torch.Tensor,
+        chunk_size: int,
+        use_kernels: bool = False,
+    ) -> torch.Tensor:
+        """Compute triangle attention.
+
+        Parameters
+        ----------
+        x : torch.Tensor
+            Input tensor of shape [*, I, J, C_in]
+        biases : list[torch.Tensor]
+            List of bias tensors of shape [*, H, I, J]
+        chunk_size : int
+            Size of chunks for memory efficient computation
+        use_kernels : bool, default=False
+            Whether to use optimized CUDA kernels
+
+        Returns
+        -------
+        torch.Tensor
+            Output tensor of shape [*, I, J, C_in]
+
+        """
+        mha_inputs = {
+            "q_x": x,
+            "kv_x": x,
+            "tri_bias": tri_bias,
+            "mask_bias": mask_bias,
+            "mask": mask,
+        }
+
+        return chunk_layer(
+            partial(
+                self.mha,
+                use_kernels=use_kernels,
+            ),
+            mha_inputs,
+            chunk_size=chunk_size,
+            no_batch_dims=len(x.shape[:-2]),
+            _out=None,
+        )
+
+    def forward(
+        self,
+        x: torch.Tensor,
+        mask: Optional[torch.Tensor] = None,
+        chunk_size: Optional[int] = None,
+        use_kernels: bool = False,
+    ) -> torch.Tensor:
+        """Compute triangle attention.
+
+        Parameters
+        ----------
+        x : torch.Tensor
+            Input tensor of shape [*, I, J, C_in]
+        mask : torch.Tensor, optional
+            Attention mask of shape [*, I, J]
+        chunk_size : int, optional
+            Size of chunks for memory efficient computation
+        use_kernels : bool, default=False
+            Whether to use optimized CUDA kernels
+
+        Returns
+        -------
+        torch.Tensor
+            Output tensor of shape [*, I, J, C_in]
+
+        """
+        if mask is None:
+            # [*, I, J]
+            mask = x.new_ones(
+                x.shape[:-1],
+            )
+
+        if not self.starting:
+            x = x.transpose(-2, -3)
+            mask = mask.transpose(-1, -2)
+
+        # [*, I, J, C_in]
+        x = self.layer_norm(x)
+
+        # [*, I, 1, 1, J]
+        mask = mask[..., :, None, None, :]
+        mask_bias = self.inf * (mask - 1)
+
+        # [*, H, I, J]
+        triangle_bias = permute_final_dims(self.linear(x), (2, 0, 1))
+
+        # [*, 1, H, I, J]
+        triangle_bias = triangle_bias.unsqueeze(-4)
+
+        if chunk_size is not None and not use_kernels:
+            x = self._chunk(
+                x,
+                triangle_bias,
+                mask_bias,
+                mask,
+                chunk_size,
+                use_kernels=use_kernels,
+            )
+        else:
+            x = self.mha(
+                x,
+                x,
+                triangle_bias,
+                mask_bias,
+                mask,
+                use_kernels=use_kernels,
+            )
+
+        if not self.starting:
+            x = x.transpose(-2, -3)
+
+        return x
+
+
+# Implements Algorithm 13
+TriangleAttentionStartingNode = TriangleAttention
+
+
+class TriangleAttentionEndingNode(TriangleAttention):
+    """Implement Algorithm 14."""
+
+    __init__ = partialmethod(TriangleAttention.__init__, starting=False)
diff --git a/forks/boltz/src/boltz/model/layers/triangular_attention/primitives.py b/forks/boltz/src/boltz/model/layers/triangular_attention/primitives.py
new file mode 100644
index 00000000..26aabc7b
--- /dev/null
+++ b/forks/boltz/src/boltz/model/layers/triangular_attention/primitives.py
@@ -0,0 +1,409 @@
+# Copyright 2021 AlQuraishi Laboratory
+# Copyright 2021 DeepMind Technologies Limited
+#
+# Licensed under the Apache License, Version 2.0 (the "License");
+# you may not use this file except in compliance with the License.
+# You may obtain a copy of the License at
+#
+#      http://www.apache.org/licenses/LICENSE-2.0
+#
+# Unless required by applicable law or agreed to in writing, software
+# distributed under the License is distributed on an "AS IS" BASIS,
+# WITHOUT WARRANTIES OR CONDITIONS OF ANY KIND, either express or implied.
+# See the License for the specific language governing permissions and
+# limitations under the License.
+
+import math
+from typing import Callable, List, Optional, Tuple
+
+import torch
+from einops import rearrange
+from torch import nn
+
+from boltz.model.layers import initialize
+from boltz.model.layers.triangular_attention.utils import (
+    flatten_final_dims,
+    permute_final_dims,
+)
+
+
+class Linear(nn.Linear):
+    """
+    A Linear layer with built-in nonstandard initializations. Called just
+    like torch.nn.Linear.
+
+    Implements the initializers in 1.11.4, plus some additional ones found
+    in the code.
+    """
+
+    def __init__(
+        self,
+        in_dim: int,
+        out_dim: int,
+        bias: bool = True,
+        init: str = "default",
+        init_fn: Optional[Callable[[torch.Tensor, torch.Tensor], None]] = None,
+        precision=None,
+    ):
+        """Initialize the linear layer.
+
+        Parameters
+        ----------
+        in_dim : int
+            The final dimension of inputs to the layer
+        out_dim : int
+            The final dimension of layer outputs
+        bias : bool, default=True
+            Whether to learn an additive bias
+        init : str, default='default'
+            The initializer to use. Choose from:
+
+            - "default": LeCun fan-in truncated normal initialization
+            - "relu": He initialization w/ truncated normal distribution
+            - "glorot": Fan-average Glorot uniform initialization
+            - "gating": Weights=0, Bias=1
+            - "normal": Normal initialization with std=1/sqrt(fan_in)
+            - "final": Weights=0, Bias=0
+
+            Overridden by init_fn if the latter is not None.
+        init_fn : callable, optional
+            A custom initializer taking weight and bias as inputs.
+            Overrides init if not None.
+
+        """
+        super().__init__(in_dim, out_dim, bias=bias)
+
+        if bias:
+            with torch.no_grad():
+                self.bias.fill_(0)
+
+        with torch.no_grad():
+            if init_fn is not None:
+                init_fn(self.weight, self.bias)
+            else:
+                if init == "default":
+                    initialize.lecun_normal_init_(self.weight)
+                elif init == "relu":
+                    initialize.he_normal_init_(self.weight)
+                elif init == "glorot":
+                    initialize.glorot_uniform_init_(self.weight)
+                elif init == "gating":
+                    initialize.gating_init_(self.weight)
+                    if bias:
+                        self.bias.fill_(1.0)
+                elif init == "normal":
+                    initialize.normal_init_(self.weight)
+                elif init == "final":
+                    initialize.final_init_(self.weight)
+                else:
+                    raise ValueError("Invalid init string.")
+
+        self.precision = precision
+
+    def forward(self, input: torch.Tensor) -> torch.Tensor:
+        d = input.dtype
+        if self.precision is not None:
+            with torch.autocast("cuda", enabled=False):
+                bias = (
+                    self.bias.to(dtype=self.precision)
+                    if self.bias is not None
+                    else None
+                )
+                return nn.functional.linear(
+                    input.to(dtype=self.precision),
+                    self.weight.to(dtype=self.precision),
+                    bias,
+                ).to(dtype=d)
+
+        if d is torch.bfloat16:
+            with torch.autocast("cuda", enabled=False):
+                bias = self.bias.to(dtype=d) if self.bias is not None else None
+                return nn.functional.linear(input, self.weight.to(dtype=d), bias)
+
+        return nn.functional.linear(input, self.weight, self.bias)
+
+
+class LayerNorm(nn.Module):
+    def __init__(self, c_in, eps=1e-5):
+        super(LayerNorm, self).__init__()
+
+        self.c_in = (c_in,)
+        self.eps = eps
+
+        self.weight = nn.Parameter(torch.ones(c_in))
+        self.bias = nn.Parameter(torch.zeros(c_in))
+
+    def forward(self, x):
+        d = x.dtype
+        if d is torch.bfloat16:
+            with torch.autocast("cuda", enabled=False):
+                out = nn.functional.layer_norm(
+                    x,
+                    self.c_in,
+                    self.weight.to(dtype=d),
+                    self.bias.to(dtype=d),
+                    self.eps,
+                )
+        else:
+            out = nn.functional.layer_norm(
+                x,
+                self.c_in,
+                self.weight,
+                self.bias,
+                self.eps,
+            )
+
+        return out
+
+
+@torch.jit.ignore
+def softmax_no_cast(t: torch.Tensor, dim: int = -1) -> torch.Tensor:
+    """
+    Softmax, but without automatic casting to fp32 when the input is of
+    type bfloat16
+    """
+    d = t.dtype
+    if d is torch.bfloat16:
+        with torch.autocast("cuda", enabled=False):
+            s = torch.nn.functional.softmax(t, dim=dim)
+    else:
+        s = torch.nn.functional.softmax(t, dim=dim)
+
+    return s
+
+
+# @torch.jit.script
+def _attention(
+    query: torch.Tensor,
+    key: torch.Tensor,
+    value: torch.Tensor,
+    biases: List[torch.Tensor],
+) -> torch.Tensor:
+    # [*, H, C_hidden, K]
+    key = permute_final_dims(key, (1, 0))
+
+    # [*, H, Q, K]
+    a = torch.matmul(query, key)
+
+    for b in biases:
+        a += b
+
+    a = softmax_no_cast(a, -1)
+
+    # [*, H, Q, C_hidden]
+    a = torch.matmul(a, value)
+
+    return a
+
+
+@torch.compiler.disable
+def kernel_triangular_attn(q, k, v, tri_bias, mask, scale):
+    from cuequivariance_torch.primitives.triangle import triangle_attention
+    return triangle_attention(q, k, v, tri_bias, mask=mask, scale=scale)
+
+
+class Attention(nn.Module):
+    """
+    Standard multi-head attention using AlphaFold's default layer
+    initialization. Allows multiple bias vectors.
+    """
+
+    def __init__(
+        self,
+        c_q: int,
+        c_k: int,
+        c_v: int,
+        c_hidden: int,
+        no_heads: int,
+        gating: bool = True,
+    ):
+        """Initialize the attention layer.
+
+        Parameters
+        ----------
+        c_q : int
+            Input dimension of query data
+        c_k : int
+            Input dimension of key data
+        c_v : int
+            Input dimension of value data
+        c_hidden : int
+            Per-head hidden dimension
+        no_heads : int
+            Number of attention heads
+        gating : bool, default=True
+            Whether the output should be gated using query data
+
+        """
+        super().__init__()
+
+        self.c_q = c_q
+        self.c_k = c_k
+        self.c_v = c_v
+        self.c_hidden = c_hidden
+        self.no_heads = no_heads
+        self.gating = gating
+
+        # DISCREPANCY: c_hidden is not the per-head channel dimension, as
+        # stated in the supplement, but the overall channel dimension.
+
+        self.linear_q = Linear(
+            self.c_q, self.c_hidden * self.no_heads, bias=False, init="glorot"
+        )
+        self.linear_k = Linear(
+            self.c_k, self.c_hidden * self.no_heads, bias=False, init="glorot"
+        )
+        self.linear_v = Linear(
+            self.c_v, self.c_hidden * self.no_heads, bias=False, init="glorot"
+        )
+        self.linear_o = Linear(
+            self.c_hidden * self.no_heads, self.c_q, bias=False, init="final"
+        )
+
+        self.linear_g = None
+        if self.gating:
+            self.linear_g = Linear(
+                self.c_q, self.c_hidden * self.no_heads, bias=False, init="gating"
+            )
+
+        self.sigmoid = nn.Sigmoid()
+
+    def _prep_qkv(
+        self, q_x: torch.Tensor, kv_x: torch.Tensor, apply_scale: bool = True
+    ) -> Tuple[torch.Tensor, torch.Tensor, torch.Tensor]:
+        # [*, Q/K/V, H * C_hidden]
+        q = self.linear_q(q_x)
+        k = self.linear_k(kv_x)
+        v = self.linear_v(kv_x)
+
+        # [*, Q/K, H, C_hidden]
+        q = q.view(q.shape[:-1] + (self.no_heads, -1))
+        k = k.view(k.shape[:-1] + (self.no_heads, -1))
+        v = v.view(v.shape[:-1] + (self.no_heads, -1))
+
+        # [*, H, Q/K, C_hidden]
+        q = q.transpose(-2, -3)
+        k = k.transpose(-2, -3)
+        v = v.transpose(-2, -3)
+
+        if apply_scale:
+            q /= math.sqrt(self.c_hidden)
+
+        return q, k, v
+
+    def _wrap_up(self, o: torch.Tensor, q_x: torch.Tensor) -> torch.Tensor:
+        if self.linear_g is not None:
+            g = self.sigmoid(self.linear_g(q_x))
+
+            # [*, Q, H, C_hidden]
+            g = g.view(g.shape[:-1] + (self.no_heads, -1))
+            o = o * g
+
+        # [*, Q, H * C_hidden]
+        o = flatten_final_dims(o, 2)
+
+        # [*, Q, C_q]
+        o = self.linear_o(o)
+
+        return o
+
+    def forward(
+        self,
+        q_x: torch.Tensor,
+        kv_x: torch.Tensor,
+        tri_bias: torch.Tensor,
+        mask_bias: torch.Tensor,
+        mask: torch.Tensor,
+        use_kernels: bool = False,
+    ) -> torch.Tensor:
+        """Compute attention.
+
+        Parameters
+        ----------
+        q_x : torch.Tensor
+            [*, Q, C_q] query data
+        kv_x : torch.Tensor
+            [*, K, C_k] key data
+        tri_bias : torch.Tensor
+            [*, H, Q, K] triangular bias
+        mask_bias : torch.Tensor
+            [*, H, Q, K] mask bias
+        mask : torch.Tensor
+            [*, Q, K] mask
+        use_kernels : bool, default=False
+            Whether to use optimized CUDA kernels
+
+        Returns
+        -------
+            [*, Q, C_q] attention update
+
+        """
+        # Attention kernel applies scaling internally
+        q, k, v = self._prep_qkv(
+            q_x,
+            kv_x,
+            apply_scale=not use_kernels,
+        )
+
+        if use_kernels:
+            scale = 1.0 / math.sqrt(self.c_hidden)
+            o = kernel_triangular_attn(
+                q,
+                k,
+                v,
+                tri_bias=tri_bias,
+                mask=mask.bool(),
+                scale=scale,
+            )
+            o = o.transpose(-2, -3)
+        else:
+            biases = [mask_bias, tri_bias]
+            o = _attention(q, k, v, biases)
+            o = o.transpose(-2, -3)
+
+        o = self._wrap_up(o, q_x)
+
+        return o
+
+
+def _trifast_attn(q, k, v, biases):
+    orig_n_dims = len(q.shape)
+
+    if len(biases) != 2:
+        raise ValueError(f"Trifast expects two bias terms, found {len(biases)}")
+
+    mask, b = biases
+
+    if len(b.shape) == 5:
+        # Sometimes there is an extra batch dim -- why?
+        b = b.squeeze(1)
+
+    if orig_n_dims == 4:
+        # add fake batch dim
+        q = q.unsqueeze(0)
+        k = k.unsqueeze(0)
+        v = v.unsqueeze(0)
+        # b = b.unsqueeze(0) not sure why this and only this has a batch dim?
+        mask = mask.unsqueeze(0)
+
+    if len(q.shape) != 5:
+        raise ValueError(f"Trifast expects q/k/v to be 5D, found {len(q.shape)}")
+
+    # Reorder q/k/v
+    q = rearrange(q, "b i h j d -> b h i j d")
+    k = rearrange(k, "b i h j d -> b h i j d")
+    v = rearrange(v, "b i h j d -> b h i j d")
+
+    # Make mask the right shape.
+    mask = rearrange(mask, "b i () () j -> b i j").bool()
+
+    # Delay import to here to avoid initializing cuda too early
+    from trifast import triangle_attention
+
+    o = triangle_attention(q, k, v, b, mask)
+    o = rearrange(o, "b h i j d -> b i j h d")
+
+    # Remove the batch dim if we added it.
+    if orig_n_dims == 4:
+        o = o.squeeze(0)
+    return o
diff --git a/forks/boltz/src/boltz/model/layers/triangular_attention/utils.py b/forks/boltz/src/boltz/model/layers/triangular_attention/utils.py
new file mode 100644
index 00000000..89899daa
--- /dev/null
+++ b/forks/boltz/src/boltz/model/layers/triangular_attention/utils.py
@@ -0,0 +1,380 @@
+# Copyright 2021 AlQuraishi Laboratory
+#
+# Licensed under the Apache License, Version 2.0 (the "License");
+# you may not use this file except in compliance with the License.
+# You may obtain a copy of the License at
+#
+#      http://www.apache.org/licenses/LICENSE-2.0
+#
+# Unless required by applicable law or agreed to in writing, software
+# distributed under the License is distributed on an "AS IS" BASIS,
+# WITHOUT WARRANTIES OR CONDITIONS OF ANY KIND, either express or implied.
+# See the License for the specific language governing permissions and
+# limitations under the License.
+
+from functools import partial
+from typing import Any, Callable, Dict, List, Optional, Sequence, Tuple
+
+import torch
+
+
+def add(m1, m2, inplace):
+    # The first operation in a checkpoint can't be in-place, but it's
+    # nice to have in-place addition during inference. Thus...
+    if not inplace:
+        m1 = m1 + m2
+    else:
+        m1 += m2
+
+    return m1
+
+
+def permute_final_dims(tensor: torch.Tensor, inds: List[int]):
+    zero_index = -1 * len(inds)
+    first_inds = list(range(len(tensor.shape[:zero_index])))
+    return tensor.permute(first_inds + [zero_index + i for i in inds])
+
+
+def is_fp16_enabled():
+    # Autocast world
+    fp16_enabled = torch.get_autocast_gpu_dtype() == torch.float16
+    fp16_enabled = fp16_enabled and torch.is_autocast_enabled()
+
+    return fp16_enabled
+
+
+# With tree_map, a poor man's JAX tree_map
+def dict_map(fn, dic, leaf_type):
+    new_dict = {}
+    for k, v in dic.items():
+        if type(v) is dict:
+            new_dict[k] = dict_map(fn, v, leaf_type)
+        else:
+            new_dict[k] = tree_map(fn, v, leaf_type)
+
+    return new_dict
+
+
+def tree_map(fn, tree, leaf_type):
+    if isinstance(tree, dict):
+        return dict_map(fn, tree, leaf_type)
+    elif isinstance(tree, list):
+        return [tree_map(fn, x, leaf_type) for x in tree]
+    elif isinstance(tree, tuple):
+        return tuple([tree_map(fn, x, leaf_type) for x in tree])
+    elif isinstance(tree, leaf_type):
+        return fn(tree)
+    else:
+        raise ValueError(f"Tree of type {type(tree)} not supported")
+
+
+tensor_tree_map = partial(tree_map, leaf_type=torch.Tensor)
+
+
+def flatten_final_dims(t: torch.Tensor, no_dims: int):
+    return t.reshape(t.shape[:-no_dims] + (-1,))
+
+
+def _fetch_dims(tree):
+    shapes = []
+    tree_type = type(tree)
+    if tree_type is dict:
+        for v in tree.values():
+            shapes.extend(_fetch_dims(v))
+    elif tree_type is list or tree_type is tuple:
+        for t in tree:
+            shapes.extend(_fetch_dims(t))
+    elif tree_type is torch.Tensor:
+        shapes.append(tree.shape)
+    else:
+        raise ValueError("Not supported")
+
+    return shapes
+
+
+@torch.jit.ignore
+def _flat_idx_to_idx(
+    flat_idx: int,
+    dims: Tuple[int],
+) -> Tuple[int]:
+    idx = []
+    for d in reversed(dims):
+        idx.append(flat_idx % d)
+        flat_idx = flat_idx // d
+
+    return tuple(reversed(idx))
+
+
+@torch.jit.ignore
+def _get_minimal_slice_set(
+    start: Sequence[int],
+    end: Sequence[int],
+    dims: int,
+    start_edges: Optional[Sequence[bool]] = None,
+    end_edges: Optional[Sequence[bool]] = None,
+) -> Sequence[Tuple[int]]:
+    """
+    Produces an ordered sequence of tensor slices that, when used in
+    sequence on a tensor with shape dims, yields tensors that contain every
+    leaf in the contiguous range [start, end]. Care is taken to yield a
+    short sequence of slices, and perhaps even the shortest possible (I'm
+    pretty sure it's the latter).
+
+    end is INCLUSIVE.
+    """
+
+    # start_edges and end_edges both indicate whether, starting from any given
+    # dimension, the start/end index is at the top/bottom edge of the
+    # corresponding tensor, modeled as a tree
+    def reduce_edge_list(l):
+        tally = 1
+        for i in range(len(l)):
+            reversed_idx = -1 * (i + 1)
+            l[reversed_idx] *= tally
+            tally = l[reversed_idx]
+
+    if start_edges is None:
+        start_edges = [s == 0 for s in start]
+        reduce_edge_list(start_edges)
+    if end_edges is None:
+        end_edges = [e == (d - 1) for e, d in zip(end, dims)]
+        reduce_edge_list(end_edges)
+
+        # Base cases. Either start/end are empty and we're done, or the final,
+    # one-dimensional tensor can be simply sliced
+    if len(start) == 0:
+        return [tuple()]
+    elif len(start) == 1:
+        return [(slice(start[0], end[0] + 1),)]
+
+    slices = []
+    path = []
+
+    # Dimensions common to start and end can be selected directly
+    for s, e in zip(start, end):
+        if s == e:
+            path.append(slice(s, s + 1))
+        else:
+            break
+
+    path = tuple(path)
+    divergence_idx = len(path)
+
+    # start == end, and we're done
+    if divergence_idx == len(dims):
+        return [tuple(path)]
+
+    def upper():
+        sdi = start[divergence_idx]
+        return [
+            path + (slice(sdi, sdi + 1),) + s
+            for s in _get_minimal_slice_set(
+                start[divergence_idx + 1 :],
+                [d - 1 for d in dims[divergence_idx + 1 :]],
+                dims[divergence_idx + 1 :],
+                start_edges=start_edges[divergence_idx + 1 :],
+                end_edges=[1 for _ in end_edges[divergence_idx + 1 :]],
+            )
+        ]
+
+    def lower():
+        edi = end[divergence_idx]
+        return [
+            path + (slice(edi, edi + 1),) + s
+            for s in _get_minimal_slice_set(
+                [0 for _ in start[divergence_idx + 1 :]],
+                end[divergence_idx + 1 :],
+                dims[divergence_idx + 1 :],
+                start_edges=[1 for _ in start_edges[divergence_idx + 1 :]],
+                end_edges=end_edges[divergence_idx + 1 :],
+            )
+        ]
+
+    # If both start and end are at the edges of the subtree rooted at
+    # divergence_idx, we can just select the whole subtree at once
+    if start_edges[divergence_idx] and end_edges[divergence_idx]:
+        slices.append(path + (slice(start[divergence_idx], end[divergence_idx] + 1),))
+    # If just start is at the edge, we can grab almost all of the subtree,
+    # treating only the ragged bottom edge as an edge case
+    elif start_edges[divergence_idx]:
+        slices.append(path + (slice(start[divergence_idx], end[divergence_idx]),))
+        slices.extend(lower())
+    # Analogous to the previous case, but the top is ragged this time
+    elif end_edges[divergence_idx]:
+        slices.extend(upper())
+        slices.append(
+            path + (slice(start[divergence_idx] + 1, end[divergence_idx] + 1),)
+        )
+    # If both sides of the range are ragged, we need to handle both sides
+    # separately. If there's contiguous meat in between them, we can index it
+    # in one big chunk
+    else:
+        slices.extend(upper())
+        middle_ground = end[divergence_idx] - start[divergence_idx]
+        if middle_ground > 1:
+            slices.append(
+                path + (slice(start[divergence_idx] + 1, end[divergence_idx]),)
+            )
+        slices.extend(lower())
+
+    return [tuple(s) for s in slices]
+
+
+@torch.jit.ignore
+def _chunk_slice(
+    t: torch.Tensor,
+    flat_start: int,
+    flat_end: int,
+    no_batch_dims: int,
+) -> torch.Tensor:
+    """
+    Equivalent to
+
+        t.reshape((-1,) + t.shape[no_batch_dims:])[flat_start:flat_end]
+
+    but without the need for the initial reshape call, which can be
+    memory-intensive in certain situations. The only reshape operations
+    in this function are performed on sub-tensors that scale with
+    (flat_end - flat_start), the chunk size.
+    """
+
+    batch_dims = t.shape[:no_batch_dims]
+    start_idx = list(_flat_idx_to_idx(flat_start, batch_dims))
+    # _get_minimal_slice_set is inclusive
+    end_idx = list(_flat_idx_to_idx(flat_end - 1, batch_dims))
+
+    # Get an ordered list of slices to perform
+    slices = _get_minimal_slice_set(
+        start_idx,
+        end_idx,
+        batch_dims,
+    )
+
+    sliced_tensors = [t[s] for s in slices]
+
+    return torch.cat([s.view((-1,) + t.shape[no_batch_dims:]) for s in sliced_tensors])
+
+
+def chunk_layer(
+    layer: Callable,
+    inputs: Dict[str, Any],
+    chunk_size: int,
+    no_batch_dims: int,
+    low_mem: bool = False,
+    _out: Any = None,
+    _add_into_out: bool = False,
+) -> Any:
+    """
+    Implements the "chunking" procedure described in section 1.11.8.
+
+    Layer outputs and inputs are assumed to be simple "pytrees,"
+    consisting only of (arbitrarily nested) lists, tuples, and dicts with
+    torch.Tensor leaves.
+
+    Args:
+        layer:
+            The layer to be applied chunk-wise
+        inputs:
+            A (non-nested) dictionary of keyworded inputs. All leaves must
+            be tensors and must share the same batch dimensions.
+        chunk_size:
+            The number of sub-batches per chunk. If multiple batch
+            dimensions are specified, a "sub-batch" is defined as a single
+            indexing of all batch dimensions simultaneously (s.t. the
+            number of sub-batches is the product of the batch dimensions).
+        no_batch_dims:
+            How many of the initial dimensions of each input tensor can
+            be considered batch dimensions.
+        low_mem:
+            Avoids flattening potentially large input tensors. Unnecessary
+            in most cases, and is ever so slightly slower than the default
+            setting.
+    Returns:
+        The reassembled output of the layer on the inputs.
+    """
+    if not (len(inputs) > 0):
+        raise ValueError("Must provide at least one input")
+
+    initial_dims = [shape[:no_batch_dims] for shape in _fetch_dims(inputs)]
+    orig_batch_dims = tuple([max(s) for s in zip(*initial_dims)])
+
+    def _prep_inputs(t):
+        if not low_mem:
+            if not sum(t.shape[:no_batch_dims]) == no_batch_dims:
+                t = t.expand(orig_batch_dims + t.shape[no_batch_dims:])
+            t = t.reshape(-1, *t.shape[no_batch_dims:])
+        else:
+            t = t.expand(orig_batch_dims + t.shape[no_batch_dims:])
+        return t
+
+    prepped_inputs = tensor_tree_map(_prep_inputs, inputs)
+    prepped_outputs = None
+    if _out is not None:
+        reshape_fn = lambda t: t.view([-1] + list(t.shape[no_batch_dims:]))
+        prepped_outputs = tensor_tree_map(reshape_fn, _out)
+
+    flat_batch_dim = 1
+    for d in orig_batch_dims:
+        flat_batch_dim *= d
+
+    no_chunks = flat_batch_dim // chunk_size + (flat_batch_dim % chunk_size != 0)
+
+    i = 0
+    out = prepped_outputs
+    for _ in range(no_chunks):
+        # Chunk the input
+        if not low_mem:
+            select_chunk = lambda t: t[i : i + chunk_size] if t.shape[0] != 1 else t
+        else:
+            select_chunk = partial(
+                _chunk_slice,
+                flat_start=i,
+                flat_end=min(flat_batch_dim, i + chunk_size),
+                no_batch_dims=len(orig_batch_dims),
+            )
+
+        chunks = tensor_tree_map(select_chunk, prepped_inputs)
+
+        # Run the layer on the chunk
+        output_chunk = layer(**chunks)
+
+        # Allocate space for the output
+        if out is None:
+            allocate = lambda t: t.new_zeros((flat_batch_dim,) + t.shape[1:])
+            out = tensor_tree_map(allocate, output_chunk)
+
+        # Put the chunk in its pre-allocated space
+        out_type = type(output_chunk)
+        if out_type is dict:
+
+            def assign(d1, d2):
+                for k, v in d1.items():
+                    if type(v) is dict:
+                        assign(v, d2[k])
+                    else:
+                        if _add_into_out:
+                            v[i : i + chunk_size] += d2[k]
+                        else:
+                            v[i : i + chunk_size] = d2[k]
+
+            assign(out, output_chunk)
+        elif out_type is tuple:
+            for x1, x2 in zip(out, output_chunk):
+                if _add_into_out:
+                    x1[i : i + chunk_size] += x2
+                else:
+                    x1[i : i + chunk_size] = x2
+        elif out_type is torch.Tensor:
+            if _add_into_out:
+                out[i : i + chunk_size] += output_chunk
+            else:
+                out[i : i + chunk_size] = output_chunk
+        else:
+            raise ValueError("Not supported")
+
+        i += chunk_size
+
+    reshape = lambda t: t.view(orig_batch_dims + t.shape[1:])
+    out = tensor_tree_map(reshape, out)
+
+    return out
diff --git a/forks/boltz/src/boltz/model/layers/triangular_mult.py b/forks/boltz/src/boltz/model/layers/triangular_mult.py
new file mode 100644
index 00000000..5c52958a
--- /dev/null
+++ b/forks/boltz/src/boltz/model/layers/triangular_mult.py
@@ -0,0 +1,212 @@
+import torch
+from torch import Tensor, nn
+
+from boltz.model.layers import initialize as init
+
+
+@torch.compiler.disable
+def kernel_triangular_mult(
+    x,
+    direction,
+    mask,
+    norm_in_weight,
+    norm_in_bias,
+    p_in_weight,
+    g_in_weight,
+    norm_out_weight,
+    norm_out_bias,
+    p_out_weight,
+    g_out_weight,
+    eps,
+):
+    from cuequivariance_torch.primitives.triangle import triangle_multiplicative_update
+    return triangle_multiplicative_update(
+        x,
+        direction=direction,
+        mask=mask,
+        norm_in_weight=norm_in_weight,
+        norm_in_bias=norm_in_bias,
+        p_in_weight=p_in_weight,
+        g_in_weight=g_in_weight,
+        norm_out_weight=norm_out_weight,
+        norm_out_bias=norm_out_bias,
+        p_out_weight=p_out_weight,
+        g_out_weight=g_out_weight,
+        eps=eps,
+    )
+
+
+class TriangleMultiplicationOutgoing(nn.Module):
+    """TriangleMultiplicationOutgoing."""
+
+    def __init__(self, dim: int = 128) -> None:
+        """Initialize the TriangularUpdate module.
+
+        Parameters
+        ----------
+        dim: int
+            The dimension of the input, default 128
+
+        """
+        super().__init__()
+
+        self.norm_in = nn.LayerNorm(dim, eps=1e-5)
+        self.p_in = nn.Linear(dim, 2 * dim, bias=False)
+        self.g_in = nn.Linear(dim, 2 * dim, bias=False)
+
+        self.norm_out = nn.LayerNorm(dim)
+        self.p_out = nn.Linear(dim, dim, bias=False)
+        self.g_out = nn.Linear(dim, dim, bias=False)
+
+        init.bias_init_one_(self.norm_in.weight)
+        init.bias_init_zero_(self.norm_in.bias)
+
+        init.lecun_normal_init_(self.p_in.weight)
+        init.gating_init_(self.g_in.weight)
+
+        init.bias_init_one_(self.norm_out.weight)
+        init.bias_init_zero_(self.norm_out.bias)
+
+        init.final_init_(self.p_out.weight)
+        init.gating_init_(self.g_out.weight)
+
+    def forward(self, x: Tensor, mask: Tensor, use_kernels: bool = False) -> Tensor:
+        """Perform a forward pass.
+
+        Parameters
+        ----------
+        x: torch.Tensor
+            The input data of shape (B, N, N, D)
+        mask: torch.Tensor
+            The input mask of shape (B, N, N)
+        use_kernels: bool
+            Whether to use the kernel
+
+        Returns
+        -------
+        x: torch.Tensor
+            The output data of shape (B, N, N, D)
+
+        """
+        if use_kernels:
+            return kernel_triangular_mult(
+                x,
+                direction="outgoing",
+                mask=mask,
+                norm_in_weight=self.norm_in.weight,
+                norm_in_bias=self.norm_in.bias,
+                p_in_weight=self.p_in.weight,
+                g_in_weight=self.g_in.weight,
+                norm_out_weight=self.norm_out.weight,
+                norm_out_bias=self.norm_out.bias,
+                p_out_weight=self.p_out.weight,
+                g_out_weight=self.g_out.weight,
+                eps=1e-5,
+            )
+
+        # Input gating: D -> D
+        x = self.norm_in(x)
+        x_in = x
+        x = self.p_in(x) * self.g_in(x).sigmoid()
+
+        # Apply mask
+        x = x * mask.unsqueeze(-1)
+
+        # Split input and cast to float
+        a, b = torch.chunk(x.float(), 2, dim=-1)
+
+        # Triangular projection
+        x = torch.einsum("bikd,bjkd->bijd", a, b)
+
+        # Output gating
+        x = self.p_out(self.norm_out(x)) * self.g_out(x_in).sigmoid()
+
+        return x
+
+
+class TriangleMultiplicationIncoming(nn.Module):
+    """TriangleMultiplicationIncoming."""
+
+    def __init__(self, dim: int = 128) -> None:
+        """Initialize the TriangularUpdate module.
+
+        Parameters
+        ----------
+        dim: int
+            The dimension of the input, default 128
+
+        """
+        super().__init__()
+
+        self.norm_in = nn.LayerNorm(dim, eps=1e-5)
+        self.p_in = nn.Linear(dim, 2 * dim, bias=False)
+        self.g_in = nn.Linear(dim, 2 * dim, bias=False)
+
+        self.norm_out = nn.LayerNorm(dim)
+        self.p_out = nn.Linear(dim, dim, bias=False)
+        self.g_out = nn.Linear(dim, dim, bias=False)
+
+        init.bias_init_one_(self.norm_in.weight)
+        init.bias_init_zero_(self.norm_in.bias)
+
+        init.lecun_normal_init_(self.p_in.weight)
+        init.gating_init_(self.g_in.weight)
+
+        init.bias_init_one_(self.norm_out.weight)
+        init.bias_init_zero_(self.norm_out.bias)
+
+        init.final_init_(self.p_out.weight)
+        init.gating_init_(self.g_out.weight)
+
+    def forward(self, x: Tensor, mask: Tensor, use_kernels: bool = False) -> Tensor:
+        """Perform a forward pass.
+
+        Parameters
+        ----------
+        x: torch.Tensor
+            The input data of shape (B, N, N, D)
+        mask: torch.Tensor
+            The input mask of shape (B, N, N)
+        use_kernels: bool
+            Whether to use the kernel
+
+        Returns
+        -------
+        x: torch.Tensor
+            The output data of shape (B, N, N, D)
+
+        """
+        if use_kernels:
+            return kernel_triangular_mult(
+                x,
+                direction="incoming",
+                mask=mask,
+                norm_in_weight=self.norm_in.weight,
+                norm_in_bias=self.norm_in.bias,
+                p_in_weight=self.p_in.weight,
+                g_in_weight=self.g_in.weight,
+                norm_out_weight=self.norm_out.weight,
+                norm_out_bias=self.norm_out.bias,
+                p_out_weight=self.p_out.weight,
+                g_out_weight=self.g_out.weight,
+                eps=1e-5,
+            )
+
+        # Input gating: D -> D
+        x = self.norm_in(x)
+        x_in = x
+        x = self.p_in(x) * self.g_in(x).sigmoid()
+
+        # Apply mask
+        x = x * mask.unsqueeze(-1)
+
+        # Split input and cast to float
+        a, b = torch.chunk(x.float(), 2, dim=-1)
+
+        # Triangular projection
+        x = torch.einsum("bkid,bkjd->bijd", a, b)
+
+        # Output gating
+        x = self.p_out(self.norm_out(x)) * self.g_out(x_in).sigmoid()
+
+        return x
diff --git a/forks/boltz/src/boltz/model/loss/__init__.py b/forks/boltz/src/boltz/model/loss/__init__.py
new file mode 100644
index 00000000..e69de29b
diff --git a/forks/boltz/src/boltz/model/loss/bfactor.py b/forks/boltz/src/boltz/model/loss/bfactor.py
new file mode 100644
index 00000000..c650f332
--- /dev/null
+++ b/forks/boltz/src/boltz/model/loss/bfactor.py
@@ -0,0 +1,49 @@
+import torch
+from torch import Tensor
+
+
+def bfactor_loss_fn(
+    output: dict[str, Tensor],
+    feats: dict[str, Tensor],
+) -> Tensor:
+    """Compute the bfactor loss.
+
+    Parameters
+    ----------
+    output : dict[str, Tensor]
+        Output of the model
+    feats : dict[str, Tensor]
+        Input features
+
+    Returns
+    -------
+    Tensor
+        The globally averaged loss.
+
+    """
+    with torch.autocast("cuda", enabled=False):
+        # Get predicted distograms
+        pred = output["pbfactor"].float()  # (B, L, bins)
+        bins = pred.shape[2]  # num_bins
+        token_to_rep_atom = feats["token_to_rep_atom"]
+
+        # Compute target histogram
+        bfactor_atom = feats["bfactor"].unsqueeze(-1)  # (B, L)
+        bfactor_token = torch.bmm(token_to_rep_atom.float(), bfactor_atom)
+
+        boundaries = torch.linspace(0, 100, bins - 1, device=bfactor_token.device)
+        bfactor_token_bin = (bfactor_token > boundaries).sum(dim=-1).long()
+        bfactor_target = torch.nn.functional.one_hot(
+            bfactor_token_bin, num_classes=bins
+        )
+
+        # Combine target mask and padding mask
+        token_mask = (bfactor_token > 1e-5).squeeze(-1).float()
+
+        # Compute the bfactor loss
+        errors = -1 * torch.sum(
+            bfactor_target * torch.nn.functional.log_softmax(pred, dim=-1),
+            dim=-1,
+        )
+        loss = torch.sum(errors * token_mask) / (torch.sum(token_mask) + 1e-5)
+        return loss
diff --git a/forks/boltz/src/boltz/model/loss/confidence.py b/forks/boltz/src/boltz/model/loss/confidence.py
new file mode 100644
index 00000000..7080c9d6
--- /dev/null
+++ b/forks/boltz/src/boltz/model/loss/confidence.py
@@ -0,0 +1,590 @@
+import torch
+from torch import nn
+
+from boltz.data import const
+
+
+def confidence_loss(
+    model_out,
+    feats,
+    true_coords,
+    true_coords_resolved_mask,
+    multiplicity=1,
+    alpha_pae=0.0,
+):
+    """Compute confidence loss.
+
+    Parameters
+    ----------
+    model_out: Dict[str, torch.Tensor]
+        Dictionary containing the model output
+    feats: Dict[str, torch.Tensor]
+        Dictionary containing the model input
+    true_coords: torch.Tensor
+        The atom coordinates after symmetry correction
+    true_coords_resolved_mask: torch.Tensor
+        The resolved mask after symmetry correction
+    multiplicity: int, optional
+        The diffusion batch size, by default 1
+    alpha_pae: float, optional
+        The weight of the pae loss, by default 0.0
+
+    Returns
+    -------
+    Dict[str, torch.Tensor]
+        Loss breakdown
+
+    """
+    # Compute losses
+    plddt = plddt_loss(
+        model_out["plddt_logits"],
+        model_out["sample_atom_coords"],
+        true_coords,
+        true_coords_resolved_mask,
+        feats,
+        multiplicity=multiplicity,
+    )
+    pde = pde_loss(
+        model_out["pde_logits"],
+        model_out["sample_atom_coords"],
+        true_coords,
+        true_coords_resolved_mask,
+        feats,
+        multiplicity,
+    )
+    resolved = resolved_loss(
+        model_out["resolved_logits"],
+        feats,
+        true_coords_resolved_mask,
+        multiplicity=multiplicity,
+    )
+
+    pae = 0.0
+    if alpha_pae > 0.0:
+        pae = pae_loss(
+            model_out["pae_logits"],
+            model_out["sample_atom_coords"],
+            true_coords,
+            true_coords_resolved_mask,
+            feats,
+            multiplicity,
+        )
+
+    loss = plddt + pde + resolved + alpha_pae * pae
+
+    dict_out = {
+        "loss": loss,
+        "loss_breakdown": {
+            "plddt_loss": plddt,
+            "pde_loss": pde,
+            "resolved_loss": resolved,
+            "pae_loss": pae,
+        },
+    }
+    return dict_out
+
+
+def resolved_loss(
+    pred_resolved,
+    feats,
+    true_coords_resolved_mask,
+    multiplicity=1,
+):
+    """Compute resolved loss.
+
+    Parameters
+    ----------
+    pred_resolved: torch.Tensor
+        The resolved logits
+    feats: Dict[str, torch.Tensor]
+        Dictionary containing the model input
+    true_coords_resolved_mask: torch.Tensor
+        The resolved mask after symmetry correction
+    multiplicity: int, optional
+        The diffusion batch size, by default 1
+
+    Returns
+    -------
+    torch.Tensor
+        Resolved loss
+
+    """
+
+    # extract necessary features
+    token_to_rep_atom = feats["token_to_rep_atom"]
+    token_to_rep_atom = token_to_rep_atom.repeat_interleave(multiplicity, 0).float()
+    ref_mask = torch.bmm(
+        token_to_rep_atom, true_coords_resolved_mask.unsqueeze(-1).float()
+    ).squeeze(-1)
+    pad_mask = feats["token_pad_mask"]
+    pad_mask = pad_mask.repeat_interleave(multiplicity, 0).float()
+
+    # compute loss
+    log_softmax_resolved = torch.nn.functional.log_softmax(pred_resolved, dim=-1)
+    errors = (
+        -ref_mask * log_softmax_resolved[:, :, 0]
+        - (1 - ref_mask) * log_softmax_resolved[:, :, 1]
+    )
+    loss = torch.sum(errors * pad_mask, dim=-1) / (1e-7 + torch.sum(pad_mask, dim=-1))
+
+    # Average over the batch dimension
+    loss = torch.mean(loss)
+
+    return loss
+
+
+def plddt_loss(
+    pred_lddt,
+    pred_atom_coords,
+    true_atom_coords,
+    true_coords_resolved_mask,
+    feats,
+    multiplicity=1,
+):
+    """Compute plddt loss.
+
+    Parameters
+    ----------
+    pred_lddt: torch.Tensor
+        The plddt logits
+    pred_atom_coords: torch.Tensor
+        The predicted atom coordinates
+    true_atom_coords: torch.Tensor
+        The atom coordinates after symmetry correction
+    true_coords_resolved_mask: torch.Tensor
+        The resolved mask after symmetry correction
+    feats: Dict[str, torch.Tensor]
+        Dictionary containing the model input
+    multiplicity: int, optional
+        The diffusion batch size, by default 1
+
+    Returns
+    -------
+    torch.Tensor
+        Plddt loss
+
+    """
+
+    # extract necessary features
+    atom_mask = true_coords_resolved_mask
+
+    R_set_to_rep_atom = feats["r_set_to_rep_atom"]
+    R_set_to_rep_atom = R_set_to_rep_atom.repeat_interleave(multiplicity, 0).float()
+
+    token_type = feats["mol_type"]
+    token_type = token_type.repeat_interleave(multiplicity, 0)
+    is_nucleotide_token = (token_type == const.chain_type_ids["DNA"]).float() + (
+        token_type == const.chain_type_ids["RNA"]
+    ).float()
+
+    B = true_atom_coords.shape[0]
+
+    atom_to_token = feats["atom_to_token"].float()
+    atom_to_token = atom_to_token.repeat_interleave(multiplicity, 0)
+
+    token_to_rep_atom = feats["token_to_rep_atom"].float()
+    token_to_rep_atom = token_to_rep_atom.repeat_interleave(multiplicity, 0)
+
+    true_token_coords = torch.bmm(token_to_rep_atom, true_atom_coords)
+    pred_token_coords = torch.bmm(token_to_rep_atom, pred_atom_coords)
+
+    # compute true lddt
+    true_d = torch.cdist(
+        true_token_coords,
+        torch.bmm(R_set_to_rep_atom, true_atom_coords),
+    )
+    pred_d = torch.cdist(
+        pred_token_coords,
+        torch.bmm(R_set_to_rep_atom, pred_atom_coords),
+    )
+
+    # compute mask
+    pair_mask = atom_mask.unsqueeze(-1) * atom_mask.unsqueeze(-2)
+    pair_mask = (
+        pair_mask
+        * (1 - torch.eye(pair_mask.shape[1], device=pair_mask.device))[None, :, :]
+    )
+    pair_mask = torch.einsum("bnm,bkm->bnk", pair_mask, R_set_to_rep_atom)
+    pair_mask = torch.bmm(token_to_rep_atom, pair_mask)
+    atom_mask = torch.bmm(token_to_rep_atom, atom_mask.unsqueeze(-1).float())
+    is_nucleotide_R_element = torch.bmm(
+        R_set_to_rep_atom, torch.bmm(atom_to_token, is_nucleotide_token.unsqueeze(-1))
+    ).squeeze(-1)
+    cutoff = 15 + 15 * is_nucleotide_R_element.reshape(B, 1, -1).repeat(
+        1, true_d.shape[1], 1
+    )
+
+    # compute lddt
+    target_lddt, mask_no_match = lddt_dist(
+        pred_d, true_d, pair_mask, cutoff, per_atom=True
+    )
+
+    # compute loss
+    num_bins = pred_lddt.shape[-1]
+    bin_index = torch.floor(target_lddt * num_bins).long()
+    bin_index = torch.clamp(bin_index, max=(num_bins - 1))
+    lddt_one_hot = nn.functional.one_hot(bin_index, num_classes=num_bins)
+    errors = -1 * torch.sum(
+        lddt_one_hot * torch.nn.functional.log_softmax(pred_lddt, dim=-1),
+        dim=-1,
+    )
+    atom_mask = atom_mask.squeeze(-1)
+    loss = torch.sum(errors * atom_mask * mask_no_match, dim=-1) / (
+        1e-7 + torch.sum(atom_mask * mask_no_match, dim=-1)
+    )
+
+    # Average over the batch dimension
+    loss = torch.mean(loss)
+
+    return loss
+
+
+def pde_loss(
+    pred_pde,
+    pred_atom_coords,
+    true_atom_coords,
+    true_coords_resolved_mask,
+    feats,
+    multiplicity=1,
+    max_dist=32.0,
+):
+    """Compute pde loss.
+
+    Parameters
+    ----------
+    pred_pde: torch.Tensor
+        The pde logits
+    pred_atom_coords: torch.Tensor
+        The predicted atom coordinates
+    true_atom_coords: torch.Tensor
+        The atom coordinates after symmetry correction
+    true_coords_resolved_mask: torch.Tensor
+        The resolved mask after symmetry correction
+    feats: Dict[str, torch.Tensor]
+        Dictionary containing the model input
+    multiplicity: int, optional
+        The diffusion batch size, by default 1
+
+    Returns
+    -------
+    torch.Tensor
+        Pde loss
+
+    """
+
+    # extract necessary features
+    token_to_rep_atom = feats["token_to_rep_atom"]
+    token_to_rep_atom = token_to_rep_atom.repeat_interleave(multiplicity, 0).float()
+    token_mask = torch.bmm(
+        token_to_rep_atom, true_coords_resolved_mask.unsqueeze(-1).float()
+    ).squeeze(-1)
+    mask = token_mask.unsqueeze(-1) * token_mask.unsqueeze(-2)
+
+    # compute true pde
+    true_token_coords = torch.bmm(token_to_rep_atom, true_atom_coords)
+    pred_token_coords = torch.bmm(token_to_rep_atom, pred_atom_coords)
+
+    true_d = torch.cdist(true_token_coords, true_token_coords)
+    pred_d = torch.cdist(pred_token_coords, pred_token_coords)
+    target_pde = torch.abs(true_d - pred_d)
+
+    # compute loss
+    num_bins = pred_pde.shape[-1]
+    bin_index = torch.floor(target_pde * num_bins / max_dist).long()
+    bin_index = torch.clamp(bin_index, max=(num_bins - 1))
+    pde_one_hot = nn.functional.one_hot(bin_index, num_classes=num_bins)
+    errors = -1 * torch.sum(
+        pde_one_hot * torch.nn.functional.log_softmax(pred_pde, dim=-1),
+        dim=-1,
+    )
+    loss = torch.sum(errors * mask, dim=(-2, -1)) / (
+        1e-7 + torch.sum(mask, dim=(-2, -1))
+    )
+
+    # Average over the batch dimension
+    loss = torch.mean(loss)
+
+    return loss
+
+
+def pae_loss(
+    pred_pae,
+    pred_atom_coords,
+    true_atom_coords,
+    true_coords_resolved_mask,
+    feats,
+    multiplicity=1,
+    max_dist=32.0,
+):
+    """Compute pae loss.
+
+    Parameters
+    ----------
+    pred_pae: torch.Tensor
+        The pae logits
+    pred_atom_coords: torch.Tensor
+        The predicted atom coordinates
+    true_atom_coords: torch.Tensor
+        The atom coordinates after symmetry correction
+    true_coords_resolved_mask: torch.Tensor
+        The resolved mask after symmetry correction
+    feats: Dict[str, torch.Tensor]
+        Dictionary containing the model input
+    multiplicity: int, optional
+        The diffusion batch size, by default 1
+
+    Returns
+    -------
+    torch.Tensor
+        Pae loss
+
+    """
+    # Retrieve frames and resolved masks
+    frames_idx_original = feats["frames_idx"]
+    mask_frame_true = feats["frame_resolved_mask"]
+
+    # Adjust the frames for nonpolymers after symmetry correction!
+    # NOTE: frames of polymers do not change under symmetry!
+    frames_idx_true, mask_collinear_true = compute_frame_pred(
+        true_atom_coords,
+        frames_idx_original,
+        feats,
+        multiplicity,
+        resolved_mask=true_coords_resolved_mask,
+    )
+
+    frame_true_atom_a, frame_true_atom_b, frame_true_atom_c = (
+        frames_idx_true[:, :, :, 0],
+        frames_idx_true[:, :, :, 1],
+        frames_idx_true[:, :, :, 2],
+    )
+    # Compute token coords in true frames
+    B, N, _ = true_atom_coords.shape
+    true_atom_coords = true_atom_coords.reshape(B // multiplicity, multiplicity, -1, 3)
+    true_coords_transformed = express_coordinate_in_frame(
+        true_atom_coords, frame_true_atom_a, frame_true_atom_b, frame_true_atom_c
+    )
+
+    # Compute pred frames and mask
+    frames_idx_pred, mask_collinear_pred = compute_frame_pred(
+        pred_atom_coords, frames_idx_original, feats, multiplicity
+    )
+    frame_pred_atom_a, frame_pred_atom_b, frame_pred_atom_c = (
+        frames_idx_pred[:, :, :, 0],
+        frames_idx_pred[:, :, :, 1],
+        frames_idx_pred[:, :, :, 2],
+    )
+    # Compute token coords in pred frames
+    B, N, _ = pred_atom_coords.shape
+    pred_atom_coords = pred_atom_coords.reshape(B // multiplicity, multiplicity, -1, 3)
+    pred_coords_transformed = express_coordinate_in_frame(
+        pred_atom_coords, frame_pred_atom_a, frame_pred_atom_b, frame_pred_atom_c
+    )
+
+    target_pae = torch.sqrt(
+        ((true_coords_transformed - pred_coords_transformed) ** 2).sum(-1) + 1e-8
+    )
+
+    # Compute mask for the pae loss
+    b_true_resolved_mask = true_coords_resolved_mask[
+        torch.arange(B // multiplicity)[:, None, None].to(
+            pred_coords_transformed.device
+        ),
+        frame_true_atom_b,
+    ]
+
+    pair_mask = (
+        mask_frame_true[:, None, :, None]  # if true frame is invalid
+        * mask_collinear_true[:, :, :, None]  # if true frame is invalid
+        * mask_collinear_pred[:, :, :, None]  # if pred frame is invalid
+        * b_true_resolved_mask[:, :, None, :]  # If atom j is not resolved
+        * feats["token_pad_mask"][:, None, :, None]
+        * feats["token_pad_mask"][:, None, None, :]
+    )
+
+    # compute loss
+    num_bins = pred_pae.shape[-1]
+    bin_index = torch.floor(target_pae * num_bins / max_dist).long()
+    bin_index = torch.clamp(bin_index, max=(num_bins - 1))
+    pae_one_hot = nn.functional.one_hot(bin_index, num_classes=num_bins)
+    errors = -1 * torch.sum(
+        pae_one_hot
+        * torch.nn.functional.log_softmax(pred_pae.reshape(pae_one_hot.shape), dim=-1),
+        dim=-1,
+    )
+    loss = torch.sum(errors * pair_mask, dim=(-2, -1)) / (
+        1e-7 + torch.sum(pair_mask, dim=(-2, -1))
+    )
+    # Average over the batch dimension
+    loss = torch.mean(loss)
+
+    return loss
+
+
+def lddt_dist(dmat_predicted, dmat_true, mask, cutoff=15.0, per_atom=False):
+    # NOTE: the mask is a pairwise mask which should have the identity elements already masked out
+    # Compute mask over distances
+    dists_to_score = (dmat_true < cutoff).float() * mask
+    dist_l1 = torch.abs(dmat_true - dmat_predicted)
+
+    score = 0.25 * (
+        (dist_l1 < 0.5).float()
+        + (dist_l1 < 1.0).float()
+        + (dist_l1 < 2.0).float()
+        + (dist_l1 < 4.0).float()
+    )
+
+    # Normalize over the appropriate axes.
+    if per_atom:
+        mask_no_match = torch.sum(dists_to_score, dim=-1) != 0
+        norm = 1.0 / (1e-10 + torch.sum(dists_to_score, dim=-1))
+        score = norm * (1e-10 + torch.sum(dists_to_score * score, dim=-1))
+        return score, mask_no_match.float()
+    else:
+        norm = 1.0 / (1e-10 + torch.sum(dists_to_score, dim=(-2, -1)))
+        score = norm * (1e-10 + torch.sum(dists_to_score * score, dim=(-2, -1)))
+        total = torch.sum(dists_to_score, dim=(-1, -2))
+        return score, total
+
+
+def express_coordinate_in_frame(atom_coords, frame_atom_a, frame_atom_b, frame_atom_c):
+    batch, multiplicity = atom_coords.shape[0], atom_coords.shape[1]
+    batch_indices0 = torch.arange(batch)[:, None, None].to(atom_coords.device)
+    batch_indices1 = torch.arange(multiplicity)[None, :, None].to(atom_coords.device)
+
+    # extract frame atoms
+    a, b, c = (
+        atom_coords[batch_indices0, batch_indices1, frame_atom_a],
+        atom_coords[batch_indices0, batch_indices1, frame_atom_b],
+        atom_coords[batch_indices0, batch_indices1, frame_atom_c],
+    )
+    w1 = (a - b) / (torch.norm(a - b, dim=-1, keepdim=True) + 1e-5)
+    w2 = (c - b) / (torch.norm(c - b, dim=-1, keepdim=True) + 1e-5)
+
+    # build orthogonal frame
+    e1 = (w1 + w2) / (torch.norm(w1 + w2, dim=-1, keepdim=True) + 1e-5)
+    e2 = (w2 - w1) / (torch.norm(w2 - w1, dim=-1, keepdim=True) + 1e-5)
+    e3 = torch.linalg.cross(e1, e2)
+
+    # project onto frame basis
+    d = b[:, :, None, :, :] - b[:, :, :, None, :]
+    x_transformed = torch.cat(
+        [
+            torch.sum(d * e1[:, :, :, None, :], dim=-1, keepdim=True),
+            torch.sum(d * e2[:, :, :, None, :], dim=-1, keepdim=True),
+            torch.sum(d * e3[:, :, :, None, :], dim=-1, keepdim=True),
+        ],
+        dim=-1,
+    )
+    return x_transformed
+
+
+def compute_collinear_mask(v1, v2):
+    # Compute the mask for collinear or overlapping atoms
+    norm1 = torch.norm(v1, dim=1, keepdim=True)
+    norm2 = torch.norm(v2, dim=1, keepdim=True)
+    v1 = v1 / (norm1 + 1e-6)
+    v2 = v2 / (norm2 + 1e-6)
+    mask_angle = torch.abs(torch.sum(v1 * v2, dim=1)) < 0.9063
+    mask_overlap1 = norm1.reshape(-1) > 1e-2
+    mask_overlap2 = norm2.reshape(-1) > 1e-2
+    return mask_angle & mask_overlap1 & mask_overlap2
+
+
+def compute_frame_pred(
+    pred_atom_coords,
+    frames_idx_true,
+    feats,
+    multiplicity,
+    resolved_mask=None,
+    inference=False,
+):
+    # extract necessary features
+    asym_id_token = feats["asym_id"]
+    asym_id_atom = torch.bmm(
+        feats["atom_to_token"].float(), asym_id_token.unsqueeze(-1).float()
+    ).squeeze(-1)
+    B, N, _ = pred_atom_coords.shape
+    pred_atom_coords = pred_atom_coords.reshape(B // multiplicity, multiplicity, -1, 3)
+    frames_idx_pred = (
+        frames_idx_true.clone()
+        .repeat_interleave(multiplicity, 0)
+        .reshape(B // multiplicity, multiplicity, -1, 3)
+    )
+
+    # Iterate through the batch and update the frames for nonpolymers
+    for i, pred_atom_coord in enumerate(pred_atom_coords):
+        token_idx = 0
+        atom_idx = 0
+        for id in torch.unique(asym_id_token[i]):
+            mask_chain_token = (asym_id_token[i] == id) * feats["token_pad_mask"][i]
+            mask_chain_atom = (asym_id_atom[i] == id) * feats["atom_pad_mask"][i]
+            num_tokens = int(mask_chain_token.sum().item())
+            num_atoms = int(mask_chain_atom.sum().item())
+            if (
+                feats["mol_type"][i, token_idx] != const.chain_type_ids["NONPOLYMER"]
+                or num_atoms < 3
+            ):
+                token_idx += num_tokens
+                atom_idx += num_atoms
+                continue
+            dist_mat = (
+                (
+                    pred_atom_coord[:, mask_chain_atom.bool()][:, None, :, :]
+                    - pred_atom_coord[:, mask_chain_atom.bool()][:, :, None, :]
+                )
+                ** 2
+            ).sum(-1) ** 0.5
+
+            # Sort the atoms by distance
+            if inference:
+                resolved_pair = 1 - (
+                    feats["atom_pad_mask"][i][mask_chain_atom.bool()][None, :]
+                    * feats["atom_pad_mask"][i][mask_chain_atom.bool()][:, None]
+                ).to(torch.float32)
+                resolved_pair[resolved_pair == 1] = torch.inf
+                indices = torch.sort(dist_mat + resolved_pair, axis=2).indices
+            else:
+                if resolved_mask is None:
+                    resolved_mask = feats["atom_resolved_mask"]
+                resolved_pair = 1 - (
+                    resolved_mask[i][mask_chain_atom.bool()][None, :]
+                    * resolved_mask[i][mask_chain_atom.bool()][:, None]
+                ).to(torch.float32)
+                resolved_pair[resolved_pair == 1] = torch.inf
+                indices = torch.sort(dist_mat + resolved_pair, axis=2).indices
+
+            # Compute the frames
+            frames = (
+                torch.cat(
+                    [
+                        indices[:, :, 1:2],
+                        indices[:, :, 0:1],
+                        indices[:, :, 2:3],
+                    ],
+                    dim=2,
+                )
+                + atom_idx
+            )
+            frames_idx_pred[i, :, token_idx : token_idx + num_atoms, :] = frames
+            token_idx += num_tokens
+            atom_idx += num_atoms
+
+    # Expand the frames with the multiplicity
+    frames_expanded = pred_atom_coords[
+        torch.arange(0, B // multiplicity, 1)[:, None, None, None].to(
+            frames_idx_pred.device
+        ),
+        torch.arange(0, multiplicity, 1)[None, :, None, None].to(
+            frames_idx_pred.device
+        ),
+        frames_idx_pred,
+    ].reshape(-1, 3, 3)
+
+    # Compute masks for collinear or overlapping atoms in the frame
+    mask_collinear_pred = compute_collinear_mask(
+        frames_expanded[:, 1] - frames_expanded[:, 0],
+        frames_expanded[:, 1] - frames_expanded[:, 2],
+    ).reshape(B // multiplicity, multiplicity, -1)
+
+    return frames_idx_pred, mask_collinear_pred * feats["token_pad_mask"][:, None, :]
diff --git a/forks/boltz/src/boltz/model/loss/confidencev2.py b/forks/boltz/src/boltz/model/loss/confidencev2.py
new file mode 100644
index 00000000..9f641ba4
--- /dev/null
+++ b/forks/boltz/src/boltz/model/loss/confidencev2.py
@@ -0,0 +1,621 @@
+import torch
+from torch import nn
+
+from boltz.data import const
+from boltz.model.layers.confidence_utils import compute_frame_pred, tm_function
+
+
+def confidence_loss(
+    model_out,
+    feats,
+    true_coords,
+    true_coords_resolved_mask,
+    token_level_confidence=False,
+    multiplicity=1,
+    alpha_pae=0.0,
+    mask_loss=None,
+    relative_supervision_weight=0.0,
+):
+    # TODO no support for MD yet!
+    # TODO only apply to the PDB structures not the distillation ones
+    plddt, rel_plddt = plddt_loss(
+        model_out["plddt_logits"],
+        model_out["sample_atom_coords"],
+        feats,
+        true_coords,
+        true_coords_resolved_mask,
+        token_level_confidence=token_level_confidence,
+        multiplicity=multiplicity,
+        mask_loss=mask_loss,
+        relative_confidence_supervision=relative_supervision_weight > 0.0,
+        relative_pred_lddt=model_out.get("relative_plddt_logits", None),
+    )
+    pde, rel_pde = pde_loss(
+        model_out["pde_logits"],
+        model_out["sample_atom_coords"],
+        feats,
+        true_coords,
+        true_coords_resolved_mask,
+        multiplicity,
+        mask_loss=mask_loss,
+        relative_confidence_supervision=relative_supervision_weight > 0.0,
+        relative_pred_pde=model_out.get("relative_pde_logits", None),
+    )
+    resolved = resolved_loss(
+        model_out["resolved_logits"],
+        feats,
+        true_coords_resolved_mask,
+        token_level_confidence=token_level_confidence,
+        multiplicity=multiplicity,
+        mask_loss=mask_loss,
+    )
+
+    pae, rel_pae = 0.0, 0.0
+    if alpha_pae > 0.0:
+        pae, rel_pae = pae_loss(
+            model_out["pae_logits"],
+            model_out["sample_atom_coords"],
+            feats,
+            true_coords,
+            true_coords_resolved_mask,
+            multiplicity,
+            mask_loss=mask_loss,
+            relative_confidence_supervision=relative_supervision_weight > 0.0,
+            relative_pred_pae=model_out.get("relative_pae_logits", None),
+        )
+
+    loss = (
+        plddt
+        + pde
+        + resolved
+        + alpha_pae * pae
+        + relative_supervision_weight * (rel_plddt + rel_pde + alpha_pae * rel_pae)
+    )
+
+    dict_out = {
+        "loss": loss,
+        "loss_breakdown": {
+            "plddt_loss": plddt,
+            "pde_loss": pde,
+            "resolved_loss": resolved,
+            "pae_loss": pae,
+            "rel_plddt_loss": rel_plddt,
+            "rel_pde_loss": rel_pde,
+            "rel_pae_loss": rel_pae,
+        },
+    }
+    return dict_out
+
+
+def resolved_loss(
+    pred_resolved,
+    feats,
+    true_coords_resolved_mask,
+    token_level_confidence=False,
+    multiplicity=1,
+    mask_loss=None,
+):
+    with torch.autocast("cuda", enabled=False):
+        if token_level_confidence:
+            token_to_rep_atom = feats["token_to_rep_atom"]
+            token_to_rep_atom = token_to_rep_atom.repeat_interleave(
+                multiplicity, 0
+            ).float()
+            ref_mask = torch.bmm(
+                token_to_rep_atom, true_coords_resolved_mask.unsqueeze(-1).float()
+            ).squeeze(-1)
+
+            pad_mask = feats["token_pad_mask"]
+            pad_mask = pad_mask.repeat_interleave(multiplicity, 0).float()
+        else:
+            ref_mask = true_coords_resolved_mask.float()
+            pad_mask = feats["atom_pad_mask"]
+            pad_mask = pad_mask.repeat_interleave(multiplicity, 0).float()
+        # compute loss
+        log_softmax_resolved = torch.nn.functional.log_softmax(
+            pred_resolved.float(), dim=-1
+        )
+        errors = (
+            -ref_mask * log_softmax_resolved[:, :, 0]
+            - (1 - ref_mask) * log_softmax_resolved[:, :, 1]
+        )
+        loss = torch.sum(errors * pad_mask, dim=-1) / (
+            1e-7 + torch.sum(pad_mask, dim=-1)
+        )
+
+        # Average over the batch dimension
+        if mask_loss is not None:
+            mask_loss = (
+                mask_loss.repeat_interleave(multiplicity, 0)
+                .reshape(-1, multiplicity)
+                .float()
+            )
+            loss = torch.sum(loss.reshape(-1, multiplicity) * mask_loss) / (
+                torch.sum(mask_loss) + 1e-7
+            )
+        else:
+            loss = torch.mean(loss)
+    return loss
+
+
+def get_target_lddt(
+    pred_atom_coords,
+    feats,
+    true_atom_coords,
+    true_coords_resolved_mask,
+    token_level_confidence=True,
+    multiplicity=1,
+):
+    with torch.cuda.amp.autocast(enabled=False):
+        # extract necessary features
+        atom_mask = true_coords_resolved_mask
+
+        R_set_to_rep_atom = feats["r_set_to_rep_atom"]
+        R_set_to_rep_atom = R_set_to_rep_atom.repeat_interleave(multiplicity, 0).float()
+
+        token_type = feats["mol_type"]
+        token_type = token_type.repeat_interleave(multiplicity, 0)
+        is_nucleotide_token = (token_type == const.chain_type_ids["DNA"]).float() + (
+            token_type == const.chain_type_ids["RNA"]
+        ).float()
+
+        B = true_atom_coords.shape[0]
+
+        atom_to_token = feats["atom_to_token"].float()
+        atom_to_token = atom_to_token.repeat_interleave(multiplicity, 0)
+
+        token_to_rep_atom = feats["token_to_rep_atom"].float()
+        token_to_rep_atom = token_to_rep_atom.repeat_interleave(multiplicity, 0)
+
+        if token_level_confidence:
+            true_token_coords = torch.bmm(token_to_rep_atom, true_atom_coords)
+            pred_token_coords = torch.bmm(token_to_rep_atom, pred_atom_coords)
+
+        # compute true lddt
+        true_d = torch.cdist(
+            true_token_coords if token_level_confidence else true_atom_coords,
+            torch.bmm(R_set_to_rep_atom, true_atom_coords),
+        )
+        pred_d = torch.cdist(
+            pred_token_coords if token_level_confidence else pred_atom_coords,
+            torch.bmm(R_set_to_rep_atom, pred_atom_coords),
+        )
+
+        pair_mask = atom_mask.unsqueeze(-1) * atom_mask.unsqueeze(-2)
+        pair_mask = (
+            pair_mask
+            * (1 - torch.eye(pair_mask.shape[1], device=pair_mask.device))[None, :, :]
+        )
+        pair_mask = torch.einsum("bnm,bkm->bnk", pair_mask, R_set_to_rep_atom)
+
+        if token_level_confidence:
+            pair_mask = torch.bmm(token_to_rep_atom, pair_mask)
+            atom_mask = torch.bmm(token_to_rep_atom, atom_mask.unsqueeze(-1).float())
+        is_nucleotide_R_element = torch.bmm(
+            R_set_to_rep_atom,
+            torch.bmm(atom_to_token, is_nucleotide_token.unsqueeze(-1).float()),
+        ).squeeze(-1)
+        cutoff = 15 + 15 * is_nucleotide_R_element.reshape(B, 1, -1).repeat(
+            1, true_d.shape[1], 1
+        )
+        target_lddt, mask_no_match = lddt_dist(
+            pred_d, true_d, pair_mask, cutoff, per_atom=True
+        )
+        return target_lddt, mask_no_match, atom_mask
+
+
+def plddt_loss(
+    pred_lddt,
+    pred_atom_coords,
+    feats,
+    true_atom_coords,
+    true_coords_resolved_mask,
+    token_level_confidence=False,
+    multiplicity=1,
+    mask_loss=None,
+    relative_confidence_supervision=False,
+    relative_pred_lddt=None,
+):
+    target_lddt, mask_no_match, atom_mask = get_target_lddt(
+        pred_atom_coords=pred_atom_coords,
+        feats=feats,
+        true_atom_coords=true_atom_coords,
+        true_coords_resolved_mask=true_coords_resolved_mask,
+        token_level_confidence=token_level_confidence,
+        multiplicity=multiplicity,
+    )
+
+    num_bins = pred_lddt.shape[-1]
+    bin_index = torch.floor(target_lddt * num_bins).long()
+    bin_index = torch.clamp(bin_index, max=(num_bins - 1))
+    lddt_one_hot = nn.functional.one_hot(bin_index, num_classes=num_bins)
+    errors = -1 * torch.sum(
+        lddt_one_hot * torch.nn.functional.log_softmax(pred_lddt, dim=-1),
+        dim=-1,
+    )
+    atom_mask = atom_mask.squeeze(-1)
+    loss = torch.sum(errors * atom_mask * mask_no_match, dim=-1) / (
+        1e-7 + torch.sum(atom_mask * mask_no_match, dim=-1)
+    )
+    # Average over the batch dimension
+    if mask_loss is not None:
+        mask_loss = mask_loss.repeat_interleave(multiplicity, 0).reshape(
+            -1, multiplicity
+        )
+        loss = torch.sum(loss.reshape(-1, multiplicity) * mask_loss) / (
+            torch.sum(mask_loss) + 1e-7
+        )
+    else:
+        loss = torch.mean(loss)
+
+    rel_loss = 0.0
+    if relative_confidence_supervision:
+        # relative LDDT loss
+        B = true_atom_coords.shape[0]
+        relative_target_lddt = target_lddt.view(
+            B // multiplicity, multiplicity, 1, -1
+        ) - target_lddt.view(B // multiplicity, 1, multiplicity, -1)
+        rel_bin_index = torch.floor(
+            torch.abs(relative_target_lddt) * num_bins
+        ).long() * torch.sign(relative_target_lddt)
+        rel_bin_index = torch.clamp(
+            rel_bin_index, max=(num_bins - 1), min=-(num_bins - 1)
+        ).long() + (num_bins - 1)
+        rel_lddt_one_hot = nn.functional.one_hot(
+            rel_bin_index, num_classes=2 * num_bins - 1
+        )
+        rel_errors = -1 * torch.sum(
+            rel_lddt_one_hot
+            * torch.nn.functional.log_softmax(relative_pred_lddt, dim=-1),
+            dim=-1,
+        )
+        rel_atom_mask = atom_mask.view(B // multiplicity, multiplicity, 1, -1).repeat(
+            1, 1, multiplicity, 1
+        )
+        rel_mask_no_match = mask_no_match.view(
+            B // multiplicity, multiplicity, 1, -1
+        ).repeat(1, 1, multiplicity, 1)
+        rel_loss = torch.sum(rel_errors * rel_atom_mask * rel_mask_no_match, dim=-1) / (
+            1e-7 + torch.sum(rel_atom_mask * rel_mask_no_match, dim=-1)
+        )
+
+        if mask_loss is not None:
+            rel_mask_loss = mask_loss.view(B // multiplicity, multiplicity, 1).repeat(
+                1, 1, multiplicity
+            )
+            rel_loss = torch.sum(rel_loss * rel_mask_loss) / (
+                torch.sum(rel_mask_loss) + 1e-7
+            )
+        else:
+            rel_loss = torch.mean(rel_loss)
+
+    return loss, rel_loss
+
+
+def lddt_dist(dmat_predicted, dmat_true, mask, cutoff=15.0, per_atom=False):
+    # NOTE: the mask is a pairwise mask which should have the identity elements already masked out
+    # Compute mask over distances
+    dists_to_score = (dmat_true < cutoff).float() * mask
+    dist_l1 = torch.abs(dmat_true - dmat_predicted)
+
+    score = 0.25 * (
+        (dist_l1 < 0.5).float()
+        + (dist_l1 < 1.0).float()
+        + (dist_l1 < 2.0).float()
+        + (dist_l1 < 4.0).float()
+    )
+
+    # Normalize over the appropriate axes.
+    if per_atom:
+        mask_no_match = torch.sum(dists_to_score, dim=-1) != 0
+        norm = 1.0 / (1e-10 + torch.sum(dists_to_score, dim=-1))
+        score = norm * (1e-10 + torch.sum(dists_to_score * score, dim=-1))
+        return score, mask_no_match.float()
+    else:
+        norm = 1.0 / (1e-10 + torch.sum(dists_to_score, dim=(-2, -1)))
+        score = norm * (1e-10 + torch.sum(dists_to_score * score, dim=(-2, -1)))
+        total = torch.sum(dists_to_score, dim=(-1, -2))
+        return score, total
+
+
+def express_coordinate_in_frame(atom_coords, frame_atom_a, frame_atom_b, frame_atom_c):
+    batch, multiplicity = atom_coords.shape[0], atom_coords.shape[1]
+    batch_indices0 = torch.arange(batch)[:, None, None].to(atom_coords.device)
+    batch_indices1 = torch.arange(multiplicity)[None, :, None].to(atom_coords.device)
+
+    # extract frame atoms
+    a, b, c = (
+        atom_coords[batch_indices0, batch_indices1, frame_atom_a],
+        atom_coords[batch_indices0, batch_indices1, frame_atom_b],
+        atom_coords[batch_indices0, batch_indices1, frame_atom_c],
+    )
+    w1 = (a - b) / (torch.norm(a - b, dim=-1, keepdim=True) + 1e-5)
+    w2 = (c - b) / (torch.norm(c - b, dim=-1, keepdim=True) + 1e-5)
+
+    # build orthogonal frame
+    e1 = (w1 + w2) / (torch.norm(w1 + w2, dim=-1, keepdim=True) + 1e-5)
+    e2 = (w2 - w1) / (torch.norm(w2 - w1, dim=-1, keepdim=True) + 1e-5)
+    e3 = torch.linalg.cross(e1, e2)
+
+    # NOTE: it is unclear based on what atom of the token the error is computed, here I will use the atom indicated by b (center of frame)
+
+    # project onto frame basis
+    d = b[:, :, None, :, :] - b[:, :, :, None, :]
+    x_transformed = torch.cat(
+        [
+            torch.sum(d * e1[:, :, :, None, :], dim=-1, keepdim=True),
+            torch.sum(d * e2[:, :, :, None, :], dim=-1, keepdim=True),
+            torch.sum(d * e3[:, :, :, None, :], dim=-1, keepdim=True),
+        ],
+        dim=-1,
+    )
+    return x_transformed
+
+
+def get_target_pae(
+    pred_atom_coords,
+    feats,
+    true_atom_coords,
+    true_coords_resolved_mask,
+    multiplicity=1,
+):
+    with torch.cuda.amp.autocast(enabled=False):
+        # Retrieve frames and resolved masks
+        frames_idx_original = feats["frames_idx"]
+        mask_frame_true = feats["frame_resolved_mask"]
+
+        # Adjust the frames for nonpolymers after symmetry correction!
+        # NOTE: frames of polymers do not change under symmetry!
+        frames_idx_true, mask_collinear_true = compute_frame_pred(
+            true_atom_coords,
+            frames_idx_original,
+            feats,
+            multiplicity,
+            resolved_mask=true_coords_resolved_mask,
+        )
+
+        frame_true_atom_a, frame_true_atom_b, frame_true_atom_c = (
+            frames_idx_true[:, :, :, 0],
+            frames_idx_true[:, :, :, 1],
+            frames_idx_true[:, :, :, 2],
+        )
+        # Compute token coords in true frames
+        B, N, _ = true_atom_coords.shape
+        true_atom_coords = true_atom_coords.reshape(
+            B // multiplicity, multiplicity, -1, 3
+        )
+        true_coords_transformed = express_coordinate_in_frame(
+            true_atom_coords, frame_true_atom_a, frame_true_atom_b, frame_true_atom_c
+        )
+
+        # Compute pred frames and mask
+        frames_idx_pred, mask_collinear_pred = compute_frame_pred(
+            pred_atom_coords, frames_idx_original, feats, multiplicity
+        )
+        frame_pred_atom_a, frame_pred_atom_b, frame_pred_atom_c = (
+            frames_idx_pred[:, :, :, 0],
+            frames_idx_pred[:, :, :, 1],
+            frames_idx_pred[:, :, :, 2],
+        )
+        # Compute token coords in pred frames
+        B, N, _ = pred_atom_coords.shape
+        pred_atom_coords = pred_atom_coords.reshape(
+            B // multiplicity, multiplicity, -1, 3
+        )
+        pred_coords_transformed = express_coordinate_in_frame(
+            pred_atom_coords, frame_pred_atom_a, frame_pred_atom_b, frame_pred_atom_c
+        )
+
+        target_pae = torch.sqrt(
+            ((true_coords_transformed - pred_coords_transformed) ** 2).sum(-1) + 1e-8
+        )
+
+        # Compute mask for the pae loss
+        b_true_resolved_mask = true_coords_resolved_mask[
+            torch.arange(B // multiplicity)[:, None, None].to(
+                pred_coords_transformed.device
+            ),
+            frame_true_atom_b,
+        ]
+
+        pair_mask = (
+            mask_frame_true[:, None, :, None]  # if true frame is invalid
+            * mask_collinear_true[:, :, :, None]  # if true frame is invalid
+            * mask_collinear_pred[:, :, :, None]  # if pred frame is invalid
+            * b_true_resolved_mask[:, :, None, :]  # If atom j is not resolved
+            * feats["token_pad_mask"][:, None, :, None]
+            * feats["token_pad_mask"][:, None, None, :]
+        )
+        return target_pae, pair_mask
+
+
+def pae_loss(
+    pred_pae,
+    pred_atom_coords,
+    feats,
+    true_atom_coords,
+    true_coords_resolved_mask,
+    multiplicity=1,
+    max_dist=32.0,
+    mask_loss=None,
+    relative_confidence_supervision=False,
+    relative_pred_pae=None,
+):
+    target_pae, pair_mask = get_target_pae(
+        pred_atom_coords=pred_atom_coords,
+        feats=feats,
+        true_atom_coords=true_atom_coords,
+        true_coords_resolved_mask=true_coords_resolved_mask,
+        multiplicity=multiplicity,
+    )
+
+    # compute loss
+    num_bins = pred_pae.shape[-1]
+    bin_index = torch.floor(target_pae * num_bins / max_dist).long()
+    bin_index = torch.clamp(bin_index, max=(num_bins - 1))
+    pae_one_hot = nn.functional.one_hot(bin_index, num_classes=num_bins)
+    errors = -1 * torch.sum(
+        pae_one_hot
+        * torch.nn.functional.log_softmax(pred_pae.reshape(pae_one_hot.shape), dim=-1),
+        dim=-1,
+    )
+    loss = torch.sum(errors * pair_mask, dim=(-2, -1)) / (
+        1e-7 + torch.sum(pair_mask, dim=(-2, -1))
+    )
+    # Average over the batch dimension
+    if mask_loss is not None:
+        mask_loss = mask_loss.repeat_interleave(multiplicity, 0).reshape(
+            -1, multiplicity
+        )
+        loss = torch.sum(loss.reshape(-1, multiplicity) * mask_loss) / (
+            torch.sum(mask_loss) + 1e-7
+        )
+    else:
+        loss = torch.mean(loss)
+
+    rel_loss = 0.0
+    if relative_confidence_supervision:
+        B, N, _, _ = pred_pae.shape
+        rel_target_pae = target_pae.view(
+            B // multiplicity, multiplicity, 1, N, N
+        ) - target_pae.view(B // multiplicity, 1, multiplicity, N, N)
+        rel_bin_index = torch.floor(
+            torch.abs(rel_target_pae) * num_bins / max_dist
+        ).long() * torch.sign(rel_target_pae)
+        rel_bin_index = torch.clamp(
+            rel_bin_index, max=(num_bins - 1), min=-(num_bins - 1)
+        ).long() + (num_bins - 1)
+        rel_pae_one_hot = nn.functional.one_hot(
+            rel_bin_index, num_classes=2 * num_bins - 1
+        )
+        rel_errors = -1 * torch.sum(
+            rel_pae_one_hot
+            * torch.nn.functional.log_softmax(relative_pred_pae, dim=-1),
+            dim=-1,
+        )
+        rel_mask = pair_mask.view(B // multiplicity, multiplicity, 1, N, N).repeat(
+            1, 1, multiplicity, 1, 1
+        )
+        rel_loss = torch.sum(rel_errors * rel_mask, dim=(-2, -1)) / (
+            1e-7 + torch.sum(rel_mask, dim=(-2, -1))
+        )
+
+        if mask_loss is not None:
+            rel_mask_loss = mask_loss.view(B // multiplicity, multiplicity, 1).repeat(
+                1, 1, multiplicity
+            )
+            rel_loss = torch.sum(rel_loss * rel_mask_loss) / (
+                torch.sum(rel_mask_loss) + 1e-7
+            )
+        else:
+            rel_loss = torch.mean(rel_loss)
+
+    return loss, rel_loss
+
+
+def get_target_pde(
+    pred_atom_coords,
+    feats,
+    true_atom_coords,
+    true_coords_resolved_mask,
+    multiplicity=1,
+):
+    with torch.cuda.amp.autocast(enabled=False):
+        # extract necessary features
+        token_to_rep_atom = feats["token_to_rep_atom"]
+        token_to_rep_atom = token_to_rep_atom.repeat_interleave(multiplicity, 0).float()
+        token_mask = torch.bmm(
+            token_to_rep_atom, true_coords_resolved_mask.unsqueeze(-1).float()
+        ).squeeze(-1)
+        mask = token_mask.unsqueeze(-1) * token_mask.unsqueeze(-2)
+
+        # compute true pde
+        true_token_coords = torch.bmm(token_to_rep_atom, true_atom_coords)
+        pred_token_coords = torch.bmm(token_to_rep_atom, pred_atom_coords)
+
+        true_d = torch.cdist(true_token_coords, true_token_coords)
+        pred_d = torch.cdist(pred_token_coords, pred_token_coords)
+        target_pde = torch.abs(true_d - pred_d)
+        return target_pde, mask
+
+
+def pde_loss(
+    pred_pde,
+    pred_atom_coords,
+    feats,
+    true_atom_coords,
+    true_coords_resolved_mask,
+    multiplicity=1,
+    max_dist=32.0,
+    mask_loss=None,
+    relative_confidence_supervision=False,
+    relative_pred_pde=None,
+):
+    target_pde, mask = get_target_pde(
+        pred_atom_coords=pred_atom_coords,
+        feats=feats,
+        true_atom_coords=true_atom_coords,
+        true_coords_resolved_mask=true_coords_resolved_mask,
+        multiplicity=multiplicity,
+    )
+    # compute loss
+    num_bins = pred_pde.shape[-1]
+    bin_index = torch.floor(target_pde * num_bins / max_dist).long()
+    bin_index = torch.clamp(bin_index, max=(num_bins - 1))
+    pde_one_hot = nn.functional.one_hot(bin_index, num_classes=num_bins)
+    errors = -1 * torch.sum(
+        pde_one_hot * torch.nn.functional.log_softmax(pred_pde, dim=-1),
+        dim=-1,
+    )
+    loss = torch.sum(errors * mask, dim=(-2, -1)) / (
+        1e-7 + torch.sum(mask, dim=(-2, -1))
+    )
+    # Average over the batch dimension
+    if mask_loss is not None:
+        mask_loss = mask_loss.repeat_interleave(multiplicity, 0).reshape(
+            -1, multiplicity
+        )
+        loss = torch.sum(loss.reshape(-1, multiplicity) * mask_loss) / (
+            torch.sum(mask_loss) + 1e-7
+        )
+    else:
+        loss = torch.mean(loss)
+
+    rel_loss = 0.0
+    if relative_confidence_supervision:
+        B, N = target_pde.shape[:2]
+        rel_target_pde = target_pde.view(
+            B // multiplicity, multiplicity, 1, N, N
+        ) - target_pde.view(B // multiplicity, 1, multiplicity, N, N)
+        rel_bin_index = torch.floor(
+            torch.abs(rel_target_pde) * num_bins / max_dist
+        ).long() * torch.sign(rel_target_pde)
+        rel_bin_index = torch.clamp(
+            rel_bin_index, max=(num_bins - 1), min=-(num_bins - 1)
+        ).long() + (num_bins - 1)
+        rel_pde_one_hot = nn.functional.one_hot(
+            rel_bin_index, num_classes=2 * num_bins - 1
+        )
+        rel_errors = -1 * torch.sum(
+            rel_pde_one_hot
+            * torch.nn.functional.log_softmax(relative_pred_pde, dim=-1),
+            dim=-1,
+        )
+        rel_mask = mask.view(B // multiplicity, multiplicity, 1, N, N).repeat(
+            1, 1, multiplicity, 1, 1
+        )
+        rel_loss = torch.sum(rel_errors * rel_mask, dim=(-2, -1)) / (
+            1e-7 + torch.sum(rel_mask, dim=(-2, -1))
+        )
+
+        if mask_loss is not None:
+            rel_mask_loss = mask_loss.view(B // multiplicity, multiplicity, 1).repeat(
+                1, 1, multiplicity
+            )
+            rel_loss = torch.sum(rel_loss * rel_mask_loss) / (
+                torch.sum(rel_mask_loss) + 1e-7
+            )
+        else:
+            rel_loss = torch.mean(rel_loss)
+
+    return loss, rel_loss
diff --git a/forks/boltz/src/boltz/model/loss/diffusion.py b/forks/boltz/src/boltz/model/loss/diffusion.py
new file mode 100644
index 00000000..3433e429
--- /dev/null
+++ b/forks/boltz/src/boltz/model/loss/diffusion.py
@@ -0,0 +1,171 @@
+# started from code from https://github.com/lucidrains/alphafold3-pytorch, MIT License, Copyright (c) 2024 Phil Wang
+
+from einops import einsum
+import torch
+import torch.nn.functional as F
+
+
+def weighted_rigid_align(
+    true_coords,
+    pred_coords,
+    weights,
+    mask,
+):
+    """Compute weighted alignment.
+
+    Parameters
+    ----------
+    true_coords: torch.Tensor
+        The ground truth atom coordinates
+    pred_coords: torch.Tensor
+        The predicted atom coordinates
+    weights: torch.Tensor
+        The weights for alignment
+    mask: torch.Tensor
+        The atoms mask
+
+    Returns
+    -------
+    torch.Tensor
+        Aligned coordinates
+
+    """
+
+    batch_size, num_points, dim = true_coords.shape
+    weights = (mask * weights).unsqueeze(-1)
+
+    # Compute weighted centroids
+    true_centroid = (true_coords * weights).sum(dim=1, keepdim=True) / weights.sum(
+        dim=1, keepdim=True
+    )
+    pred_centroid = (pred_coords * weights).sum(dim=1, keepdim=True) / weights.sum(
+        dim=1, keepdim=True
+    )
+
+    # Center the coordinates
+    true_coords_centered = true_coords - true_centroid
+    pred_coords_centered = pred_coords - pred_centroid
+
+    if num_points < (dim + 1):
+        print(
+            "Warning: The size of one of the point clouds is <= dim+1. "
+            + "`WeightedRigidAlign` cannot return a unique rotation."
+        )
+
+    # Compute the weighted covariance matrix
+    cov_matrix = einsum(
+        weights * pred_coords_centered, true_coords_centered, "b n i, b n j -> b i j"
+    )
+
+    # Compute the SVD of the covariance matrix, required float32 for svd and determinant
+    original_dtype = cov_matrix.dtype
+    cov_matrix_32 = cov_matrix.to(dtype=torch.float32)
+    U, S, V = torch.linalg.svd(
+        cov_matrix_32, driver="gesvd" if cov_matrix_32.is_cuda else None
+    )
+    V = V.mH
+
+    # Catch ambiguous rotation by checking the magnitude of singular values
+    if (S.abs() <= 1e-15).any() and not (num_points < (dim + 1)):
+        print(
+            "Warning: Excessively low rank of "
+            + "cross-correlation between aligned point clouds. "
+            + "`WeightedRigidAlign` cannot return a unique rotation."
+        )
+
+    # Compute the rotation matrix
+    rot_matrix = torch.einsum("b i j, b k j -> b i k", U, V).to(dtype=torch.float32)
+
+    # Ensure proper rotation matrix with determinant 1
+    F = torch.eye(dim, dtype=cov_matrix_32.dtype, device=cov_matrix.device)[
+        None
+    ].repeat(batch_size, 1, 1)
+    F[:, -1, -1] = torch.det(rot_matrix)
+    rot_matrix = einsum(U, F, V, "b i j, b j k, b l k -> b i l")
+    rot_matrix = rot_matrix.to(dtype=original_dtype)
+
+    # Apply the rotation and translation
+    aligned_coords = (
+        einsum(true_coords_centered, rot_matrix, "b n i, b j i -> b n j")
+        + pred_centroid
+    )
+    aligned_coords.detach_()
+
+    return aligned_coords
+
+
+def smooth_lddt_loss(
+    pred_coords,
+    true_coords,
+    is_nucleotide,
+    coords_mask,
+    nucleic_acid_cutoff: float = 30.0,
+    other_cutoff: float = 15.0,
+    multiplicity: int = 1,
+):
+    """Compute weighted alignment.
+
+    Parameters
+    ----------
+    pred_coords: torch.Tensor
+        The predicted atom coordinates
+    true_coords: torch.Tensor
+        The ground truth atom coordinates
+    is_nucleotide: torch.Tensor
+        The weights for alignment
+    coords_mask: torch.Tensor
+        The atoms mask
+    nucleic_acid_cutoff: float
+        The nucleic acid cutoff
+    other_cutoff: float
+        The non nucleic acid cutoff
+    multiplicity: int
+        The multiplicity
+    Returns
+    -------
+    torch.Tensor
+        Aligned coordinates
+
+    """
+    B, N, _ = true_coords.shape
+    true_dists = torch.cdist(true_coords, true_coords)
+    is_nucleotide = is_nucleotide.repeat_interleave(multiplicity, 0)
+
+    coords_mask = coords_mask.repeat_interleave(multiplicity, 0)
+    is_nucleotide_pair = is_nucleotide.unsqueeze(-1).expand(
+        -1, -1, is_nucleotide.shape[-1]
+    )
+
+    mask = (
+        is_nucleotide_pair * (true_dists < nucleic_acid_cutoff).float()
+        + (1 - is_nucleotide_pair) * (true_dists < other_cutoff).float()
+    )
+    mask = mask * (1 - torch.eye(pred_coords.shape[1], device=pred_coords.device))
+    mask = mask * (coords_mask.unsqueeze(-1) * coords_mask.unsqueeze(-2))
+
+    # Compute distances between all pairs of atoms
+    pred_dists = torch.cdist(pred_coords, pred_coords)
+    dist_diff = torch.abs(true_dists - pred_dists)
+
+    # Compute epsilon values
+    eps = (
+        (
+            (
+                F.sigmoid(0.5 - dist_diff)
+                + F.sigmoid(1.0 - dist_diff)
+                + F.sigmoid(2.0 - dist_diff)
+                + F.sigmoid(4.0 - dist_diff)
+            )
+            / 4.0
+        )
+        .view(multiplicity, B // multiplicity, N, N)
+        .mean(dim=0)
+    )
+
+    # Calculate masked averaging
+    eps = eps.repeat_interleave(multiplicity, 0)
+    num = (eps * mask).sum(dim=(-1, -2))
+    den = mask.sum(dim=(-1, -2)).clamp(min=1)
+    lddt = num / den
+
+    return 1.0 - lddt.mean()
diff --git a/forks/boltz/src/boltz/model/loss/diffusionv2.py b/forks/boltz/src/boltz/model/loss/diffusionv2.py
new file mode 100644
index 00000000..457ab838
--- /dev/null
+++ b/forks/boltz/src/boltz/model/loss/diffusionv2.py
@@ -0,0 +1,139 @@
+# started from code from https://github.com/lucidrains/alphafold3-pytorch, MIT License, Copyright (c) 2024 Phil Wang
+
+import einx
+import torch
+import torch.nn.functional as F
+from einops import einsum, rearrange
+
+
+def weighted_rigid_align(
+    true_coords,  # Float['b n 3'],       #  true coordinates
+    pred_coords,  # Float['b n 3'],       # predicted coordinates
+    weights,  # Float['b n'],             # weights for each atom
+    mask,  # Bool['b n'] | None = None    # mask for variable lengths
+):  # -> Float['b n 3']:
+    """Algorithm 28 : note there is a problem with the pseudocode in the paper where predicted and
+    GT are swapped in algorithm 28, but correct in equation (2)."""
+
+    out_shape = torch.broadcast_shapes(true_coords.shape, pred_coords.shape)
+    *batch_size, num_points, dim = out_shape
+    weights = (mask * weights).unsqueeze(-1)
+
+    # Compute weighted centroids
+    true_centroid = (true_coords * weights).sum(dim=-2, keepdim=True) / weights.sum(
+        dim=-2, keepdim=True
+    )
+    pred_centroid = (pred_coords * weights).sum(dim=-2, keepdim=True) / weights.sum(
+        dim=-2, keepdim=True
+    )
+
+    # Center the coordinates
+    true_coords_centered = true_coords - true_centroid
+    pred_coords_centered = pred_coords - pred_centroid
+
+    if torch.any(mask.sum(dim=-1) < (dim + 1)):
+        print(
+            "Warning: The size of one of the point clouds is <= dim+1. "
+            + "`WeightedRigidAlign` cannot return a unique rotation."
+        )
+
+    # Compute the weighted covariance matrix
+    cov_matrix = einsum(
+        weights * pred_coords_centered,
+        true_coords_centered,
+        "... n i, ... n j -> ... i j",
+    )
+
+    # Compute the SVD of the covariance matrix, required float32 for svd and determinant
+    original_dtype = cov_matrix.dtype
+    cov_matrix_32 = cov_matrix.to(dtype=torch.float32)
+
+    U, S, V = torch.linalg.svd(
+        cov_matrix_32, driver="gesvd" if cov_matrix_32.is_cuda else None
+    )
+    V = V.mH
+
+    # Catch ambiguous rotation by checking the magnitude of singular values
+    if (S.abs() <= 1e-15).any() and not (num_points < (dim + 1)):
+        print(
+            "Warning: Excessively low rank of "
+            + "cross-correlation between aligned point clouds. "
+            + "`WeightedRigidAlign` cannot return a unique rotation."
+        )
+
+    # Compute the rotation matrix
+    rot_matrix = torch.einsum("... i j, ... k j -> ... i k", U, V).to(
+        dtype=torch.float32
+    )
+
+    # Ensure proper rotation matrix with determinant 1
+    F = torch.eye(dim, dtype=cov_matrix_32.dtype, device=cov_matrix.device)[
+        None
+    ].repeat(*batch_size, 1, 1)
+    F[..., -1, -1] = torch.det(rot_matrix)
+    rot_matrix = einsum(U, F, V, "... i j, ... j k, ... l k -> ... i l")
+    rot_matrix = rot_matrix.to(dtype=original_dtype)
+
+    # Apply the rotation and translation
+    aligned_coords = (
+        einsum(true_coords_centered, rot_matrix, "... n i, ... j i -> ... n j")
+        + pred_centroid
+    )
+    aligned_coords.detach_()
+
+    return aligned_coords
+
+
+def smooth_lddt_loss(
+    pred_coords,  # Float['b n 3'],
+    true_coords,  # Float['b n 3'],
+    is_nucleotide,  # Bool['b n'],
+    coords_mask,  # Bool['b n'] | None = None,
+    nucleic_acid_cutoff: float = 30.0,
+    other_cutoff: float = 15.0,
+    multiplicity: int = 1,
+):  # -> Float['']:
+    """Algorithm 27
+    pred_coords: predicted coordinates
+    true_coords: true coordinates
+    Note: for efficiency pred_coords is the only one with the multiplicity expanded
+    TODO: add weighing which overweight the smooth lddt contribution close to t=0 (not present in the paper)
+    """
+    lddt = []
+    for i in range(true_coords.shape[0]):
+        true_dists = torch.cdist(true_coords[i], true_coords[i])
+
+        is_nucleotide_i = is_nucleotide[i // multiplicity]
+        coords_mask_i = coords_mask[i // multiplicity]
+
+        is_nucleotide_pair = is_nucleotide_i.unsqueeze(-1).expand(
+            -1, is_nucleotide_i.shape[-1]
+        )
+
+        mask = is_nucleotide_pair * (true_dists < nucleic_acid_cutoff).float()
+        mask += (1 - is_nucleotide_pair) * (true_dists < other_cutoff).float()
+        mask *= 1 - torch.eye(pred_coords.shape[1], device=pred_coords.device)
+        mask *= coords_mask_i.unsqueeze(-1)
+        mask *= coords_mask_i.unsqueeze(-2)
+
+        valid_pairs = mask.nonzero()
+        true_dists_i = true_dists[valid_pairs[:, 0], valid_pairs[:, 1]]
+
+        pred_coords_i1 = pred_coords[i, valid_pairs[:, 0]]
+        pred_coords_i2 = pred_coords[i, valid_pairs[:, 1]]
+        pred_dists_i = F.pairwise_distance(pred_coords_i1, pred_coords_i2)
+
+        dist_diff_i = torch.abs(true_dists_i - pred_dists_i)
+
+        eps_i = (
+            F.sigmoid(0.5 - dist_diff_i)
+            + F.sigmoid(1.0 - dist_diff_i)
+            + F.sigmoid(2.0 - dist_diff_i)
+            + F.sigmoid(4.0 - dist_diff_i)
+        ) / 4.0
+
+        lddt_i = eps_i.sum() / (valid_pairs.shape[0] + 1e-5)
+        lddt.append(lddt_i)
+
+    # average over batch & multiplicity
+    return 1.0 - torch.stack(lddt, dim=0).mean(dim=0)
diff --git a/forks/boltz/src/boltz/model/loss/distogram.py b/forks/boltz/src/boltz/model/loss/distogram.py
new file mode 100644
index 00000000..6179d0a8
--- /dev/null
+++ b/forks/boltz/src/boltz/model/loss/distogram.py
@@ -0,0 +1,48 @@
+import torch
+from torch import Tensor
+
+
+def distogram_loss(
+    output: dict[str, Tensor],
+    feats: dict[str, Tensor],
+) -> tuple[Tensor, Tensor]:
+    """Compute the  distogram loss.
+
+    Parameters
+    ----------
+    output : Dict[str, Tensor]
+        Output of the model
+    feats : Dict[str, Tensor]
+        Input features
+
+    Returns
+    -------
+    Tensor
+        The globally averaged loss.
+    Tensor
+        Per example loss.
+
+    """
+    # Get predicted distograms
+    pred = output["pdistogram"]
+
+    # Compute target distogram
+    target = feats["disto_target"]
+
+    # Combine target mask and padding mask
+    mask = feats["token_disto_mask"]
+    mask = mask[:, None, :] * mask[:, :, None]
+    mask = mask * (1 - torch.eye(mask.shape[1])[None]).to(pred)
+
+    # Compute the distogram loss
+    errors = -1 * torch.sum(
+        target * torch.nn.functional.log_softmax(pred, dim=-1),
+        dim=-1,
+    )
+    denom = 1e-5 + torch.sum(mask, dim=(-1, -2))
+    mean = errors * mask
+    mean = torch.sum(mean, dim=-1)
+    mean = mean / denom[..., None]
+    batch_loss = torch.sum(mean, dim=-1)
+    global_loss = torch.mean(batch_loss)
+    return global_loss, batch_loss
diff --git a/forks/boltz/src/boltz/model/loss/distogramv2.py b/forks/boltz/src/boltz/model/loss/distogramv2.py
new file mode 100644
index 00000000..1a72a28a
--- /dev/null
+++ b/forks/boltz/src/boltz/model/loss/distogramv2.py
@@ -0,0 +1,105 @@
+import torch
+from torch import Tensor
+
+
+def distogram_loss(
+    output: dict[str, Tensor],
+    feats: dict[str, Tensor],
+    aggregate_distogram: bool = True,
+) -> tuple[Tensor, Tensor]:
+    """Compute the  distogram loss.
+
+    Parameters
+    ----------
+    output : Dict[str, Tensor]
+        Output of the model
+    feats : Dict[str, Tensor]
+        Input features
+
+    Returns
+    -------
+    Tensor
+        The globally averaged loss.
+    Tensor
+        Per example loss.
+
+    """
+    with torch.autocast("cuda", enabled=False):
+        # Get predicted distograms
+        pred = output["pdistogram"].float()  # (B, L, L, num_distograms, disto_bins)
+        D = pred.shape[3]  # num_distograms  # noqa: N806
+        assert len(pred.shape) == 5  # noqa: PLR2004
+
+        # Compute target distogram
+        target = feats["disto_target"]  # (B, L, L, K, disto_bins)
+        assert len(target.shape) == 5  # noqa: PLR2004
+
+        if aggregate_distogram:
+            msg = "Cannot aggregate GT distogram when num_distograms > 1"
+            assert pred.shape[3] == 1, msg
+
+            pred = pred.squeeze(3)  # (B, L, L, disto_bins)
+
+            # Aggregate distogram over K conformers
+            target = target.sum(dim=3)  # (B, L, L, disto_bins)
+
+            # Normalize distogram
+            P = target / target.sum(-1)[..., None].clamp(min=1)  # noqa: N806
+
+            # Combine target mask and padding mask
+            mask = feats["token_disto_mask"]
+            mask = mask[:, None, :] * mask[:, :, None]
+            mask = mask * (1 - torch.eye(mask.shape[1])[None]).to(pred)
+
+            # Compute the distogram loss
+            log_Q = torch.nn.functional.log_softmax(pred, dim=-1)  # noqa: N806
+            errors = -1 * torch.sum(
+                P * log_Q,
+                dim=-1,
+            )
+            denom = 1e-5 + torch.sum(mask, dim=(-1, -2))
+            mean = errors * mask
+            mean = torch.sum(mean, dim=-1)
+            mean = mean / denom[..., None]
+            batch_loss = torch.sum(mean, dim=-1)
+            global_loss = torch.mean(batch_loss)
+        else:
+            # We want to compute the loss for each pair of conformer K and predicted
+            # distogram
+
+            # Loop through conformers and compute the loss
+            batch_loss = []
+            for k in range(target.shape[3]):
+                # Get the target distogram for conformer k
+                # (B, L, L, K, disto_bins) -> (B, L, L, D, disto_bins)
+                P_k = target[:, :, :, k : k + 1, :].repeat_interleave(D, dim=3)  # noqa: N806
+
+                # Compute the distogram loss to all predicted distograms
+                log_Q = torch.nn.functional.log_softmax(pred, dim=-1)  # noqa: N806
+                errors = -1 * torch.sum(
+                    P_k * log_Q,
+                    dim=-1,
+                )  # (B, L, L, D)
+
+                # Compute mask
+                mask = feats["token_disto_mask"]
+                mask = mask[:, None, :] * mask[:, :, None]
+                mask = mask * (1 - torch.eye(mask.shape[1])[None]).to(pred)
+                mask = mask.unsqueeze(-1).repeat_interleave(D, -1)  # (B, L, L, D)
+
+                denom = 1e-5 + torch.sum(mask, dim=(-2, -3))  # (B, D)
+                mean = errors * mask
+                mean = torch.sum(mean, dim=-2)  # (B, L, D)
+                mean = mean / denom[..., None, :]
+                b_loss = torch.sum(mean, dim=-2)  # (B, D)
+
+                batch_loss.append(b_loss)
+
+            batch_loss = torch.stack(batch_loss, dim=1)  # (B, K, D)
+
+            # Compute the batch loss by taking the min over the predicted distograms
+            # and the average across conformers
+            batch_loss = torch.min(batch_loss, dim=-1).values.mean(dim=1)
+            global_loss = torch.mean(batch_loss)
+
+        return global_loss, batch_loss
diff --git a/forks/boltz/src/boltz/model/loss/validation.py b/forks/boltz/src/boltz/model/loss/validation.py
new file mode 100644
index 00000000..00d1aa7c
--- /dev/null
+++ b/forks/boltz/src/boltz/model/loss/validation.py
@@ -0,0 +1,1025 @@
+import torch
+
+from boltz.data import const
+from boltz.model.loss.confidence import (
+    compute_frame_pred,
+    express_coordinate_in_frame,
+    lddt_dist,
+)
+from boltz.model.loss.diffusion import weighted_rigid_align
+
+
+def factored_lddt_loss(
+    true_atom_coords,
+    pred_atom_coords,
+    feats,
+    atom_mask,
+    multiplicity=1,
+    cardinality_weighted=False,
+):
+    """Compute the lddt factorized into the different modalities.
+
+    Parameters
+    ----------
+    true_atom_coords : torch.Tensor
+        Ground truth atom coordinates after symmetry correction
+    pred_atom_coords : torch.Tensor
+        Predicted atom coordinates
+    feats : Dict[str, torch.Tensor]
+        Input features
+    atom_mask : torch.Tensor
+        Atom mask
+    multiplicity : int
+        Diffusion batch size, by default 1
+
+    Returns
+    -------
+    Dict[str, torch.Tensor]
+        The lddt for each modality
+    Dict[str, torch.Tensor]
+        The total number of pairs for each modality
+
+    """
+    # extract necessary features
+    atom_type = (
+        torch.bmm(
+            feats["atom_to_token"].float(), feats["mol_type"].unsqueeze(-1).float()
+        )
+        .squeeze(-1)
+        .long()
+    )
+    atom_type = atom_type.repeat_interleave(multiplicity, 0)
+
+    ligand_mask = (atom_type == const.chain_type_ids["NONPOLYMER"]).float()
+    dna_mask = (atom_type == const.chain_type_ids["DNA"]).float()
+    rna_mask = (atom_type == const.chain_type_ids["RNA"]).float()
+    protein_mask = (atom_type == const.chain_type_ids["PROTEIN"]).float()
+
+    nucleotide_mask = dna_mask + rna_mask
+
+    true_d = torch.cdist(true_atom_coords, true_atom_coords)
+    pred_d = torch.cdist(pred_atom_coords, pred_atom_coords)
+
+    pair_mask = atom_mask[:, :, None] * atom_mask[:, None, :]
+    pair_mask = (
+        pair_mask
+        * (1 - torch.eye(pair_mask.shape[1], device=pair_mask.device))[None, :, :]
+    )
+
+    cutoff = 15 + 15 * (
+        1 - (1 - nucleotide_mask[:, :, None]) * (1 - nucleotide_mask[:, None, :])
+    )
+
+    # compute different lddts
+    dna_protein_mask = pair_mask * (
+        dna_mask[:, :, None] * protein_mask[:, None, :]
+        + protein_mask[:, :, None] * dna_mask[:, None, :]
+    )
+    dna_protein_lddt, dna_protein_total = lddt_dist(
+        pred_d, true_d, dna_protein_mask, cutoff
+    )
+    del dna_protein_mask
+
+    rna_protein_mask = pair_mask * (
+        rna_mask[:, :, None] * protein_mask[:, None, :]
+        + protein_mask[:, :, None] * rna_mask[:, None, :]
+    )
+    rna_protein_lddt, rna_protein_total = lddt_dist(
+        pred_d, true_d, rna_protein_mask, cutoff
+    )
+    del rna_protein_mask
+
+    ligand_protein_mask = pair_mask * (
+        ligand_mask[:, :, None] * protein_mask[:, None, :]
+        + protein_mask[:, :, None] * ligand_mask[:, None, :]
+    )
+    ligand_protein_lddt, ligand_protein_total = lddt_dist(
+        pred_d, true_d, ligand_protein_mask, cutoff
+    )
+    del ligand_protein_mask
+
+    dna_ligand_mask = pair_mask * (
+        dna_mask[:, :, None] * ligand_mask[:, None, :]
+        + ligand_mask[:, :, None] * dna_mask[:, None, :]
+    )
+    dna_ligand_lddt, dna_ligand_total = lddt_dist(
+        pred_d, true_d, dna_ligand_mask, cutoff
+    )
+    del dna_ligand_mask
+
+    rna_ligand_mask = pair_mask * (
+        rna_mask[:, :, None] * ligand_mask[:, None, :]
+        + ligand_mask[:, :, None] * rna_mask[:, None, :]
+    )
+    rna_ligand_lddt, rna_ligand_total = lddt_dist(
+        pred_d, true_d, rna_ligand_mask, cutoff
+    )
+    del rna_ligand_mask
+
+    intra_dna_mask = pair_mask * (dna_mask[:, :, None] * dna_mask[:, None, :])
+    intra_dna_lddt, intra_dna_total = lddt_dist(pred_d, true_d, intra_dna_mask, cutoff)
+    del intra_dna_mask
+
+    intra_rna_mask = pair_mask * (rna_mask[:, :, None] * rna_mask[:, None, :])
+    intra_rna_lddt, intra_rna_total = lddt_dist(pred_d, true_d, intra_rna_mask, cutoff)
+    del intra_rna_mask
+
+    chain_id = feats["asym_id"]
+    atom_chain_id = (
+        torch.bmm(feats["atom_to_token"].float(), chain_id.unsqueeze(-1).float())
+        .squeeze(-1)
+        .long()
+    )
+    atom_chain_id = atom_chain_id.repeat_interleave(multiplicity, 0)
+    same_chain_mask = (atom_chain_id[:, :, None] == atom_chain_id[:, None, :]).float()
+
+    intra_ligand_mask = (
+        pair_mask
+        * same_chain_mask
+        * (ligand_mask[:, :, None] * ligand_mask[:, None, :])
+    )
+    intra_ligand_lddt, intra_ligand_total = lddt_dist(
+        pred_d, true_d, intra_ligand_mask, cutoff
+    )
+    del intra_ligand_mask
+
+    intra_protein_mask = (
+        pair_mask
+        * same_chain_mask
+        * (protein_mask[:, :, None] * protein_mask[:, None, :])
+    )
+    intra_protein_lddt, intra_protein_total = lddt_dist(
+        pred_d, true_d, intra_protein_mask, cutoff
+    )
+    del intra_protein_mask
+
+    protein_protein_mask = (
+        pair_mask
+        * (1 - same_chain_mask)
+        * (protein_mask[:, :, None] * protein_mask[:, None, :])
+    )
+    protein_protein_lddt, protein_protein_total = lddt_dist(
+        pred_d, true_d, protein_protein_mask, cutoff
+    )
+    del protein_protein_mask
+
+    lddt_dict = {
+        "dna_protein": dna_protein_lddt,
+        "rna_protein": rna_protein_lddt,
+        "ligand_protein": ligand_protein_lddt,
+        "dna_ligand": dna_ligand_lddt,
+        "rna_ligand": rna_ligand_lddt,
+        "intra_ligand": intra_ligand_lddt,
+        "intra_dna": intra_dna_lddt,
+        "intra_rna": intra_rna_lddt,
+        "intra_protein": intra_protein_lddt,
+        "protein_protein": protein_protein_lddt,
+    }
+
+    total_dict = {
+        "dna_protein": dna_protein_total,
+        "rna_protein": rna_protein_total,
+        "ligand_protein": ligand_protein_total,
+        "dna_ligand": dna_ligand_total,
+        "rna_ligand": rna_ligand_total,
+        "intra_ligand": intra_ligand_total,
+        "intra_dna": intra_dna_total,
+        "intra_rna": intra_rna_total,
+        "intra_protein": intra_protein_total,
+        "protein_protein": protein_protein_total,
+    }
+    if not cardinality_weighted:
+        for key in total_dict:
+            total_dict[key] = (total_dict[key] > 0.0).float()
+
+    return lddt_dict, total_dict
+
+
+def factored_token_lddt_dist_loss(true_d, pred_d, feats, cardinality_weighted=False):
+    """Compute the distogram lddt factorized into the different modalities.
+
+    Parameters
+    ----------
+    true_d : torch.Tensor
+        Ground truth atom distogram
+    pred_d : torch.Tensor
+        Predicted atom distogram
+    feats : Dict[str, torch.Tensor]
+        Input features
+
+    Returns
+    -------
+    Tensor
+        The lddt for each modality
+    Tensor
+        The total number of pairs for each modality
+
+    """
+    # extract necessary features
+    token_type = feats["mol_type"]
+
+    ligand_mask = (token_type == const.chain_type_ids["NONPOLYMER"]).float()
+    dna_mask = (token_type == const.chain_type_ids["DNA"]).float()
+    rna_mask = (token_type == const.chain_type_ids["RNA"]).float()
+    protein_mask = (token_type == const.chain_type_ids["PROTEIN"]).float()
+    nucleotide_mask = dna_mask + rna_mask
+
+    token_mask = feats["token_disto_mask"]
+    token_mask = token_mask[:, :, None] * token_mask[:, None, :]
+    token_mask = token_mask * (1 - torch.eye(token_mask.shape[1])[None]).to(token_mask)
+
+    cutoff = 15 + 15 * (
+        1 - (1 - nucleotide_mask[:, :, None]) * (1 - nucleotide_mask[:, None, :])
+    )
+
+    # compute different lddts
+    dna_protein_mask = token_mask * (
+        dna_mask[:, :, None] * protein_mask[:, None, :]
+        + protein_mask[:, :, None] * dna_mask[:, None, :]
+    )
+    dna_protein_lddt, dna_protein_total = lddt_dist(
+        pred_d, true_d, dna_protein_mask, cutoff
+    )
+
+    rna_protein_mask = token_mask * (
+        rna_mask[:, :, None] * protein_mask[:, None, :]
+        + protein_mask[:, :, None] * rna_mask[:, None, :]
+    )
+    rna_protein_lddt, rna_protein_total = lddt_dist(
+        pred_d, true_d, rna_protein_mask, cutoff
+    )
+
+    ligand_protein_mask = token_mask * (
+        ligand_mask[:, :, None] * protein_mask[:, None, :]
+        + protein_mask[:, :, None] * ligand_mask[:, None, :]
+    )
+    ligand_protein_lddt, ligand_protein_total = lddt_dist(
+        pred_d, true_d, ligand_protein_mask, cutoff
+    )
+
+    dna_ligand_mask = token_mask * (
+        dna_mask[:, :, None] * ligand_mask[:, None, :]
+        + ligand_mask[:, :, None] * dna_mask[:, None, :]
+    )
+    dna_ligand_lddt, dna_ligand_total = lddt_dist(
+        pred_d, true_d, dna_ligand_mask, cutoff
+    )
+
+    rna_ligand_mask = token_mask * (
+        rna_mask[:, :, None] * ligand_mask[:, None, :]
+        + ligand_mask[:, :, None] * rna_mask[:, None, :]
+    )
+    rna_ligand_lddt, rna_ligand_total = lddt_dist(
+        pred_d, true_d, rna_ligand_mask, cutoff
+    )
+
+    chain_id = feats["asym_id"]
+    same_chain_mask = (chain_id[:, :, None] == chain_id[:, None, :]).float()
+    intra_ligand_mask = (
+        token_mask
+        * same_chain_mask
+        * (ligand_mask[:, :, None] * ligand_mask[:, None, :])
+    )
+    intra_ligand_lddt, intra_ligand_total = lddt_dist(
+        pred_d, true_d, intra_ligand_mask, cutoff
+    )
+
+    intra_dna_mask = token_mask * (dna_mask[:, :, None] * dna_mask[:, None, :])
+    intra_dna_lddt, intra_dna_total = lddt_dist(pred_d, true_d, intra_dna_mask, cutoff)
+
+    intra_rna_mask = token_mask * (rna_mask[:, :, None] * rna_mask[:, None, :])
+    intra_rna_lddt, intra_rna_total = lddt_dist(pred_d, true_d, intra_rna_mask, cutoff)
+
+    chain_id = feats["asym_id"]
+    same_chain_mask = (chain_id[:, :, None] == chain_id[:, None, :]).float()
+
+    intra_protein_mask = (
+        token_mask
+        * same_chain_mask
+        * (protein_mask[:, :, None] * protein_mask[:, None, :])
+    )
+    intra_protein_lddt, intra_protein_total = lddt_dist(
+        pred_d, true_d, intra_protein_mask, cutoff
+    )
+
+    protein_protein_mask = (
+        token_mask
+        * (1 - same_chain_mask)
+        * (protein_mask[:, :, None] * protein_mask[:, None, :])
+    )
+    protein_protein_lddt, protein_protein_total = lddt_dist(
+        pred_d, true_d, protein_protein_mask, cutoff
+    )
+
+    lddt_dict = {
+        "dna_protein": dna_protein_lddt,
+        "rna_protein": rna_protein_lddt,
+        "ligand_protein": ligand_protein_lddt,
+        "dna_ligand": dna_ligand_lddt,
+        "rna_ligand": rna_ligand_lddt,
+        "intra_ligand": intra_ligand_lddt,
+        "intra_dna": intra_dna_lddt,
+        "intra_rna": intra_rna_lddt,
+        "intra_protein": intra_protein_lddt,
+        "protein_protein": protein_protein_lddt,
+    }
+
+    total_dict = {
+        "dna_protein": dna_protein_total,
+        "rna_protein": rna_protein_total,
+        "ligand_protein": ligand_protein_total,
+        "dna_ligand": dna_ligand_total,
+        "rna_ligand": rna_ligand_total,
+        "intra_ligand": intra_ligand_total,
+        "intra_dna": intra_dna_total,
+        "intra_rna": intra_rna_total,
+        "intra_protein": intra_protein_total,
+        "protein_protein": protein_protein_total,
+    }
+
+    if not cardinality_weighted:
+        for key in total_dict:
+            total_dict[key] = (total_dict[key] > 0.0).float()
+
+    return lddt_dict, total_dict
+
+
+def compute_plddt_mae(
+    pred_atom_coords,
+    feats,
+    true_atom_coords,
+    pred_lddt,
+    true_coords_resolved_mask,
+    multiplicity=1,
+):
+    """Compute the plddt mean absolute error.
+
+    Parameters
+    ----------
+    pred_atom_coords : torch.Tensor
+        Predicted atom coordinates
+    feats : torch.Tensor
+        Input features
+    true_atom_coords : torch.Tensor
+        Ground truth atom coordinates
+    pred_lddt : torch.Tensor
+        Predicted lddt
+    true_coords_resolved_mask : torch.Tensor
+        Resolved atom mask
+    multiplicity : int
+        Diffusion batch size, by default 1
+
+    Returns
+    -------
+    Tensor
+        The mae for each modality
+    Tensor
+        The total number of pairs for each modality
+
+    """
+    # extract necessary features
+    atom_mask = true_coords_resolved_mask
+    R_set_to_rep_atom = feats["r_set_to_rep_atom"]
+    R_set_to_rep_atom = R_set_to_rep_atom.repeat_interleave(multiplicity, 0).float()
+
+    token_type = feats["mol_type"]
+    token_type = token_type.repeat_interleave(multiplicity, 0)
+    is_nucleotide_token = (token_type == const.chain_type_ids["DNA"]).float() + (
+        token_type == const.chain_type_ids["RNA"]
+    ).float()
+
+    B = true_atom_coords.shape[0]
+
+    atom_to_token = feats["atom_to_token"].float()
+    atom_to_token = atom_to_token.repeat_interleave(multiplicity, 0)
+
+    token_to_rep_atom = feats["token_to_rep_atom"].float()
+    token_to_rep_atom = token_to_rep_atom.repeat_interleave(multiplicity, 0)
+
+    true_token_coords = torch.bmm(token_to_rep_atom, true_atom_coords)
+    pred_token_coords = torch.bmm(token_to_rep_atom, pred_atom_coords)
+
+    # compute true lddt
+    true_d = torch.cdist(
+        true_token_coords,
+        torch.bmm(R_set_to_rep_atom, true_atom_coords),
+    )
+    pred_d = torch.cdist(
+        pred_token_coords,
+        torch.bmm(R_set_to_rep_atom, pred_atom_coords),
+    )
+
+    pair_mask = atom_mask.unsqueeze(-1) * atom_mask.unsqueeze(-2)
+    pair_mask = (
+        pair_mask
+        * (1 - torch.eye(pair_mask.shape[1], device=pair_mask.device))[None, :, :]
+    )
+    pair_mask = torch.einsum("bnm,bkm->bnk", pair_mask, R_set_to_rep_atom)
+
+    pair_mask = torch.bmm(token_to_rep_atom, pair_mask)
+    atom_mask = torch.bmm(token_to_rep_atom, atom_mask.unsqueeze(-1).float()).squeeze(
+        -1
+    )
+    is_nucleotide_R_element = torch.bmm(
+        R_set_to_rep_atom, torch.bmm(atom_to_token, is_nucleotide_token.unsqueeze(-1))
+    ).squeeze(-1)
+    cutoff = 15 + 15 * is_nucleotide_R_element.reshape(B, 1, -1).repeat(
+        1, true_d.shape[1], 1
+    )
+
+    target_lddt, mask_no_match = lddt_dist(
+        pred_d, true_d, pair_mask, cutoff, per_atom=True
+    )
+
+    protein_mask = (
+        (token_type == const.chain_type_ids["PROTEIN"]).float()
+        * atom_mask
+        * mask_no_match
+    )
+    ligand_mask = (
+        (token_type == const.chain_type_ids["NONPOLYMER"]).float()
+        * atom_mask
+        * mask_no_match
+    )
+    dna_mask = (
+        (token_type == const.chain_type_ids["DNA"]).float() * atom_mask * mask_no_match
+    )
+    rna_mask = (
+        (token_type == const.chain_type_ids["RNA"]).float() * atom_mask * mask_no_match
+    )
+
+    protein_mae = torch.sum(torch.abs(target_lddt - pred_lddt) * protein_mask) / (
+        torch.sum(protein_mask) + 1e-5
+    )
+    protein_total = torch.sum(protein_mask)
+    ligand_mae = torch.sum(torch.abs(target_lddt - pred_lddt) * ligand_mask) / (
+        torch.sum(ligand_mask) + 1e-5
+    )
+    ligand_total = torch.sum(ligand_mask)
+    dna_mae = torch.sum(torch.abs(target_lddt - pred_lddt) * dna_mask) / (
+        torch.sum(dna_mask) + 1e-5
+    )
+    dna_total = torch.sum(dna_mask)
+    rna_mae = torch.sum(torch.abs(target_lddt - pred_lddt) * rna_mask) / (
+        torch.sum(rna_mask) + 1e-5
+    )
+    rna_total = torch.sum(rna_mask)
+
+    mae_plddt_dict = {
+        "protein": protein_mae,
+        "ligand": ligand_mae,
+        "dna": dna_mae,
+        "rna": rna_mae,
+    }
+    total_dict = {
+        "protein": protein_total,
+        "ligand": ligand_total,
+        "dna": dna_total,
+        "rna": rna_total,
+    }
+
+    return mae_plddt_dict, total_dict
+
+
+def compute_pde_mae(
+    pred_atom_coords,
+    feats,
+    true_atom_coords,
+    pred_pde,
+    true_coords_resolved_mask,
+    multiplicity=1,
+):
+    """Compute the plddt mean absolute error.
+
+    Parameters
+    ----------
+    pred_atom_coords : torch.Tensor
+        Predicted atom coordinates
+    feats : torch.Tensor
+        Input features
+    true_atom_coords : torch.Tensor
+        Ground truth atom coordinates
+    pred_pde : torch.Tensor
+        Predicted pde
+    true_coords_resolved_mask : torch.Tensor
+        Resolved atom mask
+    multiplicity : int
+        Diffusion batch size, by default 1
+
+    Returns
+    -------
+    Tensor
+        The mae for each modality
+    Tensor
+        The total number of pairs for each modality
+
+    """
+    # extract necessary features
+    token_to_rep_atom = feats["token_to_rep_atom"].float()
+    token_to_rep_atom = token_to_rep_atom.repeat_interleave(multiplicity, 0)
+
+    token_mask = torch.bmm(
+        token_to_rep_atom, true_coords_resolved_mask.unsqueeze(-1).float()
+    ).squeeze(-1)
+
+    token_type = feats["mol_type"]
+    token_type = token_type.repeat_interleave(multiplicity, 0)
+
+    true_token_coords = torch.bmm(token_to_rep_atom, true_atom_coords)
+    pred_token_coords = torch.bmm(token_to_rep_atom, pred_atom_coords)
+
+    # compute true pde
+    true_d = torch.cdist(true_token_coords, true_token_coords)
+    pred_d = torch.cdist(pred_token_coords, pred_token_coords)
+    target_pde = (
+        torch.clamp(
+            torch.floor(torch.abs(true_d - pred_d) * 64 / 32).long(), max=63
+        ).float()
+        * 0.5
+        + 0.25
+    )
+
+    pair_mask = token_mask.unsqueeze(-1) * token_mask.unsqueeze(-2)
+    pair_mask = (
+        pair_mask
+        * (1 - torch.eye(pair_mask.shape[1], device=pair_mask.device))[None, :, :]
+    )
+
+    protein_mask = (token_type == const.chain_type_ids["PROTEIN"]).float()
+    ligand_mask = (token_type == const.chain_type_ids["NONPOLYMER"]).float()
+    dna_mask = (token_type == const.chain_type_ids["DNA"]).float()
+    rna_mask = (token_type == const.chain_type_ids["RNA"]).float()
+
+    # compute different pdes
+    dna_protein_mask = pair_mask * (
+        dna_mask[:, :, None] * protein_mask[:, None, :]
+        + protein_mask[:, :, None] * dna_mask[:, None, :]
+    )
+    dna_protein_mae = torch.sum(torch.abs(target_pde - pred_pde) * dna_protein_mask) / (
+        torch.sum(dna_protein_mask) + 1e-5
+    )
+    dna_protein_total = torch.sum(dna_protein_mask)
+
+    rna_protein_mask = pair_mask * (
+        rna_mask[:, :, None] * protein_mask[:, None, :]
+        + protein_mask[:, :, None] * rna_mask[:, None, :]
+    )
+    rna_protein_mae = torch.sum(torch.abs(target_pde - pred_pde) * rna_protein_mask) / (
+        torch.sum(rna_protein_mask) + 1e-5
+    )
+    rna_protein_total = torch.sum(rna_protein_mask)
+
+    ligand_protein_mask = pair_mask * (
+        ligand_mask[:, :, None] * protein_mask[:, None, :]
+        + protein_mask[:, :, None] * ligand_mask[:, None, :]
+    )
+    ligand_protein_mae = torch.sum(
+        torch.abs(target_pde - pred_pde) * ligand_protein_mask
+    ) / (torch.sum(ligand_protein_mask) + 1e-5)
+    ligand_protein_total = torch.sum(ligand_protein_mask)
+
+    dna_ligand_mask = pair_mask * (
+        dna_mask[:, :, None] * ligand_mask[:, None, :]
+        + ligand_mask[:, :, None] * dna_mask[:, None, :]
+    )
+    dna_ligand_mae = torch.sum(torch.abs(target_pde - pred_pde) * dna_ligand_mask) / (
+        torch.sum(dna_ligand_mask) + 1e-5
+    )
+    dna_ligand_total = torch.sum(dna_ligand_mask)
+
+    rna_ligand_mask = pair_mask * (
+        rna_mask[:, :, None] * ligand_mask[:, None, :]
+        + ligand_mask[:, :, None] * rna_mask[:, None, :]
+    )
+    rna_ligand_mae = torch.sum(torch.abs(target_pde - pred_pde) * rna_ligand_mask) / (
+        torch.sum(rna_ligand_mask) + 1e-5
+    )
+    rna_ligand_total = torch.sum(rna_ligand_mask)
+
+    intra_ligand_mask = pair_mask * (ligand_mask[:, :, None] * ligand_mask[:, None, :])
+    intra_ligand_mae = torch.sum(
+        torch.abs(target_pde - pred_pde) * intra_ligand_mask
+    ) / (torch.sum(intra_ligand_mask) + 1e-5)
+    intra_ligand_total = torch.sum(intra_ligand_mask)
+
+    intra_dna_mask = pair_mask * (dna_mask[:, :, None] * dna_mask[:, None, :])
+    intra_dna_mae = torch.sum(torch.abs(target_pde - pred_pde) * intra_dna_mask) / (
+        torch.sum(intra_dna_mask) + 1e-5
+    )
+    intra_dna_total = torch.sum(intra_dna_mask)
+
+    intra_rna_mask = pair_mask * (rna_mask[:, :, None] * rna_mask[:, None, :])
+    intra_rna_mae = torch.sum(torch.abs(target_pde - pred_pde) * intra_rna_mask) / (
+        torch.sum(intra_rna_mask) + 1e-5
+    )
+    intra_rna_total = torch.sum(intra_rna_mask)
+
+    chain_id = feats["asym_id"].repeat_interleave(multiplicity, 0)
+    same_chain_mask = (chain_id[:, :, None] == chain_id[:, None, :]).float()
+
+    intra_protein_mask = (
+        pair_mask
+        * same_chain_mask
+        * (protein_mask[:, :, None] * protein_mask[:, None, :])
+    )
+    intra_protein_mae = torch.sum(
+        torch.abs(target_pde - pred_pde) * intra_protein_mask
+    ) / (torch.sum(intra_protein_mask) + 1e-5)
+    intra_protein_total = torch.sum(intra_protein_mask)
+
+    protein_protein_mask = (
+        pair_mask
+        * (1 - same_chain_mask)
+        * (protein_mask[:, :, None] * protein_mask[:, None, :])
+    )
+    protein_protein_mae = torch.sum(
+        torch.abs(target_pde - pred_pde) * protein_protein_mask
+    ) / (torch.sum(protein_protein_mask) + 1e-5)
+    protein_protein_total = torch.sum(protein_protein_mask)
+
+    mae_pde_dict = {
+        "dna_protein": dna_protein_mae,
+        "rna_protein": rna_protein_mae,
+        "ligand_protein": ligand_protein_mae,
+        "dna_ligand": dna_ligand_mae,
+        "rna_ligand": rna_ligand_mae,
+        "intra_ligand": intra_ligand_mae,
+        "intra_dna": intra_dna_mae,
+        "intra_rna": intra_rna_mae,
+        "intra_protein": intra_protein_mae,
+        "protein_protein": protein_protein_mae,
+    }
+    total_pde_dict = {
+        "dna_protein": dna_protein_total,
+        "rna_protein": rna_protein_total,
+        "ligand_protein": ligand_protein_total,
+        "dna_ligand": dna_ligand_total,
+        "rna_ligand": rna_ligand_total,
+        "intra_ligand": intra_ligand_total,
+        "intra_dna": intra_dna_total,
+        "intra_rna": intra_rna_total,
+        "intra_protein": intra_protein_total,
+        "protein_protein": protein_protein_total,
+    }
+
+    return mae_pde_dict, total_pde_dict
+
+
+def compute_pae_mae(
+    pred_atom_coords,
+    feats,
+    true_atom_coords,
+    pred_pae,
+    true_coords_resolved_mask,
+    multiplicity=1,
+):
+    """Compute the pae mean absolute error.
+
+    Parameters
+    ----------
+    pred_atom_coords : torch.Tensor
+        Predicted atom coordinates
+    feats : torch.Tensor
+        Input features
+    true_atom_coords : torch.Tensor
+        Ground truth atom coordinates
+    pred_pae : torch.Tensor
+        Predicted pae
+    true_coords_resolved_mask : torch.Tensor
+        Resolved atom mask
+    multiplicity : int
+        Diffusion batch size, by default 1
+
+    Returns
+    -------
+    Tensor
+        The mae for each modality
+    Tensor
+        The total number of pairs for each modality
+
+    """
+    # Retrieve frames and resolved masks
+    frames_idx_original = feats["frames_idx"]
+    mask_frame_true = feats["frame_resolved_mask"]
+
+    # Adjust the frames for nonpolymers after symmetry correction!
+    # NOTE: frames of polymers do not change under symmetry!
+    frames_idx_true, mask_collinear_true = compute_frame_pred(
+        true_atom_coords,
+        frames_idx_original,
+        feats,
+        multiplicity,
+        resolved_mask=true_coords_resolved_mask,
+    )
+
+    frame_true_atom_a, frame_true_atom_b, frame_true_atom_c = (
+        frames_idx_true[:, :, :, 0],
+        frames_idx_true[:, :, :, 1],
+        frames_idx_true[:, :, :, 2],
+    )
+    # Compute token coords in true frames
+    B, N, _ = true_atom_coords.shape
+    true_atom_coords = true_atom_coords.reshape(B // multiplicity, multiplicity, -1, 3)
+    true_coords_transformed = express_coordinate_in_frame(
+        true_atom_coords, frame_true_atom_a, frame_true_atom_b, frame_true_atom_c
+    )
+
+    # Compute pred frames and mask
+    frames_idx_pred, mask_collinear_pred = compute_frame_pred(
+        pred_atom_coords, frames_idx_original, feats, multiplicity
+    )
+    frame_pred_atom_a, frame_pred_atom_b, frame_pred_atom_c = (
+        frames_idx_pred[:, :, :, 0],
+        frames_idx_pred[:, :, :, 1],
+        frames_idx_pred[:, :, :, 2],
+    )
+    # Compute token coords in pred frames
+    B, N, _ = pred_atom_coords.shape
+    pred_atom_coords = pred_atom_coords.reshape(B // multiplicity, multiplicity, -1, 3)
+    pred_coords_transformed = express_coordinate_in_frame(
+        pred_atom_coords, frame_pred_atom_a, frame_pred_atom_b, frame_pred_atom_c
+    )
+
+    target_pae_continuous = torch.sqrt(
+        ((true_coords_transformed - pred_coords_transformed) ** 2).sum(-1) + 1e-8
+    )
+    target_pae = (
+        torch.clamp(torch.floor(target_pae_continuous * 64 / 32).long(), max=63).float()
+        * 0.5
+        + 0.25
+    )
+
+    # Compute mask for the pae loss
+    b_true_resolved_mask = true_coords_resolved_mask[
+        torch.arange(B // multiplicity)[:, None, None].to(
+            pred_coords_transformed.device
+        ),
+        frame_true_atom_b,
+    ]
+
+    pair_mask = (
+        mask_frame_true[:, None, :, None]  # if true frame is invalid
+        * mask_collinear_true[:, :, :, None]  # if true frame is invalid
+        * mask_collinear_pred[:, :, :, None]  # if pred frame is invalid
+        * b_true_resolved_mask[:, :, None, :]  # If atom j is not resolved
+        * feats["token_pad_mask"][:, None, :, None]
+        * feats["token_pad_mask"][:, None, None, :]
+    )
+
+    token_type = feats["mol_type"]
+    token_type = token_type.repeat_interleave(multiplicity, 0)
+
+    protein_mask = (token_type == const.chain_type_ids["PROTEIN"]).float()
+    ligand_mask = (token_type == const.chain_type_ids["NONPOLYMER"]).float()
+    dna_mask = (token_type == const.chain_type_ids["DNA"]).float()
+    rna_mask = (token_type == const.chain_type_ids["RNA"]).float()
+
+    # compute different paes
+    dna_protein_mask = pair_mask * (
+        dna_mask[:, :, None] * protein_mask[:, None, :]
+        + protein_mask[:, :, None] * dna_mask[:, None, :]
+    )
+    dna_protein_mae = torch.sum(torch.abs(target_pae - pred_pae) * dna_protein_mask) / (
+        torch.sum(dna_protein_mask) + 1e-5
+    )
+    dna_protein_total = torch.sum(dna_protein_mask)
+
+    rna_protein_mask = pair_mask * (
+        rna_mask[:, :, None] * protein_mask[:, None, :]
+        + protein_mask[:, :, None] * rna_mask[:, None, :]
+    )
+    rna_protein_mae = torch.sum(torch.abs(target_pae - pred_pae) * rna_protein_mask) / (
+        torch.sum(rna_protein_mask) + 1e-5
+    )
+    rna_protein_total = torch.sum(rna_protein_mask)
+
+    ligand_protein_mask = pair_mask * (
+        ligand_mask[:, :, None] * protein_mask[:, None, :]
+        + protein_mask[:, :, None] * ligand_mask[:, None, :]
+    )
+    ligand_protein_mae = torch.sum(
+        torch.abs(target_pae - pred_pae) * ligand_protein_mask
+    ) / (torch.sum(ligand_protein_mask) + 1e-5)
+    ligand_protein_total = torch.sum(ligand_protein_mask)
+
+    dna_ligand_mask = pair_mask * (
+        dna_mask[:, :, None] * ligand_mask[:, None, :]
+        + ligand_mask[:, :, None] * dna_mask[:, None, :]
+    )
+    dna_ligand_mae = torch.sum(torch.abs(target_pae - pred_pae) * dna_ligand_mask) / (
+        torch.sum(dna_ligand_mask) + 1e-5
+    )
+    dna_ligand_total = torch.sum(dna_ligand_mask)
+
+    rna_ligand_mask = pair_mask * (
+        rna_mask[:, :, None] * ligand_mask[:, None, :]
+        + ligand_mask[:, :, None] * rna_mask[:, None, :]
+    )
+    rna_ligand_mae = torch.sum(torch.abs(target_pae - pred_pae) * rna_ligand_mask) / (
+        torch.sum(rna_ligand_mask) + 1e-5
+    )
+    rna_ligand_total = torch.sum(rna_ligand_mask)
+
+    intra_ligand_mask = pair_mask * (ligand_mask[:, :, None] * ligand_mask[:, None, :])
+    intra_ligand_mae = torch.sum(
+        torch.abs(target_pae - pred_pae) * intra_ligand_mask
+    ) / (torch.sum(intra_ligand_mask) + 1e-5)
+    intra_ligand_total = torch.sum(intra_ligand_mask)
+
+    intra_dna_mask = pair_mask * (dna_mask[:, :, None] * dna_mask[:, None, :])
+    intra_dna_mae = torch.sum(torch.abs(target_pae - pred_pae) * intra_dna_mask) / (
+        torch.sum(intra_dna_mask) + 1e-5
+    )
+    intra_dna_total = torch.sum(intra_dna_mask)
+
+    intra_rna_mask = pair_mask * (rna_mask[:, :, None] * rna_mask[:, None, :])
+    intra_rna_mae = torch.sum(torch.abs(target_pae - pred_pae) * intra_rna_mask) / (
+        torch.sum(intra_rna_mask) + 1e-5
+    )
+    intra_rna_total = torch.sum(intra_rna_mask)
+
+    chain_id = feats["asym_id"].repeat_interleave(multiplicity, 0)
+    same_chain_mask = (chain_id[:, :, None] == chain_id[:, None, :]).float()
+
+    intra_protein_mask = (
+        pair_mask
+        * same_chain_mask
+        * (protein_mask[:, :, None] * protein_mask[:, None, :])
+    )
+    intra_protein_mae = torch.sum(
+        torch.abs(target_pae - pred_pae) * intra_protein_mask
+    ) / (torch.sum(intra_protein_mask) + 1e-5)
+    intra_protein_total = torch.sum(intra_protein_mask)
+
+    protein_protein_mask = (
+        pair_mask
+        * (1 - same_chain_mask)
+        * (protein_mask[:, :, None] * protein_mask[:, None, :])
+    )
+    protein_protein_mae = torch.sum(
+        torch.abs(target_pae - pred_pae) * protein_protein_mask
+    ) / (torch.sum(protein_protein_mask) + 1e-5)
+    protein_protein_total = torch.sum(protein_protein_mask)
+
+    mae_pae_dict = {
+        "dna_protein": dna_protein_mae,
+        "rna_protein": rna_protein_mae,
+        "ligand_protein": ligand_protein_mae,
+        "dna_ligand": dna_ligand_mae,
+        "rna_ligand": rna_ligand_mae,
+        "intra_ligand": intra_ligand_mae,
+        "intra_dna": intra_dna_mae,
+        "intra_rna": intra_rna_mae,
+        "intra_protein": intra_protein_mae,
+        "protein_protein": protein_protein_mae,
+    }
+    total_pae_dict = {
+        "dna_protein": dna_protein_total,
+        "rna_protein": rna_protein_total,
+        "ligand_protein": ligand_protein_total,
+        "dna_ligand": dna_ligand_total,
+        "rna_ligand": rna_ligand_total,
+        "intra_ligand": intra_ligand_total,
+        "intra_dna": intra_dna_total,
+        "intra_rna": intra_rna_total,
+        "intra_protein": intra_protein_total,
+        "protein_protein": protein_protein_total,
+    }
+
+    return mae_pae_dict, total_pae_dict
+
+
+def weighted_minimum_rmsd(
+    pred_atom_coords,
+    feats,
+    multiplicity=1,
+    nucleotide_weight=5.0,
+    ligand_weight=10.0,
+):
+    """Compute rmsd of the aligned atom coordinates.
+
+    Parameters
+    ----------
+    pred_atom_coords : torch.Tensor
+        Predicted atom coordinates
+    feats : torch.Tensor
+        Input features
+    multiplicity : int
+        Diffusion batch size, by default 1
+
+    Returns
+    -------
+    Tensor
+        The rmsds
+    Tensor
+        The best rmsd
+
+    """
+    atom_coords = feats["coords"]
+    atom_coords = atom_coords.repeat_interleave(multiplicity, 0)
+    atom_coords = atom_coords[:, 0]
+
+    atom_mask = feats["atom_resolved_mask"]
+    atom_mask = atom_mask.repeat_interleave(multiplicity, 0)
+
+    align_weights = atom_coords.new_ones(atom_coords.shape[:2])
+    atom_type = (
+        torch.bmm(
+            feats["atom_to_token"].float(), feats["mol_type"].unsqueeze(-1).float()
+        )
+        .squeeze(-1)
+        .long()
+    )
+    atom_type = atom_type.repeat_interleave(multiplicity, 0)
+
+    align_weights = align_weights * (
+        1
+        + nucleotide_weight
+        * (
+            torch.eq(atom_type, const.chain_type_ids["DNA"]).float()
+            + torch.eq(atom_type, const.chain_type_ids["RNA"]).float()
+        )
+        + ligand_weight
+        * torch.eq(atom_type, const.chain_type_ids["NONPOLYMER"]).float()
+    )
+
+    with torch.no_grad():
+        atom_coords_aligned_ground_truth = weighted_rigid_align(
+            atom_coords, pred_atom_coords, align_weights, mask=atom_mask
+        )
+
+    # weighted MSE loss of denoised atom positions
+    mse_loss = ((pred_atom_coords - atom_coords_aligned_ground_truth) ** 2).sum(dim=-1)
+    rmsd = torch.sqrt(
+        torch.sum(mse_loss * align_weights * atom_mask, dim=-1)
+        / torch.sum(align_weights * atom_mask, dim=-1)
+    )
+    best_rmsd = torch.min(rmsd.reshape(-1, multiplicity), dim=1).values
+
+    return rmsd, best_rmsd
+
+
+def weighted_minimum_rmsd_single(
+    pred_atom_coords,
+    atom_coords,
+    atom_mask,
+    atom_to_token,
+    mol_type,
+    nucleotide_weight=5.0,
+    ligand_weight=10.0,
+):
+    """Compute rmsd of the aligned atom coordinates.
+
+    Parameters
+    ----------
+    pred_atom_coords : torch.Tensor
+        Predicted atom coordinates
+    atom_coords: torch.Tensor
+        Ground truth atom coordinates
+    atom_mask : torch.Tensor
+        Resolved atom mask
+    atom_to_token : torch.Tensor
+        Atom to token mapping
+    mol_type : torch.Tensor
+        Atom type
+
+    Returns
+    -------
+    Tensor
+        The rmsd
+    Tensor
+        The aligned coordinates
+    Tensor
+        The aligned weights
+
+    """
+    align_weights = atom_coords.new_ones(atom_coords.shape[:2])
+    atom_type = (
+        torch.bmm(atom_to_token.float(), mol_type.unsqueeze(-1).float())
+        .squeeze(-1)
+        .long()
+    )
+
+    align_weights = align_weights * (
+        1
+        + nucleotide_weight
+        * (
+            torch.eq(atom_type, const.chain_type_ids["DNA"]).float()
+            + torch.eq(atom_type, const.chain_type_ids["RNA"]).float()
+        )
+        + ligand_weight
+        * torch.eq(atom_type, const.chain_type_ids["NONPOLYMER"]).float()
+    )
+
+    with torch.no_grad():
+        atom_coords_aligned_ground_truth = weighted_rigid_align(
+            atom_coords, pred_atom_coords, align_weights, mask=atom_mask
+        )
+
+    # weighted MSE loss of denoised atom positions
+    mse_loss = ((pred_atom_coords - atom_coords_aligned_ground_truth) ** 2).sum(dim=-1)
+    rmsd = torch.sqrt(
+        torch.sum(mse_loss * align_weights * atom_mask, dim=-1)
+        / torch.sum(align_weights * atom_mask, dim=-1)
+    )
+    return rmsd, atom_coords_aligned_ground_truth, align_weights
diff --git a/forks/boltz/src/boltz/model/models/__init__.py b/forks/boltz/src/boltz/model/models/__init__.py
new file mode 100644
index 00000000..e69de29b
diff --git a/forks/boltz/src/boltz/model/models/boltz1.py b/forks/boltz/src/boltz/model/models/boltz1.py
new file mode 100644
index 00000000..51889b88
--- /dev/null
+++ b/forks/boltz/src/boltz/model/models/boltz1.py
@@ -0,0 +1,1292 @@
+import gc
+import random
+from typing import Any, Optional
+
+import torch
+import torch._dynamo
+from pytorch_lightning import LightningModule
+from torch import Tensor, nn
+from torchmetrics import MeanMetric
+
+import boltz.model.layers.initialize as init
+from boltz.data import const
+from boltz.data.feature.symmetry import (
+    minimum_lddt_symmetry_coords,
+    minimum_symmetry_coords,
+)
+from boltz.model.loss.confidence import confidence_loss
+from boltz.model.loss.distogram import distogram_loss
+from boltz.model.loss.validation import (
+    compute_pae_mae,
+    compute_pde_mae,
+    compute_plddt_mae,
+    factored_lddt_loss,
+    factored_token_lddt_dist_loss,
+    weighted_minimum_rmsd,
+)
+from boltz.model.modules.confidence import ConfidenceModule
+from boltz.model.modules.diffusion import AtomDiffusion
+from boltz.model.modules.encoders import RelativePositionEncoder
+from boltz.model.modules.trunk import (
+    DistogramModule,
+    InputEmbedder,
+    MSAModule,
+    PairformerModule,
+)
+from boltz.model.modules.utils import ExponentialMovingAverage
+from boltz.model.optim.scheduler import AlphaFoldLRScheduler
+
+
+class Boltz1(LightningModule):
+    """Boltz1 model."""
+
+    def __init__(  # noqa: PLR0915, C901, PLR0912
+        self,
+        atom_s: int,
+        atom_z: int,
+        token_s: int,
+        token_z: int,
+        num_bins: int,
+        training_args: dict[str, Any],
+        validation_args: dict[str, Any],
+        embedder_args: dict[str, Any],
+        msa_args: dict[str, Any],
+        pairformer_args: dict[str, Any],
+        score_model_args: dict[str, Any],
+        diffusion_process_args: dict[str, Any],
+        diffusion_loss_args: dict[str, Any],
+        confidence_model_args: dict[str, Any],
+        atom_feature_dim: int = 128,
+        confidence_prediction: bool = False,
+        confidence_imitate_trunk: bool = False,
+        alpha_pae: float = 0.0,
+        structure_prediction_training: bool = True,
+        atoms_per_window_queries: int = 32,
+        atoms_per_window_keys: int = 128,
+        compile_pairformer: bool = False,
+        compile_structure: bool = False,
+        compile_confidence: bool = False,
+        nucleotide_rmsd_weight: float = 5.0,
+        ligand_rmsd_weight: float = 10.0,
+        no_msa: bool = False,
+        no_atom_encoder: bool = False,
+        ema: bool = False,
+        ema_decay: float = 0.999,
+        min_dist: float = 2.0,
+        max_dist: float = 22.0,
+        predict_args: Optional[dict[str, Any]] = None,
+        steering_args: Optional[dict[str, Any]] = None,
+        use_kernels: bool = False,
+    ) -> None:
+        super().__init__()
+
+        self.save_hyperparameters()
+
+        self.lddt = nn.ModuleDict()
+        self.disto_lddt = nn.ModuleDict()
+        self.complex_lddt = nn.ModuleDict()
+        if confidence_prediction:
+            self.top1_lddt = nn.ModuleDict()
+            self.iplddt_top1_lddt = nn.ModuleDict()
+            self.ipde_top1_lddt = nn.ModuleDict()
+            self.pde_top1_lddt = nn.ModuleDict()
+            self.ptm_top1_lddt = nn.ModuleDict()
+            self.iptm_top1_lddt = nn.ModuleDict()
+            self.ligand_iptm_top1_lddt = nn.ModuleDict()
+            self.protein_iptm_top1_lddt = nn.ModuleDict()
+            self.avg_lddt = nn.ModuleDict()
+            self.plddt_mae = nn.ModuleDict()
+            self.pde_mae = nn.ModuleDict()
+            self.pae_mae = nn.ModuleDict()
+        for m in const.out_types + ["pocket_ligand_protein"]:
+            self.lddt[m] = MeanMetric()
+            self.disto_lddt[m] = MeanMetric()
+            self.complex_lddt[m] = MeanMetric()
+            if confidence_prediction:
+                self.top1_lddt[m] = MeanMetric()
+                self.iplddt_top1_lddt[m] = MeanMetric()
+                self.ipde_top1_lddt[m] = MeanMetric()
+                self.pde_top1_lddt[m] = MeanMetric()
+                self.ptm_top1_lddt[m] = MeanMetric()
+                self.iptm_top1_lddt[m] = MeanMetric()
+                self.ligand_iptm_top1_lddt[m] = MeanMetric()
+                self.protein_iptm_top1_lddt[m] = MeanMetric()
+                self.avg_lddt[m] = MeanMetric()
+                self.pde_mae[m] = MeanMetric()
+                self.pae_mae[m] = MeanMetric()
+        for m in const.out_single_types:
+            if confidence_prediction:
+                self.plddt_mae[m] = MeanMetric()
+        self.rmsd = MeanMetric()
+        self.best_rmsd = MeanMetric()
+
+        self.train_confidence_loss_logger = MeanMetric()
+        self.train_confidence_loss_dict_logger = nn.ModuleDict()
+        for m in [
+            "plddt_loss",
+            "resolved_loss",
+            "pde_loss",
+            "pae_loss",
+        ]:
+            self.train_confidence_loss_dict_logger[m] = MeanMetric()
+
+        self.ema = None
+        self.use_ema = ema
+        self.ema_decay = ema_decay
+
+        self.training_args = training_args
+        self.validation_args = validation_args
+        self.diffusion_loss_args = diffusion_loss_args
+        self.predict_args = predict_args
+        self.steering_args = steering_args
+
+        self.use_kernels = use_kernels
+
+        self.nucleotide_rmsd_weight = nucleotide_rmsd_weight
+        self.ligand_rmsd_weight = ligand_rmsd_weight
+
+        self.num_bins = num_bins
+        self.min_dist = min_dist
+        self.max_dist = max_dist
+        self.is_pairformer_compiled = False
+
+        # Input projections
+        s_input_dim = (
+            token_s + 2 * const.num_tokens + 1 + len(const.pocket_contact_info)
+        )
+        self.s_init = nn.Linear(s_input_dim, token_s, bias=False)
+        self.z_init_1 = nn.Linear(s_input_dim, token_z, bias=False)
+        self.z_init_2 = nn.Linear(s_input_dim, token_z, bias=False)
+
+        # Input embeddings
+        full_embedder_args = {
+            "atom_s": atom_s,
+            "atom_z": atom_z,
+            "token_s": token_s,
+            "token_z": token_z,
+            "atoms_per_window_queries": atoms_per_window_queries,
+            "atoms_per_window_keys": atoms_per_window_keys,
+            "atom_feature_dim": atom_feature_dim,
+            "no_atom_encoder": no_atom_encoder,
+            **embedder_args,
+        }
+        self.input_embedder = InputEmbedder(**full_embedder_args)
+        self.rel_pos = RelativePositionEncoder(token_z)
+        self.token_bonds = nn.Linear(1, token_z, bias=False)
+
+        # Normalization layers
+        self.s_norm = nn.LayerNorm(token_s)
+        self.z_norm = nn.LayerNorm(token_z)
+
+        # Recycling projections
+        self.s_recycle = nn.Linear(token_s, token_s, bias=False)
+        self.z_recycle = nn.Linear(token_z, token_z, bias=False)
+        init.gating_init_(self.s_recycle.weight)
+        init.gating_init_(self.z_recycle.weight)
+
+        # Pairwise stack
+        self.no_msa = no_msa
+        if not no_msa:
+            self.msa_module = MSAModule(
+                token_z=token_z,
+                s_input_dim=s_input_dim,
+                **msa_args,
+            )
+        self.pairformer_module = PairformerModule(token_s, token_z, **pairformer_args)
+        if compile_pairformer:
+            # Big models hit the default cache limit (8)
+            self.is_pairformer_compiled = True
+            torch._dynamo.config.cache_size_limit = 512
+            torch._dynamo.config.accumulated_cache_size_limit = 512
+            self.pairformer_module = torch.compile(
+                self.pairformer_module,
+                dynamic=False,
+                fullgraph=False,
+            )
+
+        # Output modules
+        use_accumulate_token_repr = (
+            confidence_prediction
+            and "use_s_diffusion" in confidence_model_args
+            and confidence_model_args["use_s_diffusion"]
+        )
+        self.structure_module = AtomDiffusion(
+            score_model_args={
+                "token_z": token_z,
+                "token_s": token_s,
+                "atom_z": atom_z,
+                "atom_s": atom_s,
+                "atoms_per_window_queries": atoms_per_window_queries,
+                "atoms_per_window_keys": atoms_per_window_keys,
+                "atom_feature_dim": atom_feature_dim,
+                **score_model_args,
+            },
+            compile_score=compile_structure,
+            accumulate_token_repr=use_accumulate_token_repr,
+            **diffusion_process_args,
+        )
+        self.distogram_module = DistogramModule(token_z, num_bins)
+        self.confidence_prediction = confidence_prediction
+        self.alpha_pae = alpha_pae
+
+        self.structure_prediction_training = structure_prediction_training
+        self.confidence_imitate_trunk = confidence_imitate_trunk
+        if self.confidence_prediction:
+            if self.confidence_imitate_trunk:
+                self.confidence_module = ConfidenceModule(
+                    token_s,
+                    token_z,
+                    compute_pae=alpha_pae > 0,
+                    imitate_trunk=True,
+                    pairformer_args=pairformer_args,
+                    full_embedder_args=full_embedder_args,
+                    msa_args=msa_args,
+                    **confidence_model_args,
+                )
+            else:
+                self.confidence_module = ConfidenceModule(
+                    token_s,
+                    token_z,
+                    compute_pae=alpha_pae > 0,
+                    **confidence_model_args,
+                )
+            if compile_confidence:
+                self.confidence_module = torch.compile(
+                    self.confidence_module, dynamic=False, fullgraph=False
+                )
+
+        # Remove grad from weights they are not trained for ddp
+        if not structure_prediction_training:
+            for name, param in self.named_parameters():
+                if name.split(".")[0] != "confidence_module":
+                    param.requires_grad = False
+
+    def setup(self, stage: str) -> None:
+        """Set the model for training, validation and inference."""
+        if stage == "predict" and not (
+            torch.cuda.is_available()
+            and torch.cuda.get_device_properties(torch.device("cuda")).major >= 8.0  # noqa: PLR2004
+        ):
+            self.use_kernels = False
+
+    def forward(
+        self,
+        feats: dict[str, Tensor],
+        recycling_steps: int = 0,
+        num_sampling_steps: Optional[int] = None,
+        multiplicity_diffusion_train: int = 1,
+        diffusion_samples: int = 1,
+        max_parallel_samples: Optional[int] = None,
+        run_confidence_sequentially: bool = False,
+    ) -> dict[str, Tensor]:
+        dict_out = {}
+
+        # Compute input embeddings
+        with torch.set_grad_enabled(
+            self.training and self.structure_prediction_training
+        ):
+            s_inputs = self.input_embedder(feats)
+
+            # Initialize the sequence and pairwise embeddings
+            s_init = self.s_init(s_inputs)
+            z_init = (
+                self.z_init_1(s_inputs)[:, :, None]
+                + self.z_init_2(s_inputs)[:, None, :]
+            )
+            relative_position_encoding = self.rel_pos(feats)
+            z_init = z_init + relative_position_encoding
+            z_init = z_init + self.token_bonds(feats["token_bonds"].float())
+
+            # Perform rounds of the pairwise stack
+            s = torch.zeros_like(s_init)
+            z = torch.zeros_like(z_init)
+
+            # Compute pairwise mask
+            mask = feats["token_pad_mask"].float()
+            pair_mask = mask[:, :, None] * mask[:, None, :]
+
+            for i in range(recycling_steps + 1):
+                with torch.set_grad_enabled(self.training and (i == recycling_steps)):
+                    # Fixes an issue with unused parameters in autocast
+                    if (
+                        self.training
+                        and (i == recycling_steps)
+                        and torch.is_autocast_enabled()
+                    ):
+                        torch.clear_autocast_cache()
+
+                    # Apply recycling
+                    s = s_init + self.s_recycle(self.s_norm(s))
+                    z = z_init + self.z_recycle(self.z_norm(z))
+
+                    # Compute pairwise stack
+                    if not self.no_msa:
+                        z = z + self.msa_module(
+                            z, s_inputs, feats, use_kernels=self.use_kernels
+                        )
+
+                    # Revert to uncompiled version for validation
+                    if self.is_pairformer_compiled and not self.training:
+                        pairformer_module = self.pairformer_module._orig_mod  # noqa: SLF001
+                    else:
+                        pairformer_module = self.pairformer_module
+
+                    s, z = pairformer_module(
+                        s,
+                        z,
+                        mask=mask,
+                        pair_mask=pair_mask,
+                        use_kernels=self.use_kernels,
+                    )
+
+            pdistogram = self.distogram_module(z)
+            dict_out = {
+                "pdistogram": pdistogram,
+                "s": s,
+                "z": z,
+            }
+
+        # Compute structure module
+        if self.training and self.structure_prediction_training:
+            dict_out.update(
+                self.structure_module(
+                    s_trunk=s,
+                    z_trunk=z,
+                    s_inputs=s_inputs,
+                    feats=feats,
+                    relative_position_encoding=relative_position_encoding,
+                    multiplicity=multiplicity_diffusion_train,
+                )
+            )
+
+        if (not self.training) or self.confidence_prediction:
+            dict_out.update(
+                self.structure_module.sample(
+                    s_trunk=s,
+                    z_trunk=z,
+                    s_inputs=s_inputs,
+                    feats=feats,
+                    relative_position_encoding=relative_position_encoding,
+                    num_sampling_steps=num_sampling_steps,
+                    atom_mask=feats["atom_pad_mask"],
+                    multiplicity=diffusion_samples,
+                    max_parallel_samples=max_parallel_samples,
+                    train_accumulate_token_repr=self.training,
+                    steering_args=self.steering_args,
+                )
+            )
+
+        if self.confidence_prediction:
+            dict_out.update(
+                self.confidence_module(
+                    s_inputs=s_inputs.detach(),
+                    s=s.detach(),
+                    z=z.detach(),
+                    s_diffusion=(
+                        dict_out["diff_token_repr"]
+                        if self.confidence_module.use_s_diffusion
+                        else None
+                    ),
+                    x_pred=dict_out["sample_atom_coords"].detach(),
+                    feats=feats,
+                    pred_distogram_logits=dict_out["pdistogram"].detach(),
+                    multiplicity=diffusion_samples,
+                    run_sequentially=run_confidence_sequentially,
+                    use_kernels=self.use_kernels,
+                )
+            )
+        if self.confidence_prediction and self.confidence_module.use_s_diffusion:
+            dict_out.pop("diff_token_repr", None)
+        return dict_out
+
+    def get_true_coordinates(
+        self,
+        batch,
+        out,
+        diffusion_samples,
+        symmetry_correction,
+        lddt_minimization=True,
+    ):
+        if symmetry_correction:
+            min_coords_routine = (
+                minimum_lddt_symmetry_coords
+                if lddt_minimization
+                else minimum_symmetry_coords
+            )
+            true_coords = []
+            true_coords_resolved_mask = []
+            rmsds, best_rmsds = [], []
+            for idx in range(batch["token_index"].shape[0]):
+                best_rmsd = float("inf")
+                for rep in range(diffusion_samples):
+                    i = idx * diffusion_samples + rep
+                    best_true_coords, rmsd, best_true_coords_resolved_mask = (
+                        min_coords_routine(
+                            coords=out["sample_atom_coords"][i : i + 1],
+                            feats=batch,
+                            index_batch=idx,
+                            nucleotide_weight=self.nucleotide_rmsd_weight,
+                            ligand_weight=self.ligand_rmsd_weight,
+                        )
+                    )
+                    rmsds.append(rmsd)
+                    true_coords.append(best_true_coords)
+                    true_coords_resolved_mask.append(best_true_coords_resolved_mask)
+                    if rmsd < best_rmsd:
+                        best_rmsd = rmsd
+                best_rmsds.append(best_rmsd)
+            true_coords = torch.cat(true_coords, dim=0)
+            true_coords_resolved_mask = torch.cat(true_coords_resolved_mask, dim=0)
+        else:
+            true_coords = (
+                batch["coords"].squeeze(1).repeat_interleave(diffusion_samples, 0)
+            )
+
+            true_coords_resolved_mask = batch["atom_resolved_mask"].repeat_interleave(
+                diffusion_samples, 0
+            )
+            rmsds, best_rmsds = weighted_minimum_rmsd(
+                out["sample_atom_coords"],
+                batch,
+                multiplicity=diffusion_samples,
+                nucleotide_weight=self.nucleotide_rmsd_weight,
+                ligand_weight=self.ligand_rmsd_weight,
+            )
+
+        return true_coords, rmsds, best_rmsds, true_coords_resolved_mask
+
+    def training_step(self, batch: dict[str, Tensor], batch_idx: int) -> Tensor:
+        # Sample recycling steps
+        recycling_steps = random.randint(0, self.training_args.recycling_steps)
+
+        # Compute the forward pass
+        out = self(
+            feats=batch,
+            recycling_steps=recycling_steps,
+            num_sampling_steps=self.training_args.sampling_steps,
+            multiplicity_diffusion_train=self.training_args.diffusion_multiplicity,
+            diffusion_samples=self.training_args.diffusion_samples,
+        )
+
+        # Compute losses
+        if self.structure_prediction_training:
+            disto_loss, _ = distogram_loss(
+                out,
+                batch,
+            )
+            try:
+                diffusion_loss_dict = self.structure_module.compute_loss(
+                    batch,
+                    out,
+                    multiplicity=self.training_args.diffusion_multiplicity,
+                    **self.diffusion_loss_args,
+                )
+            except Exception as e:
+                print(f"Skipping batch {batch_idx} due to error: {e}")
+                return None
+
+        else:
+            disto_loss = 0.0
+            diffusion_loss_dict = {"loss": 0.0, "loss_breakdown": {}}
+
+        if self.confidence_prediction:
+            # confidence model symmetry correction
+            true_coords, _, _, true_coords_resolved_mask = self.get_true_coordinates(
+                batch,
+                out,
+                diffusion_samples=self.training_args.diffusion_samples,
+                symmetry_correction=self.training_args.symmetry_correction,
+            )
+
+            confidence_loss_dict = confidence_loss(
+                out,
+                batch,
+                true_coords,
+                true_coords_resolved_mask,
+                alpha_pae=self.alpha_pae,
+                multiplicity=self.training_args.diffusion_samples,
+            )
+        else:
+            confidence_loss_dict = {
+                "loss": torch.tensor(0.0).to(batch["token_index"].device),
+                "loss_breakdown": {},
+            }
+
+        # Aggregate losses
+        loss = (
+            self.training_args.confidence_loss_weight * confidence_loss_dict["loss"]
+            + self.training_args.diffusion_loss_weight * diffusion_loss_dict["loss"]
+            + self.training_args.distogram_loss_weight * disto_loss
+        )
+        # Log losses
+        self.log("train/distogram_loss", disto_loss)
+        self.log("train/diffusion_loss", diffusion_loss_dict["loss"])
+        for k, v in diffusion_loss_dict["loss_breakdown"].items():
+            self.log(f"train/{k}", v)
+
+        if self.confidence_prediction:
+            self.train_confidence_loss_logger.update(
+                confidence_loss_dict["loss"].detach()
+            )
+
+            for k in self.train_confidence_loss_dict_logger.keys():
+                self.train_confidence_loss_dict_logger[k].update(
+                    confidence_loss_dict["loss_breakdown"][k].detach()
+                    if torch.is_tensor(confidence_loss_dict["loss_breakdown"][k])
+                    else confidence_loss_dict["loss_breakdown"][k]
+                )
+        self.log("train/loss", loss)
+        self.training_log()
+        return loss
+
+    def training_log(self):
+        self.log("train/grad_norm", self.gradient_norm(self), prog_bar=False)
+        self.log("train/param_norm", self.parameter_norm(self), prog_bar=False)
+
+        lr = self.trainer.optimizers[0].param_groups[0]["lr"]
+        self.log("lr", lr, prog_bar=False)
+
+        self.log(
+            "train/grad_norm_msa_module",
+            self.gradient_norm(self.msa_module),
+            prog_bar=False,
+        )
+        self.log(
+            "train/param_norm_msa_module",
+            self.parameter_norm(self.msa_module),
+            prog_bar=False,
+        )
+
+        self.log(
+            "train/grad_norm_pairformer_module",
+            self.gradient_norm(self.pairformer_module),
+            prog_bar=False,
+        )
+        self.log(
+            "train/param_norm_pairformer_module",
+            self.parameter_norm(self.pairformer_module),
+            prog_bar=False,
+        )
+
+        self.log(
+            "train/grad_norm_structure_module",
+            self.gradient_norm(self.structure_module),
+            prog_bar=False,
+        )
+        self.log(
+            "train/param_norm_structure_module",
+            self.parameter_norm(self.structure_module),
+            prog_bar=False,
+        )
+
+        if self.confidence_prediction:
+            self.log(
+                "train/grad_norm_confidence_module",
+                self.gradient_norm(self.confidence_module),
+                prog_bar=False,
+            )
+            self.log(
+                "train/param_norm_confidence_module",
+                self.parameter_norm(self.confidence_module),
+                prog_bar=False,
+            )
+
+    def on_train_epoch_end(self):
+        self.log(
+            "train/confidence_loss",
+            self.train_confidence_loss_logger,
+            prog_bar=False,
+            on_step=False,
+            on_epoch=True,
+        )
+        for k, v in self.train_confidence_loss_dict_logger.items():
+            self.log(f"train/{k}", v, prog_bar=False, on_step=False, on_epoch=True)
+
+    def gradient_norm(self, module) -> float:
+        # Only compute over parameters that are being trained
+        parameters = filter(lambda p: p.requires_grad, module.parameters())
+        parameters = filter(lambda p: p.grad is not None, parameters)
+        norm = torch.tensor([p.grad.norm(p=2) ** 2 for p in parameters]).sum().sqrt()
+        return norm
+
+    def parameter_norm(self, module) -> float:
+        # Only compute over parameters that are being trained
+        parameters = filter(lambda p: p.requires_grad, module.parameters())
+        norm = torch.tensor([p.norm(p=2) ** 2 for p in parameters]).sum().sqrt()
+        return norm
+
+    def validation_step(self, batch: dict[str, Tensor], batch_idx: int):
+        # Compute the forward pass
+        n_samples = self.validation_args.diffusion_samples
+        try:
+            out = self(
+                batch,
+                recycling_steps=self.validation_args.recycling_steps,
+                num_sampling_steps=self.validation_args.sampling_steps,
+                diffusion_samples=n_samples,
+                run_confidence_sequentially=self.validation_args.run_confidence_sequentially,
+            )
+
+        except RuntimeError as e:  # catch out of memory exceptions
+            if "out of memory" in str(e):
+                print("| WARNING: ran out of memory, skipping batch")
+                torch.cuda.empty_cache()
+                gc.collect()
+                return
+            else:
+                raise e
+
+        try:
+            # Compute distogram LDDT
+            boundaries = torch.linspace(2, 22.0, 63)
+            lower = torch.tensor([1.0])
+            upper = torch.tensor([22.0 + 5.0])
+            exp_boundaries = torch.cat((lower, boundaries, upper))
+            mid_points = ((exp_boundaries[:-1] + exp_boundaries[1:]) / 2).to(
+                out["pdistogram"]
+            )
+
+            # Compute predicted dists
+            preds = out["pdistogram"]
+            pred_softmax = torch.softmax(preds, dim=-1)
+            pred_softmax = pred_softmax.argmax(dim=-1)
+            pred_softmax = torch.nn.functional.one_hot(
+                pred_softmax, num_classes=preds.shape[-1]
+            )
+            pred_dist = (pred_softmax * mid_points).sum(dim=-1)
+            true_center = batch["disto_center"]
+            true_dists = torch.cdist(true_center, true_center)
+
+            # Compute lddt's
+            batch["token_disto_mask"] = batch["token_disto_mask"]
+            disto_lddt_dict, disto_total_dict = factored_token_lddt_dist_loss(
+                feats=batch,
+                true_d=true_dists,
+                pred_d=pred_dist,
+            )
+
+            true_coords, rmsds, best_rmsds, true_coords_resolved_mask = (
+                self.get_true_coordinates(
+                    batch=batch,
+                    out=out,
+                    diffusion_samples=n_samples,
+                    symmetry_correction=self.validation_args.symmetry_correction,
+                )
+            )
+
+            all_lddt_dict, all_total_dict = factored_lddt_loss(
+                feats=batch,
+                atom_mask=true_coords_resolved_mask,
+                true_atom_coords=true_coords,
+                pred_atom_coords=out["sample_atom_coords"],
+                multiplicity=n_samples,
+            )
+        except RuntimeError as e:  # catch out of memory exceptions
+            if "out of memory" in str(e):
+                print("| WARNING: ran out of memory, skipping batch")
+                torch.cuda.empty_cache()
+                gc.collect()
+                return
+            else:
+                raise e
+        # if the multiplicity used is > 1 then we take the best lddt of the different samples
+        # AF3 combines this with the confidence based filtering
+        best_lddt_dict, best_total_dict = {}, {}
+        best_complex_lddt_dict, best_complex_total_dict = {}, {}
+        B = true_coords.shape[0] // n_samples
+        if n_samples > 1:
+            # NOTE: we can change the way we aggregate the lddt
+            complex_total = 0
+            complex_lddt = 0
+            for key in all_lddt_dict.keys():
+                complex_lddt += all_lddt_dict[key] * all_total_dict[key]
+                complex_total += all_total_dict[key]
+            complex_lddt /= complex_total + 1e-7
+            best_complex_idx = complex_lddt.reshape(-1, n_samples).argmax(dim=1)
+            for key in all_lddt_dict:
+                best_idx = all_lddt_dict[key].reshape(-1, n_samples).argmax(dim=1)
+                best_lddt_dict[key] = all_lddt_dict[key].reshape(-1, n_samples)[
+                    torch.arange(B), best_idx
+                ]
+                best_total_dict[key] = all_total_dict[key].reshape(-1, n_samples)[
+                    torch.arange(B), best_idx
+                ]
+                best_complex_lddt_dict[key] = all_lddt_dict[key].reshape(-1, n_samples)[
+                    torch.arange(B), best_complex_idx
+                ]
+                best_complex_total_dict[key] = all_total_dict[key].reshape(
+                    -1, n_samples
+                )[torch.arange(B), best_complex_idx]
+        else:
+            best_lddt_dict = all_lddt_dict
+            best_total_dict = all_total_dict
+            best_complex_lddt_dict = all_lddt_dict
+            best_complex_total_dict = all_total_dict
+
+        # Filtering based on confidence
+        if self.confidence_prediction and n_samples > 1:
+            # note: for now we don't have pae predictions so have to use pLDDT instead of pTM
+            # also, while AF3 differentiates the best prediction per confidence type we are currently not doing it
+            # consider this in the future as well as weighing the different pLLDT types before aggregation
+            mae_plddt_dict, total_mae_plddt_dict = compute_plddt_mae(
+                pred_atom_coords=out["sample_atom_coords"],
+                feats=batch,
+                true_atom_coords=true_coords,
+                pred_lddt=out["plddt"],
+                true_coords_resolved_mask=true_coords_resolved_mask,
+                multiplicity=n_samples,
+            )
+            mae_pde_dict, total_mae_pde_dict = compute_pde_mae(
+                pred_atom_coords=out["sample_atom_coords"],
+                feats=batch,
+                true_atom_coords=true_coords,
+                pred_pde=out["pde"],
+                true_coords_resolved_mask=true_coords_resolved_mask,
+                multiplicity=n_samples,
+            )
+            mae_pae_dict, total_mae_pae_dict = compute_pae_mae(
+                pred_atom_coords=out["sample_atom_coords"],
+                feats=batch,
+                true_atom_coords=true_coords,
+                pred_pae=out["pae"],
+                true_coords_resolved_mask=true_coords_resolved_mask,
+                multiplicity=n_samples,
+            )
+
+            plddt = out["complex_plddt"].reshape(-1, n_samples)
+            top1_idx = plddt.argmax(dim=1)
+            iplddt = out["complex_iplddt"].reshape(-1, n_samples)
+            iplddt_top1_idx = iplddt.argmax(dim=1)
+            pde = out["complex_pde"].reshape(-1, n_samples)
+            pde_top1_idx = pde.argmin(dim=1)
+            ipde = out["complex_ipde"].reshape(-1, n_samples)
+            ipde_top1_idx = ipde.argmin(dim=1)
+            ptm = out["ptm"].reshape(-1, n_samples)
+            ptm_top1_idx = ptm.argmax(dim=1)
+            iptm = out["iptm"].reshape(-1, n_samples)
+            iptm_top1_idx = iptm.argmax(dim=1)
+            ligand_iptm = out["ligand_iptm"].reshape(-1, n_samples)
+            ligand_iptm_top1_idx = ligand_iptm.argmax(dim=1)
+            protein_iptm = out["protein_iptm"].reshape(-1, n_samples)
+            protein_iptm_top1_idx = protein_iptm.argmax(dim=1)
+
+            for key in all_lddt_dict:
+                top1_lddt = all_lddt_dict[key].reshape(-1, n_samples)[
+                    torch.arange(B), top1_idx
+                ]
+                top1_total = all_total_dict[key].reshape(-1, n_samples)[
+                    torch.arange(B), top1_idx
+                ]
+                iplddt_top1_lddt = all_lddt_dict[key].reshape(-1, n_samples)[
+                    torch.arange(B), iplddt_top1_idx
+                ]
+                iplddt_top1_total = all_total_dict[key].reshape(-1, n_samples)[
+                    torch.arange(B), iplddt_top1_idx
+                ]
+                pde_top1_lddt = all_lddt_dict[key].reshape(-1, n_samples)[
+                    torch.arange(B), pde_top1_idx
+                ]
+                pde_top1_total = all_total_dict[key].reshape(-1, n_samples)[
+                    torch.arange(B), pde_top1_idx
+                ]
+                ipde_top1_lddt = all_lddt_dict[key].reshape(-1, n_samples)[
+                    torch.arange(B), ipde_top1_idx
+                ]
+                ipde_top1_total = all_total_dict[key].reshape(-1, n_samples)[
+                    torch.arange(B), ipde_top1_idx
+                ]
+                ptm_top1_lddt = all_lddt_dict[key].reshape(-1, n_samples)[
+                    torch.arange(B), ptm_top1_idx
+                ]
+                ptm_top1_total = all_total_dict[key].reshape(-1, n_samples)[
+                    torch.arange(B), ptm_top1_idx
+                ]
+                iptm_top1_lddt = all_lddt_dict[key].reshape(-1, n_samples)[
+                    torch.arange(B), iptm_top1_idx
+                ]
+                iptm_top1_total = all_total_dict[key].reshape(-1, n_samples)[
+                    torch.arange(B), iptm_top1_idx
+                ]
+                ligand_iptm_top1_lddt = all_lddt_dict[key].reshape(-1, n_samples)[
+                    torch.arange(B), ligand_iptm_top1_idx
+                ]
+                ligand_iptm_top1_total = all_total_dict[key].reshape(-1, n_samples)[
+                    torch.arange(B), ligand_iptm_top1_idx
+                ]
+                protein_iptm_top1_lddt = all_lddt_dict[key].reshape(-1, n_samples)[
+                    torch.arange(B), protein_iptm_top1_idx
+                ]
+                protein_iptm_top1_total = all_total_dict[key].reshape(-1, n_samples)[
+                    torch.arange(B), protein_iptm_top1_idx
+                ]
+
+                self.top1_lddt[key].update(top1_lddt, top1_total)
+                self.iplddt_top1_lddt[key].update(iplddt_top1_lddt, iplddt_top1_total)
+                self.pde_top1_lddt[key].update(pde_top1_lddt, pde_top1_total)
+                self.ipde_top1_lddt[key].update(ipde_top1_lddt, ipde_top1_total)
+                self.ptm_top1_lddt[key].update(ptm_top1_lddt, ptm_top1_total)
+                self.iptm_top1_lddt[key].update(iptm_top1_lddt, iptm_top1_total)
+                self.ligand_iptm_top1_lddt[key].update(
+                    ligand_iptm_top1_lddt, ligand_iptm_top1_total
+                )
+                self.protein_iptm_top1_lddt[key].update(
+                    protein_iptm_top1_lddt, protein_iptm_top1_total
+                )
+
+                self.avg_lddt[key].update(all_lddt_dict[key], all_total_dict[key])
+                self.pde_mae[key].update(mae_pde_dict[key], total_mae_pde_dict[key])
+                self.pae_mae[key].update(mae_pae_dict[key], total_mae_pae_dict[key])
+
+            for key in mae_plddt_dict:
+                self.plddt_mae[key].update(
+                    mae_plddt_dict[key], total_mae_plddt_dict[key]
+                )
+
+        for m in const.out_types:
+            if m == "ligand_protein":
+                if torch.any(
+                    batch["pocket_feature"][
+                        :, :, const.pocket_contact_info["POCKET"]
+                    ].bool()
+                ):
+                    self.lddt["pocket_ligand_protein"].update(
+                        best_lddt_dict[m], best_total_dict[m]
+                    )
+                    self.disto_lddt["pocket_ligand_protein"].update(
+                        disto_lddt_dict[m], disto_total_dict[m]
+                    )
+                    self.complex_lddt["pocket_ligand_protein"].update(
+                        best_complex_lddt_dict[m], best_complex_total_dict[m]
+                    )
+                else:
+                    self.lddt["ligand_protein"].update(
+                        best_lddt_dict[m], best_total_dict[m]
+                    )
+                    self.disto_lddt["ligand_protein"].update(
+                        disto_lddt_dict[m], disto_total_dict[m]
+                    )
+                    self.complex_lddt["ligand_protein"].update(
+                        best_complex_lddt_dict[m], best_complex_total_dict[m]
+                    )
+            else:
+                self.lddt[m].update(best_lddt_dict[m], best_total_dict[m])
+                self.disto_lddt[m].update(disto_lddt_dict[m], disto_total_dict[m])
+                self.complex_lddt[m].update(
+                    best_complex_lddt_dict[m], best_complex_total_dict[m]
+                )
+        self.rmsd.update(rmsds)
+        self.best_rmsd.update(best_rmsds)
+
+    def on_validation_epoch_end(self):
+        avg_lddt = {}
+        avg_disto_lddt = {}
+        avg_complex_lddt = {}
+        if self.confidence_prediction:
+            avg_top1_lddt = {}
+            avg_iplddt_top1_lddt = {}
+            avg_pde_top1_lddt = {}
+            avg_ipde_top1_lddt = {}
+            avg_ptm_top1_lddt = {}
+            avg_iptm_top1_lddt = {}
+            avg_ligand_iptm_top1_lddt = {}
+            avg_protein_iptm_top1_lddt = {}
+
+            avg_avg_lddt = {}
+            avg_mae_plddt = {}
+            avg_mae_pde = {}
+            avg_mae_pae = {}
+
+        for m in const.out_types + ["pocket_ligand_protein"]:
+            avg_lddt[m] = self.lddt[m].compute()
+            avg_lddt[m] = 0.0 if torch.isnan(avg_lddt[m]) else avg_lddt[m].item()
+            self.lddt[m].reset()
+            self.log(f"val/lddt_{m}", avg_lddt[m], prog_bar=False, sync_dist=True)
+
+            avg_disto_lddt[m] = self.disto_lddt[m].compute()
+            avg_disto_lddt[m] = (
+                0.0 if torch.isnan(avg_disto_lddt[m]) else avg_disto_lddt[m].item()
+            )
+            self.disto_lddt[m].reset()
+            self.log(
+                f"val/disto_lddt_{m}", avg_disto_lddt[m], prog_bar=False, sync_dist=True
+            )
+            avg_complex_lddt[m] = self.complex_lddt[m].compute()
+            avg_complex_lddt[m] = (
+                0.0 if torch.isnan(avg_complex_lddt[m]) else avg_complex_lddt[m].item()
+            )
+            self.complex_lddt[m].reset()
+            self.log(
+                f"val/complex_lddt_{m}",
+                avg_complex_lddt[m],
+                prog_bar=False,
+                sync_dist=True,
+            )
+            if self.confidence_prediction:
+                avg_top1_lddt[m] = self.top1_lddt[m].compute()
+                avg_top1_lddt[m] = (
+                    0.0 if torch.isnan(avg_top1_lddt[m]) else avg_top1_lddt[m].item()
+                )
+                self.top1_lddt[m].reset()
+                self.log(
+                    f"val/top1_lddt_{m}",
+                    avg_top1_lddt[m],
+                    prog_bar=False,
+                    sync_dist=True,
+                )
+                avg_iplddt_top1_lddt[m] = self.iplddt_top1_lddt[m].compute()
+                avg_iplddt_top1_lddt[m] = (
+                    0.0
+                    if torch.isnan(avg_iplddt_top1_lddt[m])
+                    else avg_iplddt_top1_lddt[m].item()
+                )
+                self.iplddt_top1_lddt[m].reset()
+                self.log(
+                    f"val/iplddt_top1_lddt_{m}",
+                    avg_iplddt_top1_lddt[m],
+                    prog_bar=False,
+                    sync_dist=True,
+                )
+                avg_pde_top1_lddt[m] = self.pde_top1_lddt[m].compute()
+                avg_pde_top1_lddt[m] = (
+                    0.0
+                    if torch.isnan(avg_pde_top1_lddt[m])
+                    else avg_pde_top1_lddt[m].item()
+                )
+                self.pde_top1_lddt[m].reset()
+                self.log(
+                    f"val/pde_top1_lddt_{m}",
+                    avg_pde_top1_lddt[m],
+                    prog_bar=False,
+                    sync_dist=True,
+                )
+                avg_ipde_top1_lddt[m] = self.ipde_top1_lddt[m].compute()
+                avg_ipde_top1_lddt[m] = (
+                    0.0
+                    if torch.isnan(avg_ipde_top1_lddt[m])
+                    else avg_ipde_top1_lddt[m].item()
+                )
+                self.ipde_top1_lddt[m].reset()
+                self.log(
+                    f"val/ipde_top1_lddt_{m}",
+                    avg_ipde_top1_lddt[m],
+                    prog_bar=False,
+                    sync_dist=True,
+                )
+                avg_ptm_top1_lddt[m] = self.ptm_top1_lddt[m].compute()
+                avg_ptm_top1_lddt[m] = (
+                    0.0
+                    if torch.isnan(avg_ptm_top1_lddt[m])
+                    else avg_ptm_top1_lddt[m].item()
+                )
+                self.ptm_top1_lddt[m].reset()
+                self.log(
+                    f"val/ptm_top1_lddt_{m}",
+                    avg_ptm_top1_lddt[m],
+                    prog_bar=False,
+                    sync_dist=True,
+                )
+                avg_iptm_top1_lddt[m] = self.iptm_top1_lddt[m].compute()
+                avg_iptm_top1_lddt[m] = (
+                    0.0
+                    if torch.isnan(avg_iptm_top1_lddt[m])
+                    else avg_iptm_top1_lddt[m].item()
+                )
+                self.iptm_top1_lddt[m].reset()
+                self.log(
+                    f"val/iptm_top1_lddt_{m}",
+                    avg_iptm_top1_lddt[m],
+                    prog_bar=False,
+                    sync_dist=True,
+                )
+
+                avg_ligand_iptm_top1_lddt[m] = self.ligand_iptm_top1_lddt[m].compute()
+                avg_ligand_iptm_top1_lddt[m] = (
+                    0.0
+                    if torch.isnan(avg_ligand_iptm_top1_lddt[m])
+                    else avg_ligand_iptm_top1_lddt[m].item()
+                )
+                self.ligand_iptm_top1_lddt[m].reset()
+                self.log(
+                    f"val/ligand_iptm_top1_lddt_{m}",
+                    avg_ligand_iptm_top1_lddt[m],
+                    prog_bar=False,
+                    sync_dist=True,
+                )
+
+                avg_protein_iptm_top1_lddt[m] = self.protein_iptm_top1_lddt[m].compute()
+                avg_protein_iptm_top1_lddt[m] = (
+                    0.0
+                    if torch.isnan(avg_protein_iptm_top1_lddt[m])
+                    else avg_protein_iptm_top1_lddt[m].item()
+                )
+                self.protein_iptm_top1_lddt[m].reset()
+                self.log(
+                    f"val/protein_iptm_top1_lddt_{m}",
+                    avg_protein_iptm_top1_lddt[m],
+                    prog_bar=False,
+                    sync_dist=True,
+                )
+
+                avg_avg_lddt[m] = self.avg_lddt[m].compute()
+                avg_avg_lddt[m] = (
+                    0.0 if torch.isnan(avg_avg_lddt[m]) else avg_avg_lddt[m].item()
+                )
+                self.avg_lddt[m].reset()
+                self.log(
+                    f"val/avg_lddt_{m}", avg_avg_lddt[m], prog_bar=False, sync_dist=True
+                )
+                avg_mae_pde[m] = self.pde_mae[m].compute().item()
+                self.pde_mae[m].reset()
+                self.log(
+                    f"val/MAE_pde_{m}",
+                    avg_mae_pde[m],
+                    prog_bar=False,
+                    sync_dist=True,
+                )
+                avg_mae_pae[m] = self.pae_mae[m].compute().item()
+                self.pae_mae[m].reset()
+                self.log(
+                    f"val/MAE_pae_{m}",
+                    avg_mae_pae[m],
+                    prog_bar=False,
+                    sync_dist=True,
+                )
+
+        for m in const.out_single_types:
+            if self.confidence_prediction:
+                avg_mae_plddt[m] = self.plddt_mae[m].compute().item()
+                self.plddt_mae[m].reset()
+                self.log(
+                    f"val/MAE_plddt_{m}",
+                    avg_mae_plddt[m],
+                    prog_bar=False,
+                    sync_dist=True,
+                )
+
+        overall_disto_lddt = sum(
+            avg_disto_lddt[m] * w for (m, w) in const.out_types_weights.items()
+        ) / sum(const.out_types_weights.values())
+        self.log("val/disto_lddt", overall_disto_lddt, prog_bar=True, sync_dist=True)
+
+        overall_lddt = sum(
+            avg_lddt[m] * w for (m, w) in const.out_types_weights.items()
+        ) / sum(const.out_types_weights.values())
+        self.log("val/lddt", overall_lddt, prog_bar=True, sync_dist=True)
+
+        overall_complex_lddt = sum(
+            avg_complex_lddt[m] * w for (m, w) in const.out_types_weights.items()
+        ) / sum(const.out_types_weights.values())
+        self.log(
+            "val/complex_lddt", overall_complex_lddt, prog_bar=True, sync_dist=True
+        )
+
+        if self.confidence_prediction:
+            overall_top1_lddt = sum(
+                avg_top1_lddt[m] * w for (m, w) in const.out_types_weights.items()
+            ) / sum(const.out_types_weights.values())
+            self.log("val/top1_lddt", overall_top1_lddt, prog_bar=True, sync_dist=True)
+
+            overall_iplddt_top1_lddt = sum(
+                avg_iplddt_top1_lddt[m] * w
+                for (m, w) in const.out_types_weights.items()
+            ) / sum(const.out_types_weights.values())
+            self.log(
+                "val/iplddt_top1_lddt",
+                overall_iplddt_top1_lddt,
+                prog_bar=True,
+                sync_dist=True,
+            )
+
+            overall_pde_top1_lddt = sum(
+                avg_pde_top1_lddt[m] * w for (m, w) in const.out_types_weights.items()
+            ) / sum(const.out_types_weights.values())
+            self.log(
+                "val/pde_top1_lddt",
+                overall_pde_top1_lddt,
+                prog_bar=True,
+                sync_dist=True,
+            )
+
+            overall_ipde_top1_lddt = sum(
+                avg_ipde_top1_lddt[m] * w for (m, w) in const.out_types_weights.items()
+            ) / sum(const.out_types_weights.values())
+            self.log(
+                "val/ipde_top1_lddt",
+                overall_ipde_top1_lddt,
+                prog_bar=True,
+                sync_dist=True,
+            )
+
+            overall_ptm_top1_lddt = sum(
+                avg_ptm_top1_lddt[m] * w for (m, w) in const.out_types_weights.items()
+            ) / sum(const.out_types_weights.values())
+            self.log(
+                "val/ptm_top1_lddt",
+                overall_ptm_top1_lddt,
+                prog_bar=True,
+                sync_dist=True,
+            )
+
+            overall_iptm_top1_lddt = sum(
+                avg_iptm_top1_lddt[m] * w for (m, w) in const.out_types_weights.items()
+            ) / sum(const.out_types_weights.values())
+            self.log(
+                "val/iptm_top1_lddt",
+                overall_iptm_top1_lddt,
+                prog_bar=True,
+                sync_dist=True,
+            )
+
+            overall_avg_lddt = sum(
+                avg_avg_lddt[m] * w for (m, w) in const.out_types_weights.items()
+            ) / sum(const.out_types_weights.values())
+            self.log("val/avg_lddt", overall_avg_lddt, prog_bar=True, sync_dist=True)
+
+        self.log("val/rmsd", self.rmsd.compute(), prog_bar=True, sync_dist=True)
+        self.rmsd.reset()
+
+        self.log(
+            "val/best_rmsd", self.best_rmsd.compute(), prog_bar=True, sync_dist=True
+        )
+        self.best_rmsd.reset()
+
+    def predict_step(self, batch: Any, batch_idx: int, dataloader_idx: int = 0) -> Any:
+        try:
+            out = self(
+                batch,
+                recycling_steps=self.predict_args["recycling_steps"],
+                num_sampling_steps=self.predict_args["sampling_steps"],
+                diffusion_samples=self.predict_args["diffusion_samples"],
+                max_parallel_samples=self.predict_args["diffusion_samples"],
+                run_confidence_sequentially=True,
+            )
+            pred_dict = {"exception": False}
+            pred_dict["masks"] = batch["atom_pad_mask"]
+            pred_dict["coords"] = out["sample_atom_coords"]
+            pred_dict["s"] = out["s"]
+            pred_dict["z"] = out["z"]
+            if self.predict_args.get("write_confidence_summary", True):
+                pred_dict["confidence_score"] = (
+                    4 * out["complex_plddt"]
+                    + (
+                        out["iptm"]
+                        if not torch.allclose(
+                            out["iptm"], torch.zeros_like(out["iptm"])
+                        )
+                        else out["ptm"]
+                    )
+                ) / 5
+                for key in [
+                    "ptm",
+                    "iptm",
+                    "ligand_iptm",
+                    "protein_iptm",
+                    "pair_chains_iptm",
+                    "complex_plddt",
+                    "complex_iplddt",
+                    "complex_pde",
+                    "complex_ipde",
+                    "plddt",
+                ]:
+                    pred_dict[key] = out[key]
+            if self.predict_args.get("write_full_pae", True):
+                pred_dict["pae"] = out["pae"]
+            if self.predict_args.get("write_full_pde", False):
+                pred_dict["pde"] = out["pde"]
+            return pred_dict
+
+        except RuntimeError as e:  # catch out of memory exceptions
+            if "out of memory" in str(e):
+                print("| WARNING: ran out of memory, skipping batch")
+                torch.cuda.empty_cache()
+                gc.collect()
+                return {"exception": True}
+            else:
+                raise
+
+    def configure_optimizers(self):
+        """Configure the optimizer."""
+
+        if self.structure_prediction_training:
+            parameters = [p for p in self.parameters() if p.requires_grad]
+        else:
+            parameters = [
+                p for p in self.confidence_module.parameters() if p.requires_grad
+            ] + [
+                p
+                for p in self.structure_module.out_token_feat_update.parameters()
+                if p.requires_grad
+            ]
+
+        optimizer = torch.optim.Adam(
+            parameters,
+            betas=(self.training_args.adam_beta_1, self.training_args.adam_beta_2),
+            eps=self.training_args.adam_eps,
+            lr=self.training_args.base_lr,
+        )
+        if self.training_args.lr_scheduler == "af3":
+            scheduler = AlphaFoldLRScheduler(
+                optimizer,
+                base_lr=self.training_args.base_lr,
+                max_lr=self.training_args.max_lr,
+                warmup_no_steps=self.training_args.lr_warmup_no_steps,
+                start_decay_after_n_steps=self.training_args.lr_start_decay_after_n_steps,
+                decay_every_n_steps=self.training_args.lr_decay_every_n_steps,
+                decay_factor=self.training_args.lr_decay_factor,
+            )
+            return [optimizer], [{"scheduler": scheduler, "interval": "step"}]
+
+        return optimizer
+
+    def on_save_checkpoint(self, checkpoint: dict[str, Any]) -> None:
+        if self.use_ema:
+            checkpoint["ema"] = self.ema.state_dict()
+
+    def on_load_checkpoint(self, checkpoint: dict[str, Any]) -> None:
+        if self.use_ema and "ema" in checkpoint:
+            self.ema = ExponentialMovingAverage(
+                parameters=self.parameters(), decay=self.ema_decay
+            )
+            if self.ema.compatible(checkpoint["ema"]["shadow_params"]):
+                self.ema.load_state_dict(checkpoint["ema"], device=torch.device("cpu"))
+            else:
+                self.ema = None
+                print(
+                    "Warning: EMA state not loaded due to incompatible model parameters."
+                )
+
+    def on_train_start(self):
+        if self.use_ema and self.ema is None:
+            self.ema = ExponentialMovingAverage(
+                parameters=self.parameters(), decay=self.ema_decay
+            )
+        elif self.use_ema:
+            self.ema.to(self.device)
+
+    def on_train_epoch_start(self) -> None:
+        if self.use_ema:
+            self.ema.restore(self.parameters())
+
+    def on_train_batch_end(self, outputs, batch: Any, batch_idx: int) -> None:
+        # Updates EMA parameters after optimizer.step()
+        if self.use_ema:
+            self.ema.update(self.parameters())
+
+    def prepare_eval(self) -> None:
+        if self.use_ema and self.ema is None:
+            self.ema = ExponentialMovingAverage(
+                parameters=self.parameters(), decay=self.ema_decay
+            )
+
+        if self.use_ema:
+            self.ema.store(self.parameters())
+            self.ema.copy_to(self.parameters())
+
+    def on_validation_start(self):
+        self.prepare_eval()
+
+    def on_predict_start(self) -> None:
+        self.prepare_eval()
+
+    def on_test_start(self) -> None:
+        self.prepare_eval()
diff --git a/forks/boltz/src/boltz/model/models/boltz2.py b/forks/boltz/src/boltz/model/models/boltz2.py
new file mode 100644
index 00000000..d42f3400
--- /dev/null
+++ b/forks/boltz/src/boltz/model/models/boltz2.py
@@ -0,0 +1,1255 @@
+import gc
+from typing import Any, Optional
+
+import numpy as np
+import torch
+import torch._dynamo
+from pytorch_lightning import Callback, LightningModule
+from torch import Tensor, nn
+from torchmetrics import MeanMetric
+
+import boltz.model.layers.initialize as init
+from boltz.data import const
+from boltz.data.mol import (
+    minimum_lddt_symmetry_coords,
+)
+from boltz.model.layers.pairformer import PairformerModule
+from boltz.model.loss.bfactor import bfactor_loss_fn
+from boltz.model.loss.confidencev2 import (
+    confidence_loss,
+)
+from boltz.model.loss.distogramv2 import distogram_loss
+from boltz.model.modules.affinity import AffinityModule
+from boltz.model.modules.confidencev2 import ConfidenceModule
+from boltz.model.modules.diffusion_conditioning import DiffusionConditioning
+from boltz.model.modules.diffusionv2 import AtomDiffusion
+from boltz.model.modules.encodersv2 import RelativePositionEncoder
+from boltz.model.modules.trunkv2 import (
+    BFactorModule,
+    ContactConditioning,
+    DistogramModule,
+    InputEmbedder,
+    MSAModule,
+    TemplateModule,
+    TemplateV2Module,
+)
+from boltz.model.optim.ema import EMA
+from boltz.model.optim.scheduler import AlphaFoldLRScheduler
+
+
+class Boltz2(LightningModule):
+    """Boltz2 model."""
+
+    def __init__(
+        self,
+        atom_s: int,
+        atom_z: int,
+        token_s: int,
+        token_z: int,
+        num_bins: int,
+        training_args: dict[str, Any],
+        validation_args: dict[str, Any],
+        embedder_args: dict[str, Any],
+        msa_args: dict[str, Any],
+        pairformer_args: dict[str, Any],
+        score_model_args: dict[str, Any],
+        diffusion_process_args: dict[str, Any],
+        diffusion_loss_args: dict[str, Any],
+        confidence_model_args: Optional[dict[str, Any]] = None,
+        affinity_model_args: Optional[dict[str, Any]] = None,
+        affinity_model_args1: Optional[dict[str, Any]] = None,
+        affinity_model_args2: Optional[dict[str, Any]] = None,
+        validators: Any = None,
+        num_val_datasets: int = 1,
+        atom_feature_dim: int = 128,
+        template_args: Optional[dict] = None,
+        confidence_prediction: bool = True,
+        affinity_prediction: bool = False,
+        affinity_ensemble: bool = False,
+        affinity_mw_correction: bool = True,
+        run_trunk_and_structure: bool = True,
+        skip_run_structure: bool = False,
+        token_level_confidence: bool = True,
+        alpha_pae: float = 0.0,
+        structure_prediction_training: bool = True,
+        validate_structure: bool = True,
+        atoms_per_window_queries: int = 32,
+        atoms_per_window_keys: int = 128,
+        compile_pairformer: bool = False,
+        compile_structure: bool = False,
+        compile_confidence: bool = False,
+        compile_affinity: bool = False,
+        compile_msa: bool = False,
+        exclude_ions_from_lddt: bool = False,
+        ema: bool = False,
+        ema_decay: float = 0.999,
+        min_dist: float = 2.0,
+        max_dist: float = 22.0,
+        predict_args: Optional[dict[str, Any]] = None,
+        fix_sym_check: bool = False,
+        cyclic_pos_enc: bool = False,
+        aggregate_distogram: bool = True,
+        bond_type_feature: bool = False,
+        use_no_atom_char: bool = False,
+        no_random_recycling_training: bool = False,
+        use_atom_backbone_feat: bool = False,
+        use_residue_feats_atoms: bool = False,
+        conditioning_cutoff_min: float = 4.0,
+        conditioning_cutoff_max: float = 20.0,
+        steering_args: Optional[dict] = None,
+        use_templates: bool = False,
+        compile_templates: bool = False,
+        predict_bfactor: bool = False,
+        log_loss_every_steps: int = 50,
+        checkpoint_diffusion_conditioning: bool = False,
+        use_templates_v2: bool = False,
+        use_kernels: bool = False,
+    ) -> None:
+        super().__init__()
+        self.save_hyperparameters(ignore=["validators"])
+
+        # No random recycling
+        self.no_random_recycling_training = no_random_recycling_training
+
+        if validate_structure:
+            # Late init at setup time
+            self.val_group_mapper = {}  # maps a dataset index to a validation group name
+            self.validator_mapper = {}  # maps a dataset index to a validator
+
+            # Validators for each dataset keep track of all metrics,
+            # compute validation, aggregate results and log
+            self.validators = nn.ModuleList(validators)
+
+        self.num_val_datasets = num_val_datasets
+        self.log_loss_every_steps = log_loss_every_steps
+
+        # EMA
+        self.use_ema = ema
+        self.ema_decay = ema_decay
+
+        # Arguments
+        self.training_args = training_args
+        self.validation_args = validation_args
+        self.diffusion_loss_args = diffusion_loss_args
+        self.predict_args = predict_args
+        self.steering_args = steering_args
+
+        # Training metrics
+        if validate_structure:
+            self.train_confidence_loss_logger = MeanMetric()
+            self.train_confidence_loss_dict_logger = nn.ModuleDict()
+            for m in [
+                "plddt_loss",
+                "resolved_loss",
+                "pde_loss",
+                "pae_loss",
+            ]:
+                self.train_confidence_loss_dict_logger[m] = MeanMetric()
+
+        self.exclude_ions_from_lddt = exclude_ions_from_lddt
+
+        # Distogram
+        self.num_bins = num_bins
+        self.min_dist = min_dist
+        self.max_dist = max_dist
+        self.aggregate_distogram = aggregate_distogram
+
+        # Trunk
+        self.is_pairformer_compiled = False
+        self.is_msa_compiled = False
+        self.is_template_compiled = False
+
+        # Kernels
+        self.use_kernels = use_kernels
+
+        # Input embeddings
+        full_embedder_args = {
+            "atom_s": atom_s,
+            "atom_z": atom_z,
+            "token_s": token_s,
+            "token_z": token_z,
+            "atoms_per_window_queries": atoms_per_window_queries,
+            "atoms_per_window_keys": atoms_per_window_keys,
+            "atom_feature_dim": atom_feature_dim,
+            "use_no_atom_char": use_no_atom_char,
+            "use_atom_backbone_feat": use_atom_backbone_feat,
+            "use_residue_feats_atoms": use_residue_feats_atoms,
+            **embedder_args,
+        }
+        self.input_embedder = InputEmbedder(**full_embedder_args)
+
+        self.s_init = nn.Linear(token_s, token_s, bias=False)
+        self.z_init_1 = nn.Linear(token_s, token_z, bias=False)
+        self.z_init_2 = nn.Linear(token_s, token_z, bias=False)
+
+        self.rel_pos = RelativePositionEncoder(
+            token_z, fix_sym_check=fix_sym_check, cyclic_pos_enc=cyclic_pos_enc
+        )
+
+        self.token_bonds = nn.Linear(1, token_z, bias=False)
+        self.bond_type_feature = bond_type_feature
+        if bond_type_feature:
+            self.token_bonds_type = nn.Embedding(len(const.bond_types) + 1, token_z)
+
+        self.contact_conditioning = ContactConditioning(
+            token_z=token_z,
+            cutoff_min=conditioning_cutoff_min,
+            cutoff_max=conditioning_cutoff_max,
+        )
+
+        # Normalization layers
+        self.s_norm = nn.LayerNorm(token_s)
+        self.z_norm = nn.LayerNorm(token_z)
+
+        # Recycling projections
+        self.s_recycle = nn.Linear(token_s, token_s, bias=False)
+        self.z_recycle = nn.Linear(token_z, token_z, bias=False)
+        init.gating_init_(self.s_recycle.weight)
+        init.gating_init_(self.z_recycle.weight)
+
+        # Set compile rules
+        # Big models hit the default cache limit (8)
+        torch._dynamo.config.cache_size_limit = 512  # noqa: SLF001
+        torch._dynamo.config.accumulated_cache_size_limit = 512  # noqa: SLF001
+
+        # Pairwise stack
+        self.use_templates = use_templates
+        if use_templates:
+            if use_templates_v2:
+                self.template_module = TemplateV2Module(token_z, **template_args)
+            else:
+                self.template_module = TemplateModule(token_z, **template_args)
+            if compile_templates:
+                self.is_template_compiled = True
+                self.template_module = torch.compile(
+                    self.template_module,
+                    dynamic=False,
+                    fullgraph=False,
+                )
+
+        self.msa_module = MSAModule(
+            token_z=token_z,
+            token_s=token_s,
+            **msa_args,
+        )
+        if compile_msa:
+            self.is_msa_compiled = True
+            self.msa_module = torch.compile(
+                self.msa_module,
+                dynamic=False,
+                fullgraph=False,
+            )
+        self.pairformer_module = PairformerModule(token_s, token_z, **pairformer_args)
+        if compile_pairformer:
+            self.is_pairformer_compiled = True
+            self.pairformer_module = torch.compile(
+                self.pairformer_module,
+                dynamic=False,
+                fullgraph=False,
+            )
+
+        self.checkpoint_diffusion_conditioning = checkpoint_diffusion_conditioning
+        self.diffusion_conditioning = DiffusionConditioning(
+            token_s=token_s,
+            token_z=token_z,
+            atom_s=atom_s,
+            atom_z=atom_z,
+            atoms_per_window_queries=atoms_per_window_queries,
+            atoms_per_window_keys=atoms_per_window_keys,
+            atom_encoder_depth=score_model_args["atom_encoder_depth"],
+            atom_encoder_heads=score_model_args["atom_encoder_heads"],
+            token_transformer_depth=score_model_args["token_transformer_depth"],
+            token_transformer_heads=score_model_args["token_transformer_heads"],
+            atom_decoder_depth=score_model_args["atom_decoder_depth"],
+            atom_decoder_heads=score_model_args["atom_decoder_heads"],
+            atom_feature_dim=atom_feature_dim,
+            conditioning_transition_layers=score_model_args[
+                "conditioning_transition_layers"
+            ],
+            use_no_atom_char=use_no_atom_char,
+            use_atom_backbone_feat=use_atom_backbone_feat,
+            use_residue_feats_atoms=use_residue_feats_atoms,
+        )
+
+        # Output modules
+        self.structure_module = AtomDiffusion(
+            score_model_args={
+                "token_s": token_s,
+                "atom_s": atom_s,
+                "atoms_per_window_queries": atoms_per_window_queries,
+                "atoms_per_window_keys": atoms_per_window_keys,
+                **score_model_args,
+            },
+            compile_score=compile_structure,
+            **diffusion_process_args,
+        )
+        self.distogram_module = DistogramModule(
+            token_z,
+            num_bins,
+        )
+        self.predict_bfactor = predict_bfactor
+        if predict_bfactor:
+            self.bfactor_module = BFactorModule(token_s, num_bins)
+
+        self.confidence_prediction = confidence_prediction
+        self.affinity_prediction = affinity_prediction
+        self.affinity_ensemble = affinity_ensemble
+        self.affinity_mw_correction = affinity_mw_correction
+        self.run_trunk_and_structure = run_trunk_and_structure
+        self.skip_run_structure = skip_run_structure
+        self.token_level_confidence = token_level_confidence
+        self.alpha_pae = alpha_pae
+        self.structure_prediction_training = structure_prediction_training
+
+        if self.confidence_prediction:
+            self.confidence_module = ConfidenceModule(
+                token_s,
+                token_z,
+                token_level_confidence=token_level_confidence,
+                bond_type_feature=bond_type_feature,
+                fix_sym_check=fix_sym_check,
+                cyclic_pos_enc=cyclic_pos_enc,
+                conditioning_cutoff_min=conditioning_cutoff_min,
+                conditioning_cutoff_max=conditioning_cutoff_max,
+                **confidence_model_args,
+            )
+            if compile_confidence:
+                self.confidence_module = torch.compile(
+                    self.confidence_module, dynamic=False, fullgraph=False
+                )
+
+        if self.affinity_prediction:
+            if self.affinity_ensemble:
+                self.affinity_module1 = AffinityModule(
+                    token_s,
+                    token_z,
+                    **affinity_model_args1,
+                )
+                self.affinity_module2 = AffinityModule(
+                    token_s,
+                    token_z,
+                    **affinity_model_args2,
+                )
+                if compile_affinity:
+                    self.affinity_module1 = torch.compile(
+                        self.affinity_module1, dynamic=False, fullgraph=False
+                    )
+                    self.affinity_module2 = torch.compile(
+                        self.affinity_module2, dynamic=False, fullgraph=False
+                    )
+            else:
+                self.affinity_module = AffinityModule(
+                    token_s,
+                    token_z,
+                    **affinity_model_args,
+                )
+                if compile_affinity:
+                    self.affinity_module = torch.compile(
+                        self.affinity_module, dynamic=False, fullgraph=False
+                    )
+
+        # Remove grad from weights they are not trained for ddp
+        if not structure_prediction_training:
+            for name, param in self.named_parameters():
+                if (
+                    name.split(".")[0] not in ["confidence_module", "affinity_module"]
+                    and "out_token_feat_update" not in name
+                ):
+                    param.requires_grad = False
+
+    def setup(self, stage: str) -> None:
+        """Set the model for training, validation and inference."""
+        if stage == "predict" and not (
+            torch.cuda.is_available()
+            and torch.cuda.get_device_properties(torch.device("cuda")).major >= 8.0  # noqa: PLR2004
+        ):
+            self.use_kernels = False
+
+        if (
+            stage != "predict"
+            and hasattr(self.trainer, "datamodule")
+            and self.trainer.datamodule
+            and self.validate_structure
+        ):
+            self.val_group_mapper.update(self.trainer.datamodule.val_group_mapper)
+
+            l1 = len(self.val_group_mapper)
+            l2 = self.num_val_datasets
+            msg = (
+                f"Number of validation datasets num_val_datasets={l2} "
+                f"does not match the number of val_group_mapper entries={l1}."
+            )
+            assert l1 == l2, msg
+
+            # Map an index to a validator, and double check val names
+            # match from datamodule
+            all_validator_names = []
+            for validator in self.validators:
+                for val_name in validator.val_names:
+                    msg = f"Validator {val_name} duplicated in validators."
+                    assert val_name not in all_validator_names, msg
+                    all_validator_names.append(val_name)
+                    for val_idx, val_group in self.val_group_mapper.items():
+                        if val_name == val_group["label"]:
+                            self.validator_mapper[val_idx] = validator
+
+            msg = "Mismatch between validator names and val_group_mapper values."
+            assert set(all_validator_names) == {
+                x["label"] for x in self.val_group_mapper.values()
+            }, msg
+
+    def forward(
+        self,
+        feats: dict[str, Tensor],
+        recycling_steps: int = 0,
+        num_sampling_steps: Optional[int] = None,
+        multiplicity_diffusion_train: int = 1,
+        diffusion_samples: int = 1,
+        max_parallel_samples: Optional[int] = None,
+        run_confidence_sequentially: bool = False,
+    ) -> dict[str, Tensor]:
+        with torch.set_grad_enabled(
+            self.training and self.structure_prediction_training
+        ):
+            s_inputs = self.input_embedder(feats)
+
+            # Initialize the sequence embeddings
+            s_init = self.s_init(s_inputs)
+
+            # Initialize pairwise embeddings
+            z_init = (
+                self.z_init_1(s_inputs)[:, :, None]
+                + self.z_init_2(s_inputs)[:, None, :]
+            )
+            relative_position_encoding = self.rel_pos(feats)
+            z_init = z_init + relative_position_encoding
+            z_init = z_init + self.token_bonds(feats["token_bonds"].float())
+            if self.bond_type_feature:
+                z_init = z_init + self.token_bonds_type(feats["type_bonds"].long())
+            z_init = z_init + self.contact_conditioning(feats)
+
+            # Perform rounds of the pairwise stack
+            s = torch.zeros_like(s_init)
+            z = torch.zeros_like(z_init)
+
+            # Compute pairwise mask
+            mask = feats["token_pad_mask"].float()
+            pair_mask = mask[:, :, None] * mask[:, None, :]
+            if self.run_trunk_and_structure:
+                for i in range(recycling_steps + 1):
+                    with torch.set_grad_enabled(
+                        self.training
+                        and self.structure_prediction_training
+                        and (i == recycling_steps)
+                    ):
+                        # Issue with unused parameters in autocast
+                        if (
+                            self.training
+                            and (i == recycling_steps)
+                            and torch.is_autocast_enabled()
+                        ):
+                            torch.clear_autocast_cache()
+
+                        # Apply recycling
+                        s = s_init + self.s_recycle(self.s_norm(s))
+                        z = z_init + self.z_recycle(self.z_norm(z))
+
+                        # Compute pairwise stack
+                        if self.use_templates:
+                            if self.is_template_compiled and not self.training:
+                                template_module = self.template_module._orig_mod  # noqa: SLF001
+                            else:
+                                template_module = self.template_module
+
+                            z = z + template_module(
+                                z, feats, pair_mask, use_kernels=self.use_kernels
+                            )
+
+                        if self.is_msa_compiled and not self.training:
+                            msa_module = self.msa_module._orig_mod  # noqa: SLF001
+                        else:
+                            msa_module = self.msa_module
+
+                        z = z + msa_module(
+                            z, s_inputs, feats, use_kernels=self.use_kernels
+                        )
+
+                        # Revert to uncompiled version for validation
+                        if self.is_pairformer_compiled and not self.training:
+                            pairformer_module = self.pairformer_module._orig_mod  # noqa: SLF001
+                        else:
+                            pairformer_module = self.pairformer_module
+
+                        s, z = pairformer_module(
+                            s,
+                            z,
+                            mask=mask,
+                            pair_mask=pair_mask,
+                            use_kernels=self.use_kernels,
+                        )
+
+            pdistogram = self.distogram_module(z)
+            dict_out = {
+                "pdistogram": pdistogram,
+                "s": s,
+                "z": z,
+            }
+
+            if (
+                self.run_trunk_and_structure
+                and ((not self.training) or self.confidence_prediction)
+                and (not self.skip_run_structure)
+            ):
+                if self.checkpoint_diffusion_conditioning and self.training:
+                    # TODO decide whether this should be with bf16 or not
+                    q, c, to_keys, atom_enc_bias, atom_dec_bias, token_trans_bias = (
+                        torch.utils.checkpoint.checkpoint(
+                            self.diffusion_conditioning,
+                            s,
+                            z,
+                            relative_position_encoding,
+                            feats,
+                        )
+                    )
+                else:
+                    q, c, to_keys, atom_enc_bias, atom_dec_bias, token_trans_bias = (
+                        self.diffusion_conditioning(
+                            s_trunk=s,
+                            z_trunk=z,
+                            relative_position_encoding=relative_position_encoding,
+                            feats=feats,
+                        )
+                    )
+                diffusion_conditioning = {
+                    "q": q,
+                    "c": c,
+                    "to_keys": to_keys,
+                    "atom_enc_bias": atom_enc_bias,
+                    "atom_dec_bias": atom_dec_bias,
+                    "token_trans_bias": token_trans_bias,
+                }
+
+                with torch.autocast("cuda", enabled=False):
+                    struct_out = self.structure_module.sample(
+                        s_trunk=s.float(),
+                        s_inputs=s_inputs.float(),
+                        feats=feats,
+                        num_sampling_steps=num_sampling_steps,
+                        atom_mask=feats["atom_pad_mask"].float(),
+                        multiplicity=diffusion_samples,
+                        max_parallel_samples=max_parallel_samples,
+                        steering_args=self.steering_args,
+                        diffusion_conditioning=diffusion_conditioning,
+                    )
+                    dict_out.update(struct_out)
+
+                if self.predict_bfactor:
+                    pbfactor = self.bfactor_module(s)
+                    dict_out["pbfactor"] = pbfactor
+
+            if self.training and self.confidence_prediction:
+                assert len(feats["coords"].shape) == 4
+                assert feats["coords"].shape[1] == 1, (
+                    "Only one conformation is supported for confidence"
+                )
+
+            # Compute structure module
+            if self.training and self.structure_prediction_training:
+                atom_coords = feats["coords"]
+                B, K, L = atom_coords.shape[0:3]
+                assert K in (
+                    multiplicity_diffusion_train,
+                    1,
+                )  # TODO make check somewhere else, expand to m % N == 0, m > N
+                atom_coords = atom_coords.reshape(B * K, L, 3)
+                atom_coords = atom_coords.repeat_interleave(
+                    multiplicity_diffusion_train // K, 0
+                )
+                feats["coords"] = atom_coords  # (multiplicity, L, 3)
+                assert len(feats["coords"].shape) == 3
+
+                with torch.autocast("cuda", enabled=False):
+                    struct_out = self.structure_module(
+                        s_trunk=s.float(),
+                        s_inputs=s_inputs.float(),
+                        feats=feats,
+                        multiplicity=multiplicity_diffusion_train,
+                        diffusion_conditioning=diffusion_conditioning,
+                    )
+                    dict_out.update(struct_out)
+
+            elif self.training:
+                feats["coords"] = feats["coords"].squeeze(1)
+                assert len(feats["coords"].shape) == 3
+
+        if self.confidence_prediction:
+            dict_out.update(
+                self.confidence_module(
+                    s_inputs=s_inputs.detach(),
+                    s=s.detach(),
+                    z=z.detach(),
+                    x_pred=(
+                        dict_out["sample_atom_coords"].detach()
+                        if not self.skip_run_structure
+                        else feats["coords"].repeat_interleave(diffusion_samples, 0)
+                    ),
+                    feats=feats,
+                    pred_distogram_logits=(
+                        dict_out["pdistogram"][
+                            :, :, :, 0
+                        ].detach()  # TODO only implemented for 1 distogram
+                    ),
+                    multiplicity=diffusion_samples,
+                    run_sequentially=run_confidence_sequentially,
+                    use_kernels=self.use_kernels,
+                )
+            )
+
+        if self.affinity_prediction:
+            pad_token_mask = feats["token_pad_mask"][0]
+            rec_mask = feats["mol_type"][0] == 0
+            rec_mask = rec_mask * pad_token_mask
+            lig_mask = feats["affinity_token_mask"][0].to(torch.bool)
+            lig_mask = lig_mask * pad_token_mask
+            cross_pair_mask = (
+                lig_mask[:, None] * rec_mask[None, :]
+                + rec_mask[:, None] * lig_mask[None, :]
+                + lig_mask[:, None] * lig_mask[None, :]
+            )
+            z_affinity = z * cross_pair_mask[None, :, :, None]
+
+            argsort = torch.argsort(dict_out["iptm"], descending=True)
+            best_idx = argsort[0].item()
+            coords_affinity = dict_out["sample_atom_coords"].detach()[best_idx][
+                None, None
+            ]
+            s_inputs = self.input_embedder(feats, affinity=True)
+
+            with torch.autocast("cuda", enabled=False):
+                if self.affinity_ensemble:
+                    dict_out_affinity1 = self.affinity_module1(
+                        s_inputs=s_inputs.detach(),
+                        z=z_affinity.detach(),
+                        x_pred=coords_affinity,
+                        feats=feats,
+                        multiplicity=1,
+                        use_kernels=self.use_kernels,
+                    )
+
+                    dict_out_affinity1["affinity_probability_binary"] = (
+                        torch.nn.functional.sigmoid(
+                            dict_out_affinity1["affinity_logits_binary"]
+                        )
+                    )
+                    dict_out_affinity2 = self.affinity_module2(
+                        s_inputs=s_inputs.detach(),
+                        z=z_affinity.detach(),
+                        x_pred=coords_affinity,
+                        feats=feats,
+                        multiplicity=1,
+                        use_kernels=self.use_kernels,
+                    )
+                    dict_out_affinity2["affinity_probability_binary"] = (
+                        torch.nn.functional.sigmoid(
+                            dict_out_affinity2["affinity_logits_binary"]
+                        )
+                    )
+
+                    dict_out_affinity_ensemble = {
+                        "affinity_pred_value": (
+                            dict_out_affinity1["affinity_pred_value"]
+                            + dict_out_affinity2["affinity_pred_value"]
+                        )
+                        / 2,
+                        "affinity_probability_binary": (
+                            dict_out_affinity1["affinity_probability_binary"]
+                            + dict_out_affinity2["affinity_probability_binary"]
+                        )
+                        / 2,
+                    }
+
+                    dict_out_affinity1 = {
+                        "affinity_pred_value1": dict_out_affinity1[
+                            "affinity_pred_value"
+                        ],
+                        "affinity_probability_binary1": dict_out_affinity1[
+                            "affinity_probability_binary"
+                        ],
+                    }
+                    dict_out_affinity2 = {
+                        "affinity_pred_value2": dict_out_affinity2[
+                            "affinity_pred_value"
+                        ],
+                        "affinity_probability_binary2": dict_out_affinity2[
+                            "affinity_probability_binary"
+                        ],
+                    }
+                    if self.affinity_mw_correction:
+                        model_coef = 1.03525938
+                        mw_coef = -0.59992683
+                        bias = 2.83288489
+                        mw = feats["affinity_mw"][0] ** 0.3
+                        dict_out_affinity_ensemble["affinity_pred_value"] = (
+                            model_coef
+                            * dict_out_affinity_ensemble["affinity_pred_value"]
+                            + mw_coef * mw
+                            + bias
+                        )
+
+                    dict_out.update(dict_out_affinity_ensemble)
+                    dict_out.update(dict_out_affinity1)
+                    dict_out.update(dict_out_affinity2)
+                else:
+                    dict_out_affinity = self.affinity_module(
+                        s_inputs=s_inputs.detach(),
+                        z=z_affinity.detach(),
+                        x_pred=coords_affinity,
+                        feats=feats,
+                        multiplicity=1,
+                        use_kernels=self.use_kernels,
+                    )
+                    dict_out.update(
+                        {
+                            "affinity_pred_value": dict_out_affinity[
+                                "affinity_pred_value"
+                            ],
+                            "affinity_probability_binary": torch.nn.functional.sigmoid(
+                                dict_out_affinity["affinity_logits_binary"]
+                            ),
+                        }
+                    )
+
+        return dict_out
+
+    def get_true_coordinates(
+        self,
+        batch: dict[str, Tensor],
+        out: dict[str, Tensor],
+        diffusion_samples: int,
+        symmetry_correction: bool,
+        expand_to_diffusion_samples: bool = True,
+    ):
+        if symmetry_correction:
+            msg = "expand_to_diffusion_samples must be true for symmetry correction."
+            assert expand_to_diffusion_samples, msg
+
+        return_dict = {}
+
+        assert batch["coords"].shape[0] == 1, (
+            f"Validation is not supported for batch sizes={batch['coords'].shape[0]}"
+        )
+
+        if symmetry_correction:
+            true_coords = []
+            true_coords_resolved_mask = []
+            for idx in range(batch["token_index"].shape[0]):
+                for rep in range(diffusion_samples):
+                    i = idx * diffusion_samples + rep
+                    best_true_coords, best_true_coords_resolved_mask = (
+                        minimum_lddt_symmetry_coords(
+                            coords=out["sample_atom_coords"][i : i + 1],
+                            feats=batch,
+                            index_batch=idx,
+                        )
+                    )
+                    true_coords.append(best_true_coords)
+                    true_coords_resolved_mask.append(best_true_coords_resolved_mask)
+
+            true_coords = torch.cat(true_coords, dim=0)
+            true_coords_resolved_mask = torch.cat(true_coords_resolved_mask, dim=0)
+            true_coords = true_coords.unsqueeze(1)
+
+            true_coords_resolved_mask = true_coords_resolved_mask
+
+            return_dict["true_coords"] = true_coords
+            return_dict["true_coords_resolved_mask"] = true_coords_resolved_mask
+            return_dict["rmsds"] = 0
+            return_dict["best_rmsd_recall"] = 0
+
+        else:
+            K, L = batch["coords"].shape[1:3]
+
+            true_coords_resolved_mask = batch["atom_resolved_mask"]
+            true_coords = batch["coords"].squeeze(0)
+            if expand_to_diffusion_samples:
+                true_coords = true_coords.repeat((diffusion_samples, 1, 1)).reshape(
+                    diffusion_samples, K, L, 3
+                )
+
+                true_coords_resolved_mask = true_coords_resolved_mask.repeat_interleave(
+                    diffusion_samples, dim=0
+                )  # since all masks are the same across conformers and diffusion samples, can just repeat S times
+            else:
+                true_coords_resolved_mask = true_coords_resolved_mask.squeeze(0)
+
+            return_dict["true_coords"] = true_coords
+            return_dict["true_coords_resolved_mask"] = true_coords_resolved_mask
+            return_dict["rmsds"] = 0
+            return_dict["best_rmsd_recall"] = 0
+            return_dict["best_rmsd_precision"] = 0
+
+        return return_dict
+
+    def training_step(self, batch: dict[str, Tensor], batch_idx: int) -> Tensor:
+        # Sample recycling steps
+        if self.no_random_recycling_training:
+            recycling_steps = self.training_args.recycling_steps
+        else:
+            rgn = np.random.default_rng(self.global_step)
+            recycling_steps = rgn.integers(
+                0, self.training_args.recycling_steps + 1
+            ).item()
+
+        if self.training_args.get("sampling_steps_random", None) is not None:
+            rgn_samplng_steps = np.random.default_rng(self.global_step)
+            sampling_steps = rgn_samplng_steps.choice(
+                self.training_args.sampling_steps_random
+            )
+        else:
+            sampling_steps = self.training_args.sampling_steps
+
+        # Compute the forward pass
+        out = self(
+            feats=batch,
+            recycling_steps=recycling_steps,
+            num_sampling_steps=sampling_steps,
+            multiplicity_diffusion_train=self.training_args.diffusion_multiplicity,
+            diffusion_samples=self.training_args.diffusion_samples,
+        )
+
+        # Compute losses
+        if self.structure_prediction_training:
+            disto_loss, _ = distogram_loss(
+                out,
+                batch,
+                aggregate_distogram=self.aggregate_distogram,
+            )
+            try:
+                diffusion_loss_dict = self.structure_module.compute_loss(
+                    batch,
+                    out,
+                    multiplicity=self.training_args.diffusion_multiplicity,
+                    **self.diffusion_loss_args,
+                )
+            except Exception as e:
+                print(f"Skipping batch {batch_idx} due to error: {e}")
+                return None
+
+            if self.predict_bfactor:
+                bfactor_loss = bfactor_loss_fn(out, batch)
+            else:
+                bfactor_loss = 0.0
+
+        else:
+            disto_loss = 0.0
+            bfactor_loss = 0.0
+            diffusion_loss_dict = {"loss": 0.0, "loss_breakdown": {}}
+
+        if self.confidence_prediction:
+            try:
+                # confidence model symmetry correction
+                return_dict = self.get_true_coordinates(
+                    batch,
+                    out,
+                    diffusion_samples=self.training_args.diffusion_samples,
+                    symmetry_correction=self.training_args.symmetry_correction,
+                )
+            except Exception as e:
+                print(f"Skipping batch with id {batch['pdb_id']} due to error: {e}")
+                return None
+
+            true_coords = return_dict["true_coords"]
+            true_coords_resolved_mask = return_dict["true_coords_resolved_mask"]
+
+            # TODO remove once multiple conformers are supported
+            K = true_coords.shape[1]
+            assert K == 1, (
+                f"Confidence_prediction is not supported for num_ensembles_val={K}."
+            )
+
+            # For now, just take the only conformer.
+            true_coords = true_coords.squeeze(1)  # (S, L, 3)
+            batch["frames_idx"] = batch["frames_idx"].squeeze(
+                1
+            )  # remove conformer dimension
+            batch["frame_resolved_mask"] = batch["frame_resolved_mask"].squeeze(
+                1
+            )  # remove conformer dimension
+
+            confidence_loss_dict = confidence_loss(
+                out,
+                batch,
+                true_coords,
+                true_coords_resolved_mask,
+                token_level_confidence=self.token_level_confidence,
+                alpha_pae=self.alpha_pae,
+                multiplicity=self.training_args.diffusion_samples,
+            )
+
+        else:
+            confidence_loss_dict = {
+                "loss": torch.tensor(0.0, device=batch["token_index"].device),
+                "loss_breakdown": {},
+            }
+
+        # Aggregate losses
+        # NOTE: we already have an implicit weight in the losses induced by dataset sampling
+        # NOTE: this logic works only for datasets with confidence labels
+        loss = (
+            self.training_args.confidence_loss_weight * confidence_loss_dict["loss"]
+            + self.training_args.diffusion_loss_weight * diffusion_loss_dict["loss"]
+            + self.training_args.distogram_loss_weight * disto_loss
+            + self.training_args.get("bfactor_loss_weight", 0.0) * bfactor_loss
+        )
+
+        if not (self.global_step % self.log_loss_every_steps):
+            # Log losses
+            if self.validate_structure:
+                self.log("train/distogram_loss", disto_loss)
+                self.log("train/diffusion_loss", diffusion_loss_dict["loss"])
+                for k, v in diffusion_loss_dict["loss_breakdown"].items():
+                    self.log(f"train/{k}", v)
+
+            if self.confidence_prediction:
+                self.train_confidence_loss_logger.update(
+                    confidence_loss_dict["loss"].detach()
+                )
+                for k in self.train_confidence_loss_dict_logger:
+                    self.train_confidence_loss_dict_logger[k].update(
+                        (
+                            confidence_loss_dict["loss_breakdown"][k].detach()
+                            if torch.is_tensor(
+                                confidence_loss_dict["loss_breakdown"][k]
+                            )
+                            else confidence_loss_dict["loss_breakdown"][k]
+                        )
+                    )
+            self.log("train/loss", loss)
+            self.training_log()
+        return loss
+
+    def training_log(self):
+        self.log("train/grad_norm", self.gradient_norm(self), prog_bar=False)
+        self.log("train/param_norm", self.parameter_norm(self), prog_bar=False)
+
+        lr = self.trainer.optimizers[0].param_groups[0]["lr"]
+        self.log("lr", lr, prog_bar=False)
+
+        self.log(
+            "train/param_norm_msa_module",
+            self.parameter_norm(self.msa_module),
+            prog_bar=False,
+        )
+
+        self.log(
+            "train/param_norm_pairformer_module",
+            self.parameter_norm(self.pairformer_module),
+            prog_bar=False,
+        )
+
+        self.log(
+            "train/param_norm_structure_module",
+            self.parameter_norm(self.structure_module),
+            prog_bar=False,
+        )
+
+        if self.confidence_prediction:
+            self.log(
+                "train/grad_norm_confidence_module",
+                self.gradient_norm(self.confidence_module),
+                prog_bar=False,
+            )
+            self.log(
+                "train/param_norm_confidence_module",
+                self.parameter_norm(self.confidence_module),
+                prog_bar=False,
+            )
+
+    def on_train_epoch_end(self):
+        if self.confidence_prediction:
+            self.log(
+                "train/confidence_loss",
+                self.train_confidence_loss_logger,
+                prog_bar=False,
+                on_step=False,
+                on_epoch=True,
+            )
+            for k, v in self.train_confidence_loss_dict_logger.items():
+                self.log(f"train/{k}", v, prog_bar=False, on_step=False, on_epoch=True)
+
+    def gradient_norm(self, module):
+        parameters = [
+            p.grad.norm(p=2) ** 2
+            for p in module.parameters()
+            if p.requires_grad and p.grad is not None
+        ]
+        if len(parameters) == 0:
+            return torch.tensor(
+                0.0, device="cuda" if torch.cuda.is_available() else "cpu"
+            )
+        norm = torch.stack(parameters).sum().sqrt()
+        return norm
+
+    def parameter_norm(self, module):
+        parameters = [p.norm(p=2) ** 2 for p in module.parameters() if p.requires_grad]
+        if len(parameters) == 0:
+            return torch.tensor(
+                0.0, device="cuda" if torch.cuda.is_available() else "cpu"
+            )
+        norm = torch.stack(parameters).sum().sqrt()
+        return norm
+
+    def validation_step(self, batch: dict[str, Tensor], batch_idx: int):
+        if self.validate_structure:
+            try:
+                msg = "Only batch=1 is supported for validation"
+                assert batch["idx_dataset"].shape[0] == 1, msg
+
+                # Select validator based on dataset
+                idx_dataset = batch["idx_dataset"][0].item()
+                validator = self.validator_mapper[idx_dataset]
+
+                # Run forward pass
+                out = validator.run_model(
+                    model=self, batch=batch, idx_dataset=idx_dataset
+                )
+                # Compute validation step
+                validator.process(
+                    model=self, batch=batch, out=out, idx_dataset=idx_dataset
+                )
+            except RuntimeError as e:  # catch out of memory exceptions
+                idx_dataset = batch["idx_dataset"][0].item()
+                if "out of memory" in str(e):
+                    msg = f"| WARNING: ran out of memory, skipping batch, {idx_dataset}"
+                    print(msg)
+                    torch.cuda.empty_cache()
+                    gc.collect()
+                    return
+                raise e
+        else:
+            try:
+                out = self(
+                    batch,
+                    recycling_steps=self.validation_args.recycling_steps,
+                    num_sampling_steps=self.validation_args.sampling_steps,
+                    diffusion_samples=self.validation_args.diffusion_samples,
+                    run_confidence_sequentially=self.validation_args.get(
+                        "run_confidence_sequentially", False
+                    ),
+                )
+            except RuntimeError as e:  # catch out of memory exceptions
+                idx_dataset = batch["idx_dataset"][0].item()
+                if "out of memory" in str(e):
+                    msg = f"| WARNING: ran out of memory, skipping batch, {idx_dataset}"
+                    print(msg)
+                    torch.cuda.empty_cache()
+                    gc.collect()
+                    return
+                raise e
+
+    def on_validation_epoch_end(self):
+        """Aggregate all metrics for each validator."""
+        if self.validate_structure:
+            for validator in self.validator_mapper.values():
+                # This will aggregate, compute and log all metrics
+                validator.on_epoch_end(model=self)
+
+    def predict_step(self, batch: Any, batch_idx: int, dataloader_idx: int = 0) -> dict:
+        try:
+            out = self(
+                batch,
+                recycling_steps=self.predict_args["recycling_steps"],
+                num_sampling_steps=self.predict_args["sampling_steps"],
+                diffusion_samples=self.predict_args["diffusion_samples"],
+                max_parallel_samples=self.predict_args["max_parallel_samples"],
+                run_confidence_sequentially=True,
+            )
+            pred_dict = {"exception": False}
+            if "keys_dict_batch" in self.predict_args:
+                for key in self.predict_args["keys_dict_batch"]:
+                    pred_dict[key] = batch[key]
+
+            pred_dict["masks"] = batch["atom_pad_mask"]
+            pred_dict["token_masks"] = batch["token_pad_mask"]
+            pred_dict["s"] = out["s"]
+            pred_dict["z"] = out["z"]
+
+            if "keys_dict_out" in self.predict_args:
+                for key in self.predict_args["keys_dict_out"]:
+                    pred_dict[key] = out[key]
+            pred_dict["coords"] = out["sample_atom_coords"]
+            if self.confidence_prediction:
+                # pred_dict["confidence"] = out.get("ablation_confidence", None)
+                pred_dict["pde"] = out["pde"]
+                pred_dict["plddt"] = out["plddt"]
+                pred_dict["confidence_score"] = (
+                    4 * out["complex_plddt"]
+                    + (
+                        out["iptm"]
+                        if not torch.allclose(
+                            out["iptm"], torch.zeros_like(out["iptm"])
+                        )
+                        else out["ptm"]
+                    )
+                ) / 5
+
+                pred_dict["complex_plddt"] = out["complex_plddt"]
+                pred_dict["complex_iplddt"] = out["complex_iplddt"]
+                pred_dict["complex_pde"] = out["complex_pde"]
+                pred_dict["complex_ipde"] = out["complex_ipde"]
+                if self.alpha_pae > 0:
+                    pred_dict["pae"] = out["pae"]
+                    pred_dict["ptm"] = out["ptm"]
+                    pred_dict["iptm"] = out["iptm"]
+                    pred_dict["ligand_iptm"] = out["ligand_iptm"]
+                    pred_dict["protein_iptm"] = out["protein_iptm"]
+                    pred_dict["pair_chains_iptm"] = out["pair_chains_iptm"]
+            if self.affinity_prediction:
+                pred_dict["affinity_pred_value"] = out["affinity_pred_value"]
+                pred_dict["affinity_probability_binary"] = out[
+                    "affinity_probability_binary"
+                ]
+                if self.affinity_ensemble:
+                    pred_dict["affinity_pred_value1"] = out["affinity_pred_value1"]
+                    pred_dict["affinity_probability_binary1"] = out[
+                        "affinity_probability_binary1"
+                    ]
+                    pred_dict["affinity_pred_value2"] = out["affinity_pred_value2"]
+                    pred_dict["affinity_probability_binary2"] = out[
+                        "affinity_probability_binary2"
+                    ]
+            return pred_dict
+
+        except RuntimeError as e:  # catch out of memory exceptions
+            if "out of memory" in str(e):
+                print("| WARNING: ran out of memory, skipping batch")
+                torch.cuda.empty_cache()
+                gc.collect()
+                return {"exception": True}
+            else:
+                raise e
+
+    def configure_optimizers(self) -> torch.optim.Optimizer:
+        """Configure the optimizer."""
+        param_dict = dict(self.named_parameters())
+
+        if self.structure_prediction_training:
+            all_parameter_names = [
+                pn for pn, p in self.named_parameters() if p.requires_grad
+            ]
+        else:
+            all_parameter_names = [
+                pn
+                for pn, p in self.named_parameters()
+                if p.requires_grad
+                and ("out_token_feat_update" in pn or "confidence_module" in pn)
+            ]
+
+        if self.training_args.get("weight_decay", 0.0) > 0:
+            w_decay = self.training_args.get("weight_decay", 0.0)
+            if self.training_args.get("weight_decay_exclude", False):
+                nodecay_params_names = [
+                    pn
+                    for pn in all_parameter_names
+                    if (
+                        "norm" in pn
+                        or "rel_pos" in pn
+                        or ".s_init" in pn
+                        or ".z_init_" in pn
+                        or "token_bonds" in pn
+                        or "embed_atom_features" in pn
+                        or "dist_bin_pairwise_embed" in pn
+                    )
+                ]
+                nodecay_params = [param_dict[pn] for pn in nodecay_params_names]
+                decay_params = [
+                    param_dict[pn]
+                    for pn in all_parameter_names
+                    if pn not in nodecay_params_names
+                ]
+                optim_groups = [
+                    {"params": decay_params, "weight_decay": w_decay},
+                    {"params": nodecay_params, "weight_decay": 0.0},
+                ]
+                optimizer = torch.optim.AdamW(
+                    optim_groups,
+                    betas=(
+                        self.training_args.adam_beta_1,
+                        self.training_args.adam_beta_2,
+                    ),
+                    eps=self.training_args.adam_eps,
+                    lr=self.training_args.base_lr,
+                )
+
+            else:
+                optimizer = torch.optim.AdamW(
+                    [param_dict[pn] for pn in all_parameter_names],
+                    betas=(
+                        self.training_args.adam_beta_1,
+                        self.training_args.adam_beta_2,
+                    ),
+                    eps=self.training_args.adam_eps,
+                    lr=self.training_args.base_lr,
+                    weight_decay=self.training_args.get("weight_decay", 0.0),
+                )
+        else:
+            optimizer = torch.optim.AdamW(
+                [param_dict[pn] for pn in all_parameter_names],
+                betas=(self.training_args.adam_beta_1, self.training_args.adam_beta_2),
+                eps=self.training_args.adam_eps,
+                lr=self.training_args.base_lr,
+                weight_decay=self.training_args.get("weight_decay", 0.0),
+            )
+
+        if self.training_args.lr_scheduler == "af3":
+            scheduler = AlphaFoldLRScheduler(
+                optimizer,
+                base_lr=self.training_args.base_lr,
+                max_lr=self.training_args.max_lr,
+                warmup_no_steps=self.training_args.lr_warmup_no_steps,
+                start_decay_after_n_steps=self.training_args.lr_start_decay_after_n_steps,
+                decay_every_n_steps=self.training_args.lr_decay_every_n_steps,
+                decay_factor=self.training_args.lr_decay_factor,
+            )
+            return [optimizer], [{"scheduler": scheduler, "interval": "step"}]
+
+        return optimizer
+
+    def on_load_checkpoint(self, checkpoint: dict[str, Any]) -> None:
+        # Ignore the lr from the checkpoint
+        lr = self.training_args.max_lr
+        weight_decay = self.training_args.weight_decay
+        if "optimizer_states" in checkpoint:
+            for state in checkpoint["optimizer_states"]:
+                for group in state["param_groups"]:
+                    group["lr"] = lr
+                    group["weight_decay"] = weight_decay
+        if "lr_schedulers" in checkpoint:
+            for scheduler in checkpoint["lr_schedulers"]:
+                scheduler["max_lr"] = lr
+                scheduler["base_lrs"] = [lr] * len(scheduler["base_lrs"])
+                scheduler["_last_lr"] = [lr] * len(scheduler["_last_lr"])
+
+        # Ignore the training diffusion_multiplicity and recycling steps from the checkpoint
+        if "hyper_parameters" in checkpoint:
+            checkpoint["hyper_parameters"]["training_args"]["max_lr"] = lr
+            checkpoint["hyper_parameters"]["training_args"][
+                "diffusion_multiplicity"
+            ] = self.training_args.diffusion_multiplicity
+            checkpoint["hyper_parameters"]["training_args"]["recycling_steps"] = (
+                self.training_args.recycling_steps
+            )
+            checkpoint["hyper_parameters"]["training_args"]["weight_decay"] = (
+                self.training_args.weight_decay
+            )
+
+    def configure_callbacks(self) -> list[Callback]:
+        """Configure model callbacks.
+
+        Returns
+        -------
+        List[Callback]
+            List of callbacks to be used in the model.
+
+        """
+        return [EMA(self.ema_decay)] if self.use_ema else []
diff --git a/forks/boltz/src/boltz/model/modules/__init__.py b/forks/boltz/src/boltz/model/modules/__init__.py
new file mode 100644
index 00000000..e69de29b
diff --git a/forks/boltz/src/boltz/model/modules/affinity.py b/forks/boltz/src/boltz/model/modules/affinity.py
new file mode 100644
index 00000000..da14e3e6
--- /dev/null
+++ b/forks/boltz/src/boltz/model/modules/affinity.py
@@ -0,0 +1,223 @@
+import torch
+from torch import nn
+
+import boltz.model.layers.initialize as init
+from boltz.model.layers.pairformer import PairformerNoSeqModule
+from boltz.model.modules.encodersv2 import PairwiseConditioning
+from boltz.model.modules.transformersv2 import DiffusionTransformer
+from boltz.model.modules.utils import LinearNoBias
+
+
+class GaussianSmearing(torch.nn.Module):
+    """Gaussian smearing."""
+
+    def __init__(
+        self,
+        start: float = 0.0,
+        stop: float = 5.0,
+        num_gaussians: int = 50,
+    ) -> None:
+        super().__init__()
+        offset = torch.linspace(start, stop, num_gaussians)
+        self.num_gaussians = num_gaussians
+        self.coeff = -0.5 / (offset[1] - offset[0]).item() ** 2
+        self.register_buffer("offset", offset)
+
+    def forward(self, dist):
+        shape = dist.shape
+        dist = dist.view(-1, 1) - self.offset.view(1, -1)
+        return torch.exp(self.coeff * torch.pow(dist, 2)).reshape(
+            *shape, self.num_gaussians
+        )
+
+
+class AffinityModule(nn.Module):
+    """Algorithm 31"""
+
+    def __init__(
+        self,
+        token_s,
+        token_z,
+        pairformer_args: dict,
+        transformer_args: dict,
+        num_dist_bins=64,
+        max_dist=22,
+        use_cross_transformer: bool = False,
+        groups: dict = {},
+    ):
+        super().__init__()
+        boundaries = torch.linspace(2, max_dist, num_dist_bins - 1)
+        self.register_buffer("boundaries", boundaries)
+        self.dist_bin_pairwise_embed = nn.Embedding(num_dist_bins, token_z)
+        init.gating_init_(self.dist_bin_pairwise_embed.weight)
+
+        self.s_to_z_prod_in1 = LinearNoBias(token_s, token_z)
+        self.s_to_z_prod_in2 = LinearNoBias(token_s, token_z)
+
+        self.z_norm = nn.LayerNorm(token_z)
+        self.z_linear = LinearNoBias(token_z, token_z)
+
+        self.pairwise_conditioner = PairwiseConditioning(
+            token_z=token_z,
+            dim_token_rel_pos_feats=token_z,
+            num_transitions=2,
+        )
+
+        self.pairformer_stack = PairformerNoSeqModule(token_z, **pairformer_args)
+        self.affinity_heads = AffinityHeadsTransformer(
+            token_z,
+            transformer_args["token_s"],
+            transformer_args["num_blocks"],
+            transformer_args["num_heads"],
+            transformer_args["activation_checkpointing"],
+            False,
+            groups=groups,
+        )
+
+    def forward(
+        self,
+        s_inputs,
+        z,
+        x_pred,
+        feats,
+        multiplicity=1,
+        use_kernels=False,
+    ):
+        z = self.z_linear(self.z_norm(z))
+        z = z.repeat_interleave(multiplicity, 0)
+
+        z = (
+            z
+            + self.s_to_z_prod_in1(s_inputs)[:, :, None, :]
+            + self.s_to_z_prod_in2(s_inputs)[:, None, :, :]
+        )
+
+        token_to_rep_atom = feats["token_to_rep_atom"]
+        token_to_rep_atom = token_to_rep_atom.repeat_interleave(multiplicity, 0)
+        if len(x_pred.shape) == 4:
+            B, mult, N, _ = x_pred.shape
+            x_pred = x_pred.reshape(B * mult, N, -1)
+        else:
+            BM, N, _ = x_pred.shape
+            B = BM // multiplicity
+            mult = multiplicity
+        x_pred_repr = torch.bmm(token_to_rep_atom.float(), x_pred)
+        d = torch.cdist(x_pred_repr, x_pred_repr)
+
+        distogram = (d.unsqueeze(-1) > self.boundaries).sum(dim=-1).long()
+        distogram = self.dist_bin_pairwise_embed(distogram)
+
+        z = z + self.pairwise_conditioner(z_trunk=z, token_rel_pos_feats=distogram)
+
+        pad_token_mask = feats["token_pad_mask"].repeat_interleave(multiplicity, 0)
+        rec_mask = (feats["mol_type"] == 0).repeat_interleave(multiplicity, 0)
+        rec_mask = rec_mask * pad_token_mask
+        lig_mask = (
+            feats["affinity_token_mask"]
+            .repeat_interleave(multiplicity, 0)
+            .to(torch.bool)
+        )
+        lig_mask = lig_mask * pad_token_mask
+        cross_pair_mask = (
+            lig_mask[:, :, None] * rec_mask[:, None, :]
+            + rec_mask[:, :, None] * lig_mask[:, None, :]
+            + lig_mask[:, :, None] * lig_mask[:, None, :]
+        )
+        z = self.pairformer_stack(
+            z,
+            pair_mask=cross_pair_mask,
+            use_kernels=use_kernels,
+        )
+
+        out_dict = {}
+
+        # affinity heads
+        out_dict.update(
+            self.affinity_heads(z=z, feats=feats, multiplicity=multiplicity)
+        )
+
+        return out_dict
+
+
+class AffinityHeadsTransformer(nn.Module):
+    def __init__(
+        self,
+        token_z,
+        input_token_s,
+        num_blocks,
+        num_heads,
+        activation_checkpointing,
+        use_cross_transformer,
+        groups={},
+    ):
+        super().__init__()
+        self.affinity_out_mlp = nn.Sequential(
+            nn.Linear(token_z, token_z),
+            nn.ReLU(),
+            nn.Linear(token_z, input_token_s),
+            nn.ReLU(),
+        )
+
+        self.to_affinity_pred_value = nn.Sequential(
+            nn.Linear(input_token_s, input_token_s),
+            nn.ReLU(),
+            nn.Linear(input_token_s, input_token_s),
+            nn.ReLU(),
+            nn.Linear(input_token_s, 1),
+        )
+
+        self.to_affinity_pred_score = nn.Sequential(
+            nn.Linear(input_token_s, input_token_s),
+            nn.ReLU(),
+            nn.Linear(input_token_s, input_token_s),
+            nn.ReLU(),
+            nn.Linear(input_token_s, 1),
+        )
+        self.to_affinity_logits_binary = nn.Linear(1, 1)
+
+    def forward(
+        self,
+        z,
+        feats,
+        multiplicity=1,
+    ):
+        pad_token_mask = (
+            feats["token_pad_mask"].repeat_interleave(multiplicity, 0).unsqueeze(-1)
+        )
+        rec_mask = (
+            (feats["mol_type"] == 0).repeat_interleave(multiplicity, 0).unsqueeze(-1)
+        )
+        rec_mask = rec_mask * pad_token_mask
+        lig_mask = (
+            feats["affinity_token_mask"]
+            .repeat_interleave(multiplicity, 0)
+            .to(torch.bool)
+            .unsqueeze(-1)
+        ) * pad_token_mask
+        cross_pair_mask = (
+            lig_mask[:, :, None] * rec_mask[:, None, :]
+            + rec_mask[:, :, None] * lig_mask[:, None, :]
+            + (lig_mask[:, :, None] * lig_mask[:, None, :])
+        ) * (
+            1
+            - torch.eye(lig_mask.shape[1], device=lig_mask.device)
+            .unsqueeze(-1)
+            .unsqueeze(0)
+        )
+
+        g = torch.sum(z * cross_pair_mask, dim=(1, 2)) / (
+            torch.sum(cross_pair_mask, dim=(1, 2)) + 1e-7
+        )
+
+        g = self.affinity_out_mlp(g)
+
+        affinity_pred_value = self.to_affinity_pred_value(g).reshape(-1, 1)
+        affinity_pred_score = self.to_affinity_pred_score(g).reshape(-1, 1)
+        affinity_logits_binary = self.to_affinity_logits_binary(
+            affinity_pred_score
+        ).reshape(-1, 1)
+        out_dict = {
+            "affinity_pred_value": affinity_pred_value,
+            "affinity_logits_binary": affinity_logits_binary,
+        }
+        return out_dict
diff --git a/forks/boltz/src/boltz/model/modules/confidence.py b/forks/boltz/src/boltz/model/modules/confidence.py
new file mode 100755
index 00000000..4fb0fa6e
--- /dev/null
+++ b/forks/boltz/src/boltz/model/modules/confidence.py
@@ -0,0 +1,481 @@
+import torch
+import torch.nn.functional as F
+from torch import nn
+
+import boltz.model.layers.initialize as init
+from boltz.data import const
+from boltz.model.modules.confidence_utils import (
+    compute_aggregated_metric,
+    compute_ptms,
+)
+from boltz.model.modules.encoders import RelativePositionEncoder
+from boltz.model.modules.trunk import (
+    InputEmbedder,
+    MSAModule,
+    PairformerModule,
+)
+from boltz.model.modules.utils import LinearNoBias
+
+
+class ConfidenceModule(nn.Module):
+    """Confidence module."""
+
+    def __init__(
+        self,
+        token_s,
+        token_z,
+        pairformer_args: dict,
+        num_dist_bins=64,
+        max_dist=22,
+        add_s_to_z_prod=False,
+        add_s_input_to_s=False,
+        use_s_diffusion=False,
+        add_z_input_to_z=False,
+        confidence_args: dict = None,
+        compute_pae: bool = False,
+        imitate_trunk=False,
+        full_embedder_args: dict = None,
+        msa_args: dict = None,
+        compile_pairformer=False,
+    ):
+        """Initialize the confidence module.
+
+        Parameters
+        ----------
+        token_s : int
+            The single representation dimension.
+        token_z : int
+            The pair representation dimension.
+        pairformer_args : int
+            The pairformer arguments.
+        num_dist_bins : int, optional
+            The number of distance bins, by default 64.
+        max_dist : int, optional
+            The maximum distance, by default 22.
+        add_s_to_z_prod : bool, optional
+            Whether to add s to z product, by default False.
+        add_s_input_to_s : bool, optional
+            Whether to add s input to s, by default False.
+        use_s_diffusion : bool, optional
+            Whether to use s diffusion, by default False.
+        add_z_input_to_z : bool, optional
+            Whether to add z input to z, by default False.
+        confidence_args : dict, optional
+            The confidence arguments, by default None.
+        compute_pae : bool, optional
+            Whether to compute pae, by default False.
+        imitate_trunk : bool, optional
+            Whether to imitate trunk, by default False.
+        full_embedder_args : dict, optional
+            The full embedder arguments, by default None.
+        msa_args : dict, optional
+            The msa arguments, by default None.
+        compile_pairformer : bool, optional
+            Whether to compile pairformer, by default False.
+
+        """
+        super().__init__()
+        self.max_num_atoms_per_token = 23
+        self.no_update_s = pairformer_args.get("no_update_s", False)
+        boundaries = torch.linspace(2, max_dist, num_dist_bins - 1)
+        self.register_buffer("boundaries", boundaries)
+        self.dist_bin_pairwise_embed = nn.Embedding(num_dist_bins, token_z)
+        init.gating_init_(self.dist_bin_pairwise_embed.weight)
+        s_input_dim = (
+            token_s + 2 * const.num_tokens + 1 + len(const.pocket_contact_info)
+        )
+
+        self.use_s_diffusion = use_s_diffusion
+        if use_s_diffusion:
+            self.s_diffusion_norm = nn.LayerNorm(2 * token_s)
+            self.s_diffusion_to_s = LinearNoBias(2 * token_s, token_s)
+            init.gating_init_(self.s_diffusion_to_s.weight)
+
+        self.s_to_z = LinearNoBias(s_input_dim, token_z)
+        self.s_to_z_transpose = LinearNoBias(s_input_dim, token_z)
+        init.gating_init_(self.s_to_z.weight)
+        init.gating_init_(self.s_to_z_transpose.weight)
+
+        self.add_s_to_z_prod = add_s_to_z_prod
+        if add_s_to_z_prod:
+            self.s_to_z_prod_in1 = LinearNoBias(s_input_dim, token_z)
+            self.s_to_z_prod_in2 = LinearNoBias(s_input_dim, token_z)
+            self.s_to_z_prod_out = LinearNoBias(token_z, token_z)
+            init.gating_init_(self.s_to_z_prod_out.weight)
+
+        self.imitate_trunk = imitate_trunk
+        if self.imitate_trunk:
+            s_input_dim = (
+                token_s + 2 * const.num_tokens + 1 + len(const.pocket_contact_info)
+            )
+            self.s_init = nn.Linear(s_input_dim, token_s, bias=False)
+            self.z_init_1 = nn.Linear(s_input_dim, token_z, bias=False)
+            self.z_init_2 = nn.Linear(s_input_dim, token_z, bias=False)
+
+            # Input embeddings
+            self.input_embedder = InputEmbedder(**full_embedder_args)
+            self.rel_pos = RelativePositionEncoder(token_z)
+            self.token_bonds = nn.Linear(1, token_z, bias=False)
+
+            # Normalization layers
+            self.s_norm = nn.LayerNorm(token_s)
+            self.z_norm = nn.LayerNorm(token_z)
+
+            # Recycling projections
+            self.s_recycle = nn.Linear(token_s, token_s, bias=False)
+            self.z_recycle = nn.Linear(token_z, token_z, bias=False)
+            init.gating_init_(self.s_recycle.weight)
+            init.gating_init_(self.z_recycle.weight)
+
+            # Pairwise stack
+            self.msa_module = MSAModule(
+                token_z=token_z,
+                s_input_dim=s_input_dim,
+                **msa_args,
+            )
+            self.pairformer_module = PairformerModule(
+                token_s,
+                token_z,
+                **pairformer_args,
+            )
+            if compile_pairformer:
+                # Big models hit the default cache limit (8)
+                self.is_pairformer_compiled = True
+                torch._dynamo.config.cache_size_limit = 512
+                torch._dynamo.config.accumulated_cache_size_limit = 512
+                self.pairformer_module = torch.compile(
+                    self.pairformer_module,
+                    dynamic=False,
+                    fullgraph=False,
+                )
+
+            self.final_s_norm = nn.LayerNorm(token_s)
+            self.final_z_norm = nn.LayerNorm(token_z)
+        else:
+            self.s_inputs_norm = nn.LayerNorm(s_input_dim)
+            if not self.no_update_s:
+                self.s_norm = nn.LayerNorm(token_s)
+            self.z_norm = nn.LayerNorm(token_z)
+
+            self.add_s_input_to_s = add_s_input_to_s
+            if add_s_input_to_s:
+                self.s_input_to_s = LinearNoBias(s_input_dim, token_s)
+                init.gating_init_(self.s_input_to_s.weight)
+
+            self.add_z_input_to_z = add_z_input_to_z
+            if add_z_input_to_z:
+                self.rel_pos = RelativePositionEncoder(token_z)
+                self.token_bonds = nn.Linear(1, token_z, bias=False)
+
+            self.pairformer_stack = PairformerModule(
+                token_s,
+                token_z,
+                **pairformer_args,
+            )
+
+        self.confidence_heads = ConfidenceHeads(
+            token_s,
+            token_z,
+            compute_pae=compute_pae,
+            **confidence_args,
+        )
+
+    def forward(
+        self,
+        s_inputs,
+        s,
+        z,
+        x_pred,
+        feats,
+        pred_distogram_logits,
+        multiplicity=1,
+        s_diffusion=None,
+        run_sequentially=False,
+        use_kernels: bool = False,
+    ):
+        if run_sequentially and multiplicity > 1:
+            assert z.shape[0] == 1, "Not supported with batch size > 1"
+            out_dicts = []
+            for sample_idx in range(multiplicity):
+                out_dicts.append(  # noqa: PERF401
+                    self.forward(
+                        s_inputs,
+                        s,
+                        z,
+                        x_pred[sample_idx : sample_idx + 1],
+                        feats,
+                        pred_distogram_logits,
+                        multiplicity=1,
+                        s_diffusion=s_diffusion[sample_idx : sample_idx + 1]
+                        if s_diffusion is not None
+                        else None,
+                        run_sequentially=False,
+                        use_kernels=use_kernels,
+                    )
+                )
+
+            out_dict = {}
+            for key in out_dicts[0]:
+                if key != "pair_chains_iptm":
+                    out_dict[key] = torch.cat([out[key] for out in out_dicts], dim=0)
+                else:
+                    pair_chains_iptm = {}
+                    for chain_idx1 in out_dicts[0][key].keys():
+                        chains_iptm = {}
+                        for chain_idx2 in out_dicts[0][key][chain_idx1].keys():
+                            chains_iptm[chain_idx2] = torch.cat(
+                                [out[key][chain_idx1][chain_idx2] for out in out_dicts],
+                                dim=0,
+                            )
+                        pair_chains_iptm[chain_idx1] = chains_iptm
+                    out_dict[key] = pair_chains_iptm
+            return out_dict
+        if self.imitate_trunk:
+            s_inputs = self.input_embedder(feats)
+
+            # Initialize the sequence and pairwise embeddings
+            s_init = self.s_init(s_inputs)
+            z_init = (
+                self.z_init_1(s_inputs)[:, :, None]
+                + self.z_init_2(s_inputs)[:, None, :]
+            )
+            relative_position_encoding = self.rel_pos(feats)
+            z_init = z_init + relative_position_encoding
+            z_init = z_init + self.token_bonds(feats["token_bonds"].float())
+
+            # Apply recycling
+            s = s_init + self.s_recycle(self.s_norm(s))
+            z = z_init + self.z_recycle(self.z_norm(z))
+
+        else:
+            s_inputs = self.s_inputs_norm(s_inputs).repeat_interleave(multiplicity, 0)
+            if not self.no_update_s:
+                s = self.s_norm(s)
+
+            if self.add_s_input_to_s:
+                s = s + self.s_input_to_s(s_inputs)
+
+            z = self.z_norm(z)
+
+            if self.add_z_input_to_z:
+                relative_position_encoding = self.rel_pos(feats)
+                z = z + relative_position_encoding
+                z = z + self.token_bonds(feats["token_bonds"].float())
+
+        s = s.repeat_interleave(multiplicity, 0)
+
+        if self.use_s_diffusion:
+            assert s_diffusion is not None
+            s_diffusion = self.s_diffusion_norm(s_diffusion)
+            s = s + self.s_diffusion_to_s(s_diffusion)
+
+        z = z.repeat_interleave(multiplicity, 0)
+        z = (
+            z
+            + self.s_to_z(s_inputs)[:, :, None, :]
+            + self.s_to_z_transpose(s_inputs)[:, None, :, :]
+        )
+
+        if self.add_s_to_z_prod:
+            z = z + self.s_to_z_prod_out(
+                self.s_to_z_prod_in1(s_inputs)[:, :, None, :]
+                * self.s_to_z_prod_in2(s_inputs)[:, None, :, :]
+            )
+
+        token_to_rep_atom = feats["token_to_rep_atom"]
+        token_to_rep_atom = token_to_rep_atom.repeat_interleave(multiplicity, 0)
+        if len(x_pred.shape) == 4:
+            B, mult, N, _ = x_pred.shape
+            x_pred = x_pred.reshape(B * mult, N, -1)
+        x_pred_repr = torch.bmm(token_to_rep_atom.float(), x_pred)
+        d = torch.cdist(x_pred_repr, x_pred_repr)
+
+        distogram = (d.unsqueeze(-1) > self.boundaries).sum(dim=-1).long()
+        distogram = self.dist_bin_pairwise_embed(distogram)
+
+        z = z + distogram
+
+        mask = feats["token_pad_mask"].repeat_interleave(multiplicity, 0)
+        pair_mask = mask[:, :, None] * mask[:, None, :]
+
+        if self.imitate_trunk:
+            z = z + self.msa_module(z, s_inputs, feats, use_kernels=use_kernels)
+
+            s, z = self.pairformer_module(
+                s, z, mask=mask, pair_mask=pair_mask, use_kernels=use_kernels
+            )
+
+            s, z = self.final_s_norm(s), self.final_z_norm(z)
+
+        else:
+            s_t, z_t = self.pairformer_stack(
+                s, z, mask=mask, pair_mask=pair_mask, use_kernels=use_kernels
+            )
+
+            # AF3 has residual connections, we remove them
+            s = s_t
+            z = z_t
+
+        out_dict = {}
+
+        # confidence heads
+        out_dict.update(
+            self.confidence_heads(
+                s=s,
+                z=z,
+                x_pred=x_pred,
+                d=d,
+                feats=feats,
+                multiplicity=multiplicity,
+                pred_distogram_logits=pred_distogram_logits,
+            )
+        )
+
+        return out_dict
+
+
+class ConfidenceHeads(nn.Module):
+    """Confidence heads."""
+
+    def __init__(
+        self,
+        token_s,
+        token_z,
+        num_plddt_bins=50,
+        num_pde_bins=64,
+        num_pae_bins=64,
+        compute_pae: bool = True,
+    ):
+        """Initialize the confidence head.
+
+        Parameters
+        ----------
+        token_s : int
+            The single representation dimension.
+        token_z : int
+            The pair representation dimension.
+        num_plddt_bins : int
+            The number of plddt bins, by default 50.
+        num_pde_bins : int
+            The number of pde bins, by default 64.
+        num_pae_bins : int
+            The number of pae bins, by default 64.
+        compute_pae : bool
+            Whether to compute pae, by default False
+
+        """
+        super().__init__()
+        self.max_num_atoms_per_token = 23
+        self.to_pde_logits = LinearNoBias(token_z, num_pde_bins)
+        self.to_plddt_logits = LinearNoBias(token_s, num_plddt_bins)
+        self.to_resolved_logits = LinearNoBias(token_s, 2)
+        self.compute_pae = compute_pae
+        if self.compute_pae:
+            self.to_pae_logits = LinearNoBias(token_z, num_pae_bins)
+
+    def forward(
+        self,
+        s,
+        z,
+        x_pred,
+        d,
+        feats,
+        pred_distogram_logits,
+        multiplicity=1,
+    ):
+        # Compute the pLDDT, PDE, PAE, and resolved logits
+        plddt_logits = self.to_plddt_logits(s)
+        pde_logits = self.to_pde_logits(z + z.transpose(1, 2))
+        resolved_logits = self.to_resolved_logits(s)
+        if self.compute_pae:
+            pae_logits = self.to_pae_logits(z)
+
+        # Weights used to compute the interface pLDDT
+        ligand_weight = 2
+        interface_weight = 1
+
+        # Retrieve relevant features
+        token_type = feats["mol_type"]
+        token_type = token_type.repeat_interleave(multiplicity, 0)
+        is_ligand_token = (token_type == const.chain_type_ids["NONPOLYMER"]).float()
+
+        # Compute the aggregated pLDDT and iPLDDT
+        plddt = compute_aggregated_metric(plddt_logits)
+        token_pad_mask = feats["token_pad_mask"].repeat_interleave(multiplicity, 0)
+        complex_plddt = (plddt * token_pad_mask).sum(dim=-1) / token_pad_mask.sum(
+            dim=-1
+        )
+
+        is_contact = (d < 8).float()
+        is_different_chain = (
+            feats["asym_id"].unsqueeze(-1) != feats["asym_id"].unsqueeze(-2)
+        ).float()
+        is_different_chain = is_different_chain.repeat_interleave(multiplicity, 0)
+        token_interface_mask = torch.max(
+            is_contact * is_different_chain * (1 - is_ligand_token).unsqueeze(-1),
+            dim=-1,
+        ).values
+        iplddt_weight = (
+            is_ligand_token * ligand_weight + token_interface_mask * interface_weight
+        )
+        complex_iplddt = (plddt * token_pad_mask * iplddt_weight).sum(dim=-1) / (
+            torch.sum(token_pad_mask * iplddt_weight, dim=-1) + 1e-5
+        )
+
+        # Compute the aggregated PDE and iPDE
+        pde = compute_aggregated_metric(pde_logits, end=32)
+        pred_distogram_prob = nn.functional.softmax(
+            pred_distogram_logits, dim=-1
+        ).repeat_interleave(multiplicity, 0)
+        contacts = torch.zeros((1, 1, 1, 64), dtype=pred_distogram_prob.dtype).to(
+            pred_distogram_prob.device
+        )
+        contacts[:, :, :, :20] = 1.0
+        prob_contact = (pred_distogram_prob * contacts).sum(-1)
+        token_pad_mask = feats["token_pad_mask"].repeat_interleave(multiplicity, 0)
+        token_pad_pair_mask = (
+            token_pad_mask.unsqueeze(-1)
+            * token_pad_mask.unsqueeze(-2)
+            * (
+                1
+                - torch.eye(
+                    token_pad_mask.shape[1], device=token_pad_mask.device
+                ).unsqueeze(0)
+            )
+        )
+        token_pair_mask = token_pad_pair_mask * prob_contact
+        complex_pde = (pde * token_pair_mask).sum(dim=(1, 2)) / token_pair_mask.sum(
+            dim=(1, 2)
+        )
+        asym_id = feats["asym_id"].repeat_interleave(multiplicity, 0)
+        token_interface_pair_mask = token_pair_mask * (
+            asym_id.unsqueeze(-1) != asym_id.unsqueeze(-2)
+        )
+        complex_ipde = (pde * token_interface_pair_mask).sum(dim=(1, 2)) / (
+            token_interface_pair_mask.sum(dim=(1, 2)) + 1e-5
+        )
+
+        out_dict = dict(
+            pde_logits=pde_logits,
+            plddt_logits=plddt_logits,
+            resolved_logits=resolved_logits,
+            pde=pde,
+            plddt=plddt,
+            complex_plddt=complex_plddt,
+            complex_iplddt=complex_iplddt,
+            complex_pde=complex_pde,
+            complex_ipde=complex_ipde,
+        )
+        if self.compute_pae:
+            out_dict["pae_logits"] = pae_logits
+            out_dict["pae"] = compute_aggregated_metric(pae_logits, end=32)
+            ptm, iptm, ligand_iptm, protein_iptm, pair_chains_iptm = compute_ptms(
+                pae_logits, x_pred, feats, multiplicity
+            )
+            out_dict["ptm"] = ptm
+            out_dict["iptm"] = iptm
+            out_dict["ligand_iptm"] = ligand_iptm
+            out_dict["protein_iptm"] = protein_iptm
+            out_dict["pair_chains_iptm"] = pair_chains_iptm
+
+        return out_dict
diff --git a/forks/boltz/src/boltz/model/modules/confidence_utils.py b/forks/boltz/src/boltz/model/modules/confidence_utils.py
new file mode 100644
index 00000000..5ffacf11
--- /dev/null
+++ b/forks/boltz/src/boltz/model/modules/confidence_utils.py
@@ -0,0 +1,181 @@
+import torch
+from torch import nn
+
+from boltz.data import const
+from boltz.model.loss.confidence import compute_frame_pred
+
+
+def compute_aggregated_metric(logits, end=1.0):
+    """Compute the metric from the logits.
+
+    Parameters
+    ----------
+    logits : torch.Tensor
+        The logits of the metric
+    end : float
+        Max value of the metric, by default 1.0
+
+    Returns
+    -------
+    Tensor
+        The metric value
+
+    """
+    num_bins = logits.shape[-1]
+    bin_width = end / num_bins
+    bounds = torch.arange(
+        start=0.5 * bin_width, end=end, step=bin_width, device=logits.device
+    )
+    probs = nn.functional.softmax(logits, dim=-1)
+    plddt = torch.sum(
+        probs * bounds.view(*((1,) * len(probs.shape[:-1])), *bounds.shape),
+        dim=-1,
+    )
+    return plddt
+
+
+def tm_function(d, Nres):
+    """Compute the rescaling function for pTM.
+
+    Parameters
+    ----------
+    d : torch.Tensor
+        The input
+    Nres : torch.Tensor
+        The number of residues
+
+    Returns
+    -------
+    Tensor
+        Output of the function
+
+    """
+    d0 = 1.24 * (torch.clip(Nres, min=19) - 15) ** (1 / 3) - 1.8
+    return 1 / (1 + (d / d0) ** 2)
+
+
+def compute_ptms(logits, x_preds, feats, multiplicity):
+    """Compute pTM and ipTM scores.
+
+    Parameters
+    ----------
+    logits : torch.Tensor
+        pae logits
+    x_preds : torch.Tensor
+        The predicted coordinates
+    feats : Dict[str, torch.Tensor]
+        The input features
+    multiplicity : int
+        The batch size of the diffusion roll-out
+
+    Returns
+    -------
+    Tensor
+        pTM score
+    Tensor
+        ipTM score
+    Tensor
+        ligand ipTM score
+    Tensor
+        protein ipTM score
+
+    """
+    # Compute mask for collinear and overlapping tokens
+    _, mask_collinear_pred = compute_frame_pred(
+        x_preds, feats["frames_idx"], feats, multiplicity, inference=True
+    )
+    mask_pad = feats["token_pad_mask"].repeat_interleave(multiplicity, 0)
+    maski = mask_collinear_pred.reshape(-1, mask_collinear_pred.shape[-1])
+    pair_mask_ptm = maski[:, :, None] * mask_pad[:, None, :] * mask_pad[:, :, None]
+    asym_id = feats["asym_id"].repeat_interleave(multiplicity, 0)
+    pair_mask_iptm = (
+        maski[:, :, None]
+        * (asym_id[:, None, :] != asym_id[:, :, None])
+        * mask_pad[:, None, :]
+        * mask_pad[:, :, None]
+    )
+
+    # Extract pae values
+    num_bins = logits.shape[-1]
+    bin_width = 32.0 / num_bins
+    end = 32.0
+    pae_value = torch.arange(
+        start=0.5 * bin_width, end=end, step=bin_width, device=logits.device
+    ).unsqueeze(0)
+    N_res = mask_pad.sum(dim=-1, keepdim=True)
+
+    # compute pTM and ipTM
+    tm_value = tm_function(pae_value, N_res).unsqueeze(1).unsqueeze(2)
+    probs = nn.functional.softmax(logits, dim=-1)
+    tm_expected_value = torch.sum(
+        probs * tm_value,
+        dim=-1,
+    )  # shape (B, N, N)
+    ptm = torch.max(
+        torch.sum(tm_expected_value * pair_mask_ptm, dim=-1)
+        / (torch.sum(pair_mask_ptm, dim=-1) + 1e-5),
+        dim=1,
+    ).values
+    iptm = torch.max(
+        torch.sum(tm_expected_value * pair_mask_iptm, dim=-1)
+        / (torch.sum(pair_mask_iptm, dim=-1) + 1e-5),
+        dim=1,
+    ).values
+
+    # compute ligand and protein ipTM
+    token_type = feats["mol_type"]
+    token_type = token_type.repeat_interleave(multiplicity, 0)
+    is_ligand_token = (token_type == const.chain_type_ids["NONPOLYMER"]).float()
+    is_protein_token = (token_type == const.chain_type_ids["PROTEIN"]).float()
+
+    ligand_iptm_mask = (
+        maski[:, :, None]
+        * (asym_id[:, None, :] != asym_id[:, :, None])
+        * mask_pad[:, None, :]
+        * mask_pad[:, :, None]
+        * (
+            (is_ligand_token[:, :, None] * is_protein_token[:, None, :])
+            + (is_protein_token[:, :, None] * is_ligand_token[:, None, :])
+        )
+    )
+    protein_ipmt_mask = (
+        maski[:, :, None]
+        * (asym_id[:, None, :] != asym_id[:, :, None])
+        * mask_pad[:, None, :]
+        * mask_pad[:, :, None]
+        * (is_protein_token[:, :, None] * is_protein_token[:, None, :])
+    )
+
+    ligand_iptm = torch.max(
+        torch.sum(tm_expected_value * ligand_iptm_mask, dim=-1)
+        / (torch.sum(ligand_iptm_mask, dim=-1) + 1e-5),
+        dim=1,
+    ).values
+    protein_iptm = torch.max(
+        torch.sum(tm_expected_value * protein_ipmt_mask, dim=-1)
+        / (torch.sum(protein_ipmt_mask, dim=-1) + 1e-5),
+        dim=1,
+    ).values
+
+    # Compute pair chain ipTM
+    chain_pair_iptm = {}
+    asym_ids_list = torch.unique(asym_id).tolist()
+    for idx1 in asym_ids_list:
+        chain_iptm = {}
+        for idx2 in asym_ids_list:
+            mask_pair_chain = (
+                maski[:, :, None]
+                * (asym_id[:, None, :] == idx1)
+                * (asym_id[:, :, None] == idx2)
+                * mask_pad[:, None, :]
+                * mask_pad[:, :, None]
+            )
+
+            chain_iptm[idx2] = torch.max(
+                torch.sum(tm_expected_value * mask_pair_chain, dim=-1)
+                / (torch.sum(mask_pair_chain, dim=-1) + 1e-5),
+                dim=1,
+            ).values
+        chain_pair_iptm[idx1] = chain_iptm
+
+    return ptm, iptm, ligand_iptm, protein_iptm, chain_pair_iptm
diff --git a/forks/boltz/src/boltz/model/modules/confidencev2.py b/forks/boltz/src/boltz/model/modules/confidencev2.py
new file mode 100644
index 00000000..3dedc5f5
--- /dev/null
+++ b/forks/boltz/src/boltz/model/modules/confidencev2.py
@@ -0,0 +1,495 @@
+import torch
+from torch import nn
+from torch.nn.functional import pad
+
+import boltz.model.layers.initialize as init
+from boltz.data import const
+from boltz.model.layers.confidence_utils import (
+    compute_aggregated_metric,
+    compute_ptms,
+)
+from boltz.model.layers.pairformer import PairformerModule
+from boltz.model.modules.encodersv2 import RelativePositionEncoder
+from boltz.model.modules.trunkv2 import (
+    ContactConditioning,
+)
+from boltz.model.modules.utils import LinearNoBias
+
+
+class ConfidenceModule(nn.Module):
+    """Algorithm 31"""
+
+    def __init__(
+        self,
+        token_s,
+        token_z,
+        pairformer_args: dict,
+        num_dist_bins=64,
+        token_level_confidence=True,
+        max_dist=22,
+        add_s_to_z_prod=False,
+        add_s_input_to_s=False,
+        add_z_input_to_z=False,
+        maximum_bond_distance=0,
+        bond_type_feature=False,
+        confidence_args: dict = None,
+        compile_pairformer=False,
+        fix_sym_check=False,
+        cyclic_pos_enc=False,
+        return_latent_feats=False,
+        conditioning_cutoff_min=None,
+        conditioning_cutoff_max=None,
+        **kwargs,
+    ):
+        super().__init__()
+        self.max_num_atoms_per_token = 23
+        self.no_update_s = pairformer_args.get("no_update_s", False)
+        boundaries = torch.linspace(2, max_dist, num_dist_bins - 1)
+        self.register_buffer("boundaries", boundaries)
+        self.dist_bin_pairwise_embed = nn.Embedding(num_dist_bins, token_z)
+        init.gating_init_(self.dist_bin_pairwise_embed.weight)
+        self.token_level_confidence = token_level_confidence
+
+        self.s_to_z = LinearNoBias(token_s, token_z)
+        self.s_to_z_transpose = LinearNoBias(token_s, token_z)
+        init.gating_init_(self.s_to_z.weight)
+        init.gating_init_(self.s_to_z_transpose.weight)
+
+        self.add_s_to_z_prod = add_s_to_z_prod
+        if add_s_to_z_prod:
+            self.s_to_z_prod_in1 = LinearNoBias(token_s, token_z)
+            self.s_to_z_prod_in2 = LinearNoBias(token_s, token_z)
+            self.s_to_z_prod_out = LinearNoBias(token_z, token_z)
+            init.gating_init_(self.s_to_z_prod_out.weight)
+
+        self.s_inputs_norm = nn.LayerNorm(token_s)
+        if not self.no_update_s:
+            self.s_norm = nn.LayerNorm(token_s)
+        self.z_norm = nn.LayerNorm(token_z)
+
+        self.add_s_input_to_s = add_s_input_to_s
+        if add_s_input_to_s:
+            self.s_input_to_s = LinearNoBias(token_s, token_s)
+            init.gating_init_(self.s_input_to_s.weight)
+
+        self.add_z_input_to_z = add_z_input_to_z
+        if add_z_input_to_z:
+            self.rel_pos = RelativePositionEncoder(
+                token_z, fix_sym_check=fix_sym_check, cyclic_pos_enc=cyclic_pos_enc
+            )
+            self.token_bonds = nn.Linear(
+                1 if maximum_bond_distance == 0 else maximum_bond_distance + 2,
+                token_z,
+                bias=False,
+            )
+            self.bond_type_feature = bond_type_feature
+            if bond_type_feature:
+                self.token_bonds_type = nn.Embedding(len(const.bond_types) + 1, token_z)
+
+            self.contact_conditioning = ContactConditioning(
+                token_z=token_z,
+                cutoff_min=conditioning_cutoff_min,
+                cutoff_max=conditioning_cutoff_max,
+            )
+        pairformer_args["v2"] = True
+        self.pairformer_stack = PairformerModule(
+            token_s,
+            token_z,
+            **pairformer_args,
+        )
+        self.return_latent_feats = return_latent_feats
+
+        self.confidence_heads = ConfidenceHeads(
+            token_s,
+            token_z,
+            token_level_confidence=token_level_confidence,
+            **confidence_args,
+        )
+
+    def forward(
+        self,
+        s_inputs,  # Float['b n ts']
+        s,  # Float['b n ts']
+        z,  # Float['b n n tz']
+        x_pred,  # Float['bm m 3']
+        feats,
+        pred_distogram_logits,
+        multiplicity=1,
+        run_sequentially=False,
+        use_kernels: bool = False,
+    ):
+        if run_sequentially and multiplicity > 1:
+            assert z.shape[0] == 1, "Not supported with batch size > 1"
+            out_dicts = []
+            for sample_idx in range(multiplicity):
+                out_dicts.append(  # noqa: PERF401
+                    self.forward(
+                        s_inputs,
+                        s,
+                        z,
+                        x_pred[sample_idx : sample_idx + 1],
+                        feats,
+                        pred_distogram_logits,
+                        multiplicity=1,
+                        run_sequentially=False,
+                        use_kernels=use_kernels,
+                    )
+                )
+
+            out_dict = {}
+            for key in out_dicts[0]:
+                if key != "pair_chains_iptm":
+                    out_dict[key] = torch.cat([out[key] for out in out_dicts], dim=0)
+                else:
+                    pair_chains_iptm = {}
+                    for chain_idx1 in out_dicts[0][key]:
+                        chains_iptm = {}
+                        for chain_idx2 in out_dicts[0][key][chain_idx1]:
+                            chains_iptm[chain_idx2] = torch.cat(
+                                [out[key][chain_idx1][chain_idx2] for out in out_dicts],
+                                dim=0,
+                            )
+                        pair_chains_iptm[chain_idx1] = chains_iptm
+                    out_dict[key] = pair_chains_iptm
+            return out_dict
+
+        s_inputs = self.s_inputs_norm(s_inputs)
+        if not self.no_update_s:
+            s = self.s_norm(s)
+
+        if self.add_s_input_to_s:
+            s = s + self.s_input_to_s(s_inputs)
+
+        z = self.z_norm(z)
+
+        if self.add_z_input_to_z:
+            relative_position_encoding = self.rel_pos(feats)
+            z = z + relative_position_encoding
+            z = z + self.token_bonds(feats["token_bonds"].float())
+            if self.bond_type_feature:
+                z = z + self.token_bonds_type(feats["type_bonds"].long())
+            z = z + self.contact_conditioning(feats)
+
+        s = s.repeat_interleave(multiplicity, 0)
+
+        z = (
+            z
+            + self.s_to_z(s_inputs)[:, :, None, :]
+            + self.s_to_z_transpose(s_inputs)[:, None, :, :]
+        )
+        if self.add_s_to_z_prod:
+            z = z + self.s_to_z_prod_out(
+                self.s_to_z_prod_in1(s_inputs)[:, :, None, :]
+                * self.s_to_z_prod_in2(s_inputs)[:, None, :, :]
+            )
+
+        z = z.repeat_interleave(multiplicity, 0)
+        s_inputs = s_inputs.repeat_interleave(multiplicity, 0)
+
+        token_to_rep_atom = feats["token_to_rep_atom"]
+        token_to_rep_atom = token_to_rep_atom.repeat_interleave(multiplicity, 0)
+        if len(x_pred.shape) == 4:
+            B, mult, N, _ = x_pred.shape
+            x_pred = x_pred.reshape(B * mult, N, -1)
+        else:
+            BM, N, _ = x_pred.shape
+        x_pred_repr = torch.bmm(token_to_rep_atom.float(), x_pred)
+        d = torch.cdist(x_pred_repr, x_pred_repr)
+        distogram = (d.unsqueeze(-1) > self.boundaries).sum(dim=-1).long()
+        distogram = self.dist_bin_pairwise_embed(distogram)
+        z = z + distogram
+
+        mask = feats["token_pad_mask"].repeat_interleave(multiplicity, 0)
+        pair_mask = mask[:, :, None] * mask[:, None, :]
+
+        s_t, z_t = self.pairformer_stack(
+            s, z, mask=mask, pair_mask=pair_mask, use_kernels=use_kernels
+        )
+
+        # AF3 has residual connections, we remove them
+        s = s_t
+        z = z_t
+
+        out_dict = {}
+
+        if self.return_latent_feats:
+            out_dict["s_conf"] = s
+            out_dict["z_conf"] = z
+
+        # confidence heads
+        out_dict.update(
+            self.confidence_heads(
+                s=s,
+                z=z,
+                x_pred=x_pred,
+                d=d,
+                feats=feats,
+                multiplicity=multiplicity,
+                pred_distogram_logits=pred_distogram_logits,
+            )
+        )
+        return out_dict
+
+
+class ConfidenceHeads(nn.Module):
+    def __init__(
+        self,
+        token_s,
+        token_z,
+        num_plddt_bins=50,
+        num_pde_bins=64,
+        num_pae_bins=64,
+        token_level_confidence=True,
+        use_separate_heads: bool = False,
+        **kwargs,
+    ):
+        super().__init__()
+        self.max_num_atoms_per_token = 23
+        self.token_level_confidence = token_level_confidence
+        self.use_separate_heads = use_separate_heads
+
+        if self.use_separate_heads:
+            self.to_pae_intra_logits = LinearNoBias(token_z, num_pae_bins)
+            self.to_pae_inter_logits = LinearNoBias(token_z, num_pae_bins)
+        else:
+            self.to_pae_logits = LinearNoBias(token_z, num_pae_bins)
+
+        if self.use_separate_heads:
+            self.to_pde_intra_logits = LinearNoBias(token_z, num_pde_bins)
+            self.to_pde_inter_logits = LinearNoBias(token_z, num_pde_bins)
+        else:
+            self.to_pde_logits = LinearNoBias(token_z, num_pde_bins)
+
+        if self.token_level_confidence:
+            self.to_plddt_logits = LinearNoBias(token_s, num_plddt_bins)
+            self.to_resolved_logits = LinearNoBias(token_s, 2)
+        else:
+            self.to_plddt_logits = LinearNoBias(
+                token_s, num_plddt_bins * self.max_num_atoms_per_token
+            )
+            self.to_resolved_logits = LinearNoBias(
+                token_s, 2 * self.max_num_atoms_per_token
+            )
+
+    def forward(
+        self,
+        s,  # Float['b n ts']
+        z,  # Float['b n n tz']
+        x_pred,  # Float['bm m 3']
+        d,
+        feats,
+        pred_distogram_logits,
+        multiplicity=1,
+    ):
+        if self.use_separate_heads:
+            asym_id_token = feats["asym_id"]
+            is_same_chain = asym_id_token.unsqueeze(-1) == asym_id_token.unsqueeze(-2)
+            is_different_chain = ~is_same_chain
+
+        if self.use_separate_heads:
+            pae_intra_logits = self.to_pae_intra_logits(z)
+            pae_intra_logits = pae_intra_logits * is_same_chain.float().unsqueeze(-1)
+
+            pae_inter_logits = self.to_pae_inter_logits(z)
+            pae_inter_logits = pae_inter_logits * is_different_chain.float().unsqueeze(
+                -1
+            )
+
+            pae_logits = pae_inter_logits + pae_intra_logits
+        else:
+            pae_logits = self.to_pae_logits(z)
+
+        if self.use_separate_heads:
+            pde_intra_logits = self.to_pde_intra_logits(z + z.transpose(1, 2))
+            pde_intra_logits = pde_intra_logits * is_same_chain.float().unsqueeze(-1)
+
+            pde_inter_logits = self.to_pde_inter_logits(z + z.transpose(1, 2))
+            pde_inter_logits = pde_inter_logits * is_different_chain.float().unsqueeze(
+                -1
+            )
+
+            pde_logits = pde_inter_logits + pde_intra_logits
+        else:
+            pde_logits = self.to_pde_logits(z + z.transpose(1, 2))
+        resolved_logits = self.to_resolved_logits(s)
+        plddt_logits = self.to_plddt_logits(s)
+
+        ligand_weight = 20
+        non_interface_weight = 1
+        interface_weight = 10
+
+        token_type = feats["mol_type"]
+        token_type = token_type.repeat_interleave(multiplicity, 0)
+        is_ligand_token = (token_type == const.chain_type_ids["NONPOLYMER"]).float()
+
+        if self.token_level_confidence:
+            plddt = compute_aggregated_metric(plddt_logits)
+            token_pad_mask = feats["token_pad_mask"].repeat_interleave(multiplicity, 0)
+            complex_plddt = (plddt * token_pad_mask).sum(dim=-1) / token_pad_mask.sum(
+                dim=-1
+            )
+
+            is_contact = (d < 8).float()
+            is_different_chain = (
+                feats["asym_id"].unsqueeze(-1) != feats["asym_id"].unsqueeze(-2)
+            ).float()
+            is_different_chain = is_different_chain.repeat_interleave(multiplicity, 0)
+            token_interface_mask = torch.max(
+                is_contact * is_different_chain * (1 - is_ligand_token).unsqueeze(-1),
+                dim=-1,
+            ).values
+            token_non_interface_mask = (1 - token_interface_mask) * (
+                1 - is_ligand_token
+            )
+            iplddt_weight = (
+                is_ligand_token * ligand_weight
+                + token_interface_mask * interface_weight
+                + token_non_interface_mask * non_interface_weight
+            )
+            complex_iplddt = (plddt * token_pad_mask * iplddt_weight).sum(
+                dim=-1
+            ) / torch.sum(token_pad_mask * iplddt_weight, dim=-1)
+
+        else:
+            # token to atom conversion for resolved logits
+            B, N, _ = resolved_logits.shape
+            resolved_logits = resolved_logits.reshape(
+                B, N, self.max_num_atoms_per_token, 2
+            )
+
+            arange_max_num_atoms = (
+                torch.arange(self.max_num_atoms_per_token)
+                .reshape(1, 1, -1)
+                .to(resolved_logits.device)
+            )
+            max_num_atoms_mask = (
+                feats["atom_to_token"].sum(1).unsqueeze(-1) > arange_max_num_atoms
+            )
+            resolved_logits = resolved_logits[:, max_num_atoms_mask.squeeze(0)]
+            resolved_logits = pad(
+                resolved_logits,
+                (
+                    0,
+                    0,
+                    0,
+                    int(
+                        feats["atom_pad_mask"].shape[1]
+                        - feats["atom_pad_mask"].sum().item()
+                    ),
+                ),
+                value=0,
+            )
+            plddt_logits = plddt_logits.reshape(B, N, self.max_num_atoms_per_token, -1)
+            plddt_logits = plddt_logits[:, max_num_atoms_mask.squeeze(0)]
+            plddt_logits = pad(
+                plddt_logits,
+                (
+                    0,
+                    0,
+                    0,
+                    int(
+                        feats["atom_pad_mask"].shape[1]
+                        - feats["atom_pad_mask"].sum().item()
+                    ),
+                ),
+                value=0,
+            )
+            atom_pad_mask = feats["atom_pad_mask"].repeat_interleave(multiplicity, 0)
+            plddt = compute_aggregated_metric(plddt_logits)
+
+            complex_plddt = (plddt * atom_pad_mask).sum(dim=-1) / atom_pad_mask.sum(
+                dim=-1
+            )
+            token_type = feats["mol_type"].float()
+            atom_to_token = feats["atom_to_token"].float()
+            chain_id_token = feats["asym_id"].float()
+            atom_type = torch.bmm(atom_to_token, token_type.unsqueeze(-1)).squeeze(-1)
+            is_ligand_atom = (atom_type == const.chain_type_ids["NONPOLYMER"]).float()
+            d_atom = torch.cdist(x_pred, x_pred)
+            is_contact = (d_atom < 8).float()
+            chain_id_atom = torch.bmm(
+                atom_to_token, chain_id_token.unsqueeze(-1)
+            ).squeeze(-1)
+            is_different_chain = (
+                chain_id_atom.unsqueeze(-1) != chain_id_atom.unsqueeze(-2)
+            ).float()
+
+            atom_interface_mask = torch.max(
+                is_contact * is_different_chain * (1 - is_ligand_atom).unsqueeze(-1),
+                dim=-1,
+            ).values
+            atom_non_interface_mask = (1 - atom_interface_mask) * (1 - is_ligand_atom)
+            iplddt_weight = (
+                is_ligand_atom * ligand_weight
+                + atom_interface_mask * interface_weight
+                + atom_non_interface_mask * non_interface_weight
+            )
+
+            complex_iplddt = (plddt * feats["atom_pad_mask"] * iplddt_weight).sum(
+                dim=-1
+            ) / torch.sum(feats["atom_pad_mask"] * iplddt_weight, dim=-1)
+
+        # Compute the gPDE and giPDE
+        pde = compute_aggregated_metric(pde_logits, end=32)
+        pred_distogram_prob = nn.functional.softmax(
+            pred_distogram_logits, dim=-1
+        ).repeat_interleave(multiplicity, 0)
+        contacts = torch.zeros((1, 1, 1, 64), dtype=pred_distogram_prob.dtype).to(
+            pred_distogram_prob.device
+        )
+        contacts[:, :, :, :20] = 1.0
+        prob_contact = (pred_distogram_prob * contacts).sum(-1)
+        token_pad_mask = feats["token_pad_mask"].repeat_interleave(multiplicity, 0)
+        token_pad_pair_mask = (
+            token_pad_mask.unsqueeze(-1)
+            * token_pad_mask.unsqueeze(-2)
+            * (
+                1
+                - torch.eye(
+                    token_pad_mask.shape[1], device=token_pad_mask.device
+                ).unsqueeze(0)
+            )
+        )
+        token_pair_mask = token_pad_pair_mask * prob_contact
+        complex_pde = (pde * token_pair_mask).sum(dim=(1, 2)) / token_pair_mask.sum(
+            dim=(1, 2)
+        )
+        asym_id = feats["asym_id"].repeat_interleave(multiplicity, 0)
+        token_interface_pair_mask = token_pair_mask * (
+            asym_id.unsqueeze(-1) != asym_id.unsqueeze(-2)
+        )
+        complex_ipde = (pde * token_interface_pair_mask).sum(dim=(1, 2)) / (
+            token_interface_pair_mask.sum(dim=(1, 2)) + 1e-5
+        )
+        out_dict = dict(
+            pde_logits=pde_logits,
+            plddt_logits=plddt_logits,
+            resolved_logits=resolved_logits,
+            pde=pde,
+            plddt=plddt,
+            complex_plddt=complex_plddt,
+            complex_iplddt=complex_iplddt,
+            complex_pde=complex_pde,
+            complex_ipde=complex_ipde,
+        )
+        out_dict["pae_logits"] = pae_logits
+        out_dict["pae"] = compute_aggregated_metric(pae_logits, end=32)
+
+        try:
+            ptm, iptm, ligand_iptm, protein_iptm, pair_chains_iptm = compute_ptms(
+                pae_logits, x_pred, feats, multiplicity
+            )
+            out_dict["ptm"] = ptm
+            out_dict["iptm"] = iptm
+            out_dict["ligand_iptm"] = ligand_iptm
+            out_dict["protein_iptm"] = protein_iptm
+            out_dict["pair_chains_iptm"] = pair_chains_iptm
+        except Exception as e:
+            print(f"Error in compute_ptms: {e}")
+            out_dict["ptm"] = torch.zeros_like(complex_plddt)
+            out_dict["iptm"] = torch.zeros_like(complex_plddt)
+            out_dict["ligand_iptm"] = torch.zeros_like(complex_plddt)
+            out_dict["protein_iptm"] = torch.zeros_like(complex_plddt)
+            out_dict["pair_chains_iptm"] = torch.zeros_like(complex_plddt)
+
+        return out_dict
diff --git a/forks/boltz/src/boltz/model/modules/diffusion.py b/forks/boltz/src/boltz/model/modules/diffusion.py
new file mode 100644
index 00000000..d209f288
--- /dev/null
+++ b/forks/boltz/src/boltz/model/modules/diffusion.py
@@ -0,0 +1,863 @@
+# started from code from https://github.com/lucidrains/alphafold3-pytorch, MIT License, Copyright (c) 2024 Phil Wang
+
+from __future__ import annotations
+
+from math import sqrt
+
+import torch
+import torch.nn.functional as F
+from einops import rearrange
+from torch import nn
+from torch.nn import Module
+
+import boltz.model.layers.initialize as init
+from boltz.data import const
+from boltz.model.loss.diffusion import (
+    smooth_lddt_loss,
+    weighted_rigid_align,
+)
+from boltz.model.modules.utils import center_random_augmentation
+from boltz.model.modules.encoders import (
+    AtomAttentionDecoder,
+    AtomAttentionEncoder,
+    FourierEmbedding,
+    PairwiseConditioning,
+    SingleConditioning,
+)
+from boltz.model.modules.transformers import (
+    ConditionedTransitionBlock,
+    DiffusionTransformer,
+)
+from boltz.model.modules.utils import (
+    LinearNoBias,
+    compute_random_augmentation,
+    center_random_augmentation,
+    default,
+    log,
+)
+from boltz.model.potentials.potentials import get_potentials
+
+
+class DiffusionModule(Module):
+    """Diffusion module"""
+
+    def __init__(
+        self,
+        token_s: int,
+        token_z: int,
+        atom_s: int,
+        atom_z: int,
+        atoms_per_window_queries: int = 32,
+        atoms_per_window_keys: int = 128,
+        sigma_data: int = 16,
+        dim_fourier: int = 256,
+        atom_encoder_depth: int = 3,
+        atom_encoder_heads: int = 4,
+        token_transformer_depth: int = 24,
+        token_transformer_heads: int = 8,
+        atom_decoder_depth: int = 3,
+        atom_decoder_heads: int = 4,
+        atom_feature_dim: int = 128,
+        conditioning_transition_layers: int = 2,
+        activation_checkpointing: bool = False,
+        offload_to_cpu: bool = False,
+        **kwargs,
+    ) -> None:
+        """Initialize the diffusion module.
+
+        Parameters
+        ----------
+        token_s : int
+            The single representation dimension.
+        token_z : int
+            The pair representation dimension.
+        atom_s : int
+            The atom single representation dimension.
+        atom_z : int
+            The atom pair representation dimension.
+        atoms_per_window_queries : int, optional
+            The number of atoms per window for queries, by default 32.
+        atoms_per_window_keys : int, optional
+            The number of atoms per window for keys, by default 128.
+        sigma_data : int, optional
+            The standard deviation of the data distribution, by default 16.
+        dim_fourier : int, optional
+            The dimension of the fourier embedding, by default 256.
+        atom_encoder_depth : int, optional
+            The depth of the atom encoder, by default 3.
+        atom_encoder_heads : int, optional
+            The number of heads in the atom encoder, by default 4.
+        token_transformer_depth : int, optional
+            The depth of the token transformer, by default 24.
+        token_transformer_heads : int, optional
+            The number of heads in the token transformer, by default 8.
+        atom_decoder_depth : int, optional
+            The depth of the atom decoder, by default 3.
+        atom_decoder_heads : int, optional
+            The number of heads in the atom decoder, by default 4.
+        atom_feature_dim : int, optional
+            The atom feature dimension, by default 128.
+        conditioning_transition_layers : int, optional
+            The number of transition layers for conditioning, by default 2.
+        activation_checkpointing : bool, optional
+            Whether to use activation checkpointing, by default False.
+        offload_to_cpu : bool, optional
+            Whether to offload the activations to CPU, by default False.
+
+        """
+        super().__init__()
+
+        self.atoms_per_window_queries = atoms_per_window_queries
+        self.atoms_per_window_keys = atoms_per_window_keys
+        self.sigma_data = sigma_data
+
+        self.single_conditioner = SingleConditioning(
+            sigma_data=sigma_data,
+            token_s=token_s,
+            dim_fourier=dim_fourier,
+            num_transitions=conditioning_transition_layers,
+        )
+        self.pairwise_conditioner = PairwiseConditioning(
+            token_z=token_z,
+            dim_token_rel_pos_feats=token_z,
+            num_transitions=conditioning_transition_layers,
+        )
+
+        self.atom_attention_encoder = AtomAttentionEncoder(
+            atom_s=atom_s,
+            atom_z=atom_z,
+            token_s=token_s,
+            token_z=token_z,
+            atoms_per_window_queries=atoms_per_window_queries,
+            atoms_per_window_keys=atoms_per_window_keys,
+            atom_feature_dim=atom_feature_dim,
+            atom_encoder_depth=atom_encoder_depth,
+            atom_encoder_heads=atom_encoder_heads,
+            structure_prediction=True,
+            activation_checkpointing=activation_checkpointing,
+        )
+
+        self.s_to_a_linear = nn.Sequential(
+            nn.LayerNorm(2 * token_s), LinearNoBias(2 * token_s, 2 * token_s)
+        )
+        init.final_init_(self.s_to_a_linear[1].weight)
+
+        self.token_transformer = DiffusionTransformer(
+            dim=2 * token_s,
+            dim_single_cond=2 * token_s,
+            dim_pairwise=token_z,
+            depth=token_transformer_depth,
+            heads=token_transformer_heads,
+            activation_checkpointing=activation_checkpointing,
+            offload_to_cpu=offload_to_cpu,
+        )
+
+        self.a_norm = nn.LayerNorm(2 * token_s)
+
+        self.atom_attention_decoder = AtomAttentionDecoder(
+            atom_s=atom_s,
+            atom_z=atom_z,
+            token_s=token_s,
+            attn_window_queries=atoms_per_window_queries,
+            attn_window_keys=atoms_per_window_keys,
+            atom_decoder_depth=atom_decoder_depth,
+            atom_decoder_heads=atom_decoder_heads,
+            activation_checkpointing=activation_checkpointing,
+        )
+
+    def forward(
+        self,
+        s_inputs,
+        s_trunk,
+        z_trunk,
+        r_noisy,
+        times,
+        relative_position_encoding,
+        feats,
+        multiplicity=1,
+        model_cache=None,
+    ):
+        s, normed_fourier = self.single_conditioner(
+            times=times,
+            s_trunk=s_trunk.repeat_interleave(multiplicity, 0),
+            s_inputs=s_inputs.repeat_interleave(multiplicity, 0),
+        )
+
+        if model_cache is None or len(model_cache) == 0:
+            z = self.pairwise_conditioner(
+                z_trunk=z_trunk, token_rel_pos_feats=relative_position_encoding
+            )
+        else:
+            z = None
+
+        # Compute Atom Attention Encoder and aggregation to coarse-grained tokens
+        a, q_skip, c_skip, p_skip, to_keys = self.atom_attention_encoder(
+            feats=feats,
+            s_trunk=s_trunk,
+            z=z,
+            r=r_noisy,
+            multiplicity=multiplicity,
+            model_cache=model_cache,
+        )
+
+        # Full self-attention on token level
+        a = a + self.s_to_a_linear(s)
+
+        mask = feats["token_pad_mask"].repeat_interleave(multiplicity, 0)
+        a = self.token_transformer(
+            a,
+            mask=mask.float(),
+            s=s,
+            z=z,  # note z is not expanded with multiplicity until after bias is computed
+            multiplicity=multiplicity,
+            model_cache=model_cache,
+        )
+        a = self.a_norm(a)
+
+        # Broadcast token activations to atoms and run Sequence-local Atom Attention
+        r_update = self.atom_attention_decoder(
+            a=a,
+            q=q_skip,
+            c=c_skip,
+            p=p_skip,
+            feats=feats,
+            multiplicity=multiplicity,
+            to_keys=to_keys,
+            model_cache=model_cache,
+        )
+
+        return {"r_update": r_update, "token_a": a.detach()}
+
+
+class OutTokenFeatUpdate(Module):
+    """Output token feature update"""
+
+    def __init__(
+        self,
+        sigma_data: float,
+        token_s=384,
+        dim_fourier=256,
+    ):
+        """Initialize the Output token feature update for confidence model.
+
+        Parameters
+        ----------
+        sigma_data : float
+            The standard deviation of the data distribution.
+        token_s : int, optional
+            The token dimension, by default 384.
+        dim_fourier : int, optional
+            The dimension of the fourier embedding, by default 256.
+
+        """
+
+        super().__init__()
+        self.sigma_data = sigma_data
+
+        self.norm_next = nn.LayerNorm(2 * token_s)
+        self.fourier_embed = FourierEmbedding(dim_fourier)
+        self.norm_fourier = nn.LayerNorm(dim_fourier)
+        self.transition_block = ConditionedTransitionBlock(
+            2 * token_s, 2 * token_s + dim_fourier
+        )
+
+    def forward(
+        self,
+        times,
+        acc_a,
+        next_a,
+    ):
+        next_a = self.norm_next(next_a)
+        fourier_embed = self.fourier_embed(times)
+        normed_fourier = (
+            self.norm_fourier(fourier_embed)
+            .unsqueeze(1)
+            .expand(-1, next_a.shape[1], -1)
+        )
+        cond_a = torch.cat((acc_a, normed_fourier), dim=-1)
+
+        acc_a = acc_a + self.transition_block(next_a, cond_a)
+
+        return acc_a
+
+
+class AtomDiffusion(Module):
+    """Atom diffusion module"""
+
+    def __init__(
+        self,
+        score_model_args,
+        num_sampling_steps=5,
+        sigma_min=0.0004,
+        sigma_max=160.0,
+        sigma_data=16.0,
+        rho=7,
+        P_mean=-1.2,
+        P_std=1.5,
+        gamma_0=0.8,
+        gamma_min=1.0,
+        noise_scale=1.003,
+        step_scale=1.5,
+        coordinate_augmentation=True,
+        compile_score=False,
+        alignment_reverse_diff=False,
+        synchronize_sigmas=False,
+        use_inference_model_cache=False,
+        accumulate_token_repr=False,
+        **kwargs,
+    ):
+        """Initialize the atom diffusion module.
+
+        Parameters
+        ----------
+        score_model_args : dict
+            The arguments for the score model.
+        num_sampling_steps : int, optional
+            The number of sampling steps, by default 5.
+        sigma_min : float, optional
+            The minimum sigma value, by default 0.0004.
+        sigma_max : float, optional
+            The maximum sigma value, by default 160.0.
+        sigma_data : float, optional
+            The standard deviation of the data distribution, by default 16.0.
+        rho : int, optional
+            The rho value, by default 7.
+        P_mean : float, optional
+            The mean value of P, by default -1.2.
+        P_std : float, optional
+            The standard deviation of P, by default 1.5.
+        gamma_0 : float, optional
+            The gamma value, by default 0.8.
+        gamma_min : float, optional
+            The minimum gamma value, by default 1.0.
+        noise_scale : float, optional
+            The noise scale, by default 1.003.
+        step_scale : float, optional
+            The step scale, by default 1.5.
+        coordinate_augmentation : bool, optional
+            Whether to use coordinate augmentation, by default True.
+        compile_score : bool, optional
+            Whether to compile the score model, by default False.
+        alignment_reverse_diff : bool, optional
+            Whether to use alignment reverse diff, by default False.
+        synchronize_sigmas : bool, optional
+            Whether to synchronize the sigmas, by default False.
+        use_inference_model_cache : bool, optional
+            Whether to use the inference model cache, by default False.
+        accumulate_token_repr : bool, optional
+            Whether to accumulate the token representation, by default False.
+
+        """
+        super().__init__()
+        self.score_model = DiffusionModule(
+            **score_model_args,
+        )
+        if compile_score:
+            self.score_model = torch.compile(
+                self.score_model, dynamic=False, fullgraph=False
+            )
+
+        # parameters
+        self.sigma_min = sigma_min
+        self.sigma_max = sigma_max
+        self.sigma_data = sigma_data
+        self.rho = rho
+        self.P_mean = P_mean
+        self.P_std = P_std
+        self.num_sampling_steps = num_sampling_steps
+        self.gamma_0 = gamma_0
+        self.gamma_min = gamma_min
+        self.noise_scale = noise_scale
+        self.step_scale = step_scale
+        self.coordinate_augmentation = coordinate_augmentation
+        self.alignment_reverse_diff = alignment_reverse_diff
+        self.synchronize_sigmas = synchronize_sigmas
+        self.use_inference_model_cache = use_inference_model_cache
+
+        self.accumulate_token_repr = accumulate_token_repr
+        self.token_s = score_model_args["token_s"]
+        if self.accumulate_token_repr:
+            self.out_token_feat_update = OutTokenFeatUpdate(
+                sigma_data=sigma_data,
+                token_s=score_model_args["token_s"],
+                dim_fourier=score_model_args["dim_fourier"],
+            )
+
+        self.register_buffer("zero", torch.tensor(0.0), persistent=False)
+
+    @property
+    def device(self):
+        return next(self.score_model.parameters()).device
+
+    def c_skip(self, sigma):
+        return (self.sigma_data**2) / (sigma**2 + self.sigma_data**2)
+
+    def c_out(self, sigma):
+        return sigma * self.sigma_data / torch.sqrt(self.sigma_data**2 + sigma**2)
+
+    def c_in(self, sigma):
+        return 1 / torch.sqrt(sigma**2 + self.sigma_data**2)
+
+    def c_noise(self, sigma):
+        return log(sigma / self.sigma_data) * 0.25
+
+    def preconditioned_network_forward(
+        self,
+        noised_atom_coords,
+        sigma,
+        network_condition_kwargs: dict,
+        training: bool = True,
+    ):
+        batch, device = noised_atom_coords.shape[0], noised_atom_coords.device
+
+        if isinstance(sigma, float):
+            sigma = torch.full((batch,), sigma, device=device)
+
+        padded_sigma = rearrange(sigma, "b -> b 1 1")
+
+        net_out = self.score_model(
+            r_noisy=self.c_in(padded_sigma) * noised_atom_coords,
+            times=self.c_noise(sigma),
+            **network_condition_kwargs,
+        )
+
+        denoised_coords = (
+            self.c_skip(padded_sigma) * noised_atom_coords
+            + self.c_out(padded_sigma) * net_out["r_update"]
+        )
+        return denoised_coords, net_out["token_a"]
+
+    def sample_schedule(self, num_sampling_steps=None):
+        num_sampling_steps = default(num_sampling_steps, self.num_sampling_steps)
+        inv_rho = 1 / self.rho
+
+        steps = torch.arange(
+            num_sampling_steps, device=self.device, dtype=torch.float32
+        )
+        sigmas = (
+            self.sigma_max**inv_rho
+            + steps
+            / (num_sampling_steps - 1)
+            * (self.sigma_min**inv_rho - self.sigma_max**inv_rho)
+        ) ** self.rho
+
+        sigmas = sigmas * self.sigma_data
+
+        sigmas = F.pad(sigmas, (0, 1), value=0.0)  # last step is sigma value of 0.
+        return sigmas
+
+    def sample(
+        self,
+        atom_mask,
+        num_sampling_steps=None,
+        multiplicity=1,
+        max_parallel_samples=None,
+        train_accumulate_token_repr=False,
+        steering_args=None,
+        **network_condition_kwargs,
+    ):
+        if steering_args is not None and (
+            steering_args["fk_steering"] or steering_args["physical_guidance_update"]
+        ):
+            potentials = get_potentials(steering_args, boltz2=False)
+        if steering_args is not None and steering_args["fk_steering"]:
+            multiplicity = multiplicity * steering_args["num_particles"]
+            energy_traj = torch.empty((multiplicity, 0), device=self.device)
+            resample_weights = torch.ones(multiplicity, device=self.device).reshape(
+                -1, steering_args["num_particles"]
+            )
+        if steering_args is not None and steering_args["physical_guidance_update"]:
+            scaled_guidance_update = torch.zeros(
+                (multiplicity, *atom_mask.shape[1:], 3),
+                dtype=torch.float32,
+                device=self.device,
+            )
+
+        num_sampling_steps = default(num_sampling_steps, self.num_sampling_steps)
+        atom_mask = atom_mask.repeat_interleave(multiplicity, 0)
+
+        shape = (*atom_mask.shape, 3)
+        token_repr_shape = (
+            multiplicity,
+            network_condition_kwargs["feats"]["token_index"].shape[1],
+            2 * self.token_s,
+        )
+
+        # get the schedule, which is returned as (sigma, gamma) tuple, and pair up with the next sigma and gamma
+        sigmas = self.sample_schedule(num_sampling_steps)
+        gammas = torch.where(sigmas > self.gamma_min, self.gamma_0, 0.0)
+        sigmas_and_gammas = list(zip(sigmas[:-1], sigmas[1:], gammas[1:]))
+
+        # atom position is noise at the beginning
+        init_sigma = sigmas[0]
+        atom_coords = init_sigma * torch.randn(shape, device=self.device)
+        atom_coords_denoised = None
+        model_cache = {} if self.use_inference_model_cache else None
+
+        token_repr = None
+        token_a = None
+
+        # gradually denoise
+        for step_idx, (sigma_tm, sigma_t, gamma) in enumerate(sigmas_and_gammas):
+            random_R, random_tr = compute_random_augmentation(
+                multiplicity, device=atom_coords.device, dtype=atom_coords.dtype
+            )
+            atom_coords = atom_coords - atom_coords.mean(dim=-2, keepdims=True)
+            atom_coords = (
+                torch.einsum("bmd,bds->bms", atom_coords, random_R) + random_tr
+            )
+            if atom_coords_denoised is not None:
+                atom_coords_denoised -= atom_coords_denoised.mean(dim=-2, keepdims=True)
+                atom_coords_denoised = (
+                    torch.einsum("bmd,bds->bms", atom_coords_denoised, random_R)
+                    + random_tr
+                )
+            if (
+                steering_args is not None
+                and steering_args["physical_guidance_update"]
+                and scaled_guidance_update is not None
+            ):
+                scaled_guidance_update = torch.einsum(
+                    "bmd,bds->bms", scaled_guidance_update, random_R
+                )
+
+            sigma_tm, sigma_t, gamma = sigma_tm.item(), sigma_t.item(), gamma.item()
+
+            t_hat = sigma_tm * (1 + gamma)
+            steering_t = 1.0 - (step_idx / num_sampling_steps)
+            noise_var = self.noise_scale**2 * (t_hat**2 - sigma_tm**2)
+            eps = sqrt(noise_var) * torch.randn(shape, device=self.device)
+            atom_coords_noisy = atom_coords + eps
+
+            with torch.no_grad():
+                atom_coords_denoised = torch.zeros_like(atom_coords_noisy)
+                token_a = torch.zeros(token_repr_shape).to(atom_coords_noisy)
+
+                sample_ids = torch.arange(multiplicity).to(atom_coords_noisy.device)
+                sample_ids_chunks = sample_ids.chunk(
+                    multiplicity % max_parallel_samples + 1
+                )
+                for sample_ids_chunk in sample_ids_chunks:
+                    atom_coords_denoised_chunk, token_a_chunk = (
+                        self.preconditioned_network_forward(
+                            atom_coords_noisy[sample_ids_chunk],
+                            t_hat,
+                            training=False,
+                            network_condition_kwargs=dict(
+                                multiplicity=sample_ids_chunk.numel(),
+                                model_cache=model_cache,
+                                **network_condition_kwargs,
+                            ),
+                        )
+                    )
+                    atom_coords_denoised[sample_ids_chunk] = atom_coords_denoised_chunk
+                    token_a[sample_ids_chunk] = token_a_chunk
+
+                if (
+                    steering_args is not None
+                    and steering_args["fk_steering"]
+                    and (
+                        (
+                            step_idx % steering_args["fk_resampling_interval"] == 0
+                            and noise_var > 0
+                        )
+                        or step_idx == num_sampling_steps - 1
+                    )
+                ):
+                    # Compute energy of x_0 prediction
+                    energy = torch.zeros(multiplicity, device=self.device)
+                    for potential in potentials:
+                        parameters = potential.compute_parameters(steering_t)
+                        if parameters["resampling_weight"] > 0:
+                            component_energy = potential.compute(
+                                atom_coords_denoised,
+                                network_condition_kwargs["feats"],
+                                parameters,
+                            )
+                            energy += parameters["resampling_weight"] * component_energy
+                    energy_traj = torch.cat((energy_traj, energy.unsqueeze(1)), dim=1)
+
+                    # Compute log G values
+                    if step_idx == 0:
+                        log_G = -1 * energy
+                    else:
+                        log_G = energy_traj[:, -2] - energy_traj[:, -1]
+
+                    # Compute ll difference between guided and unguided transition distribution
+                    if steering_args["physical_guidance_update"] and noise_var > 0:
+                        ll_difference = (
+                            eps**2 - (eps + scaled_guidance_update) ** 2
+                        ).sum(dim=(-1, -2)) / (2 * noise_var)
+                    else:
+                        ll_difference = torch.zeros_like(energy)
+
+                    # Compute resampling weights
+                    resample_weights = F.softmax(
+                        (ll_difference + steering_args["fk_lambda"] * log_G).reshape(
+                            -1, steering_args["num_particles"]
+                        ),
+                        dim=1,
+                    )
+
+                # Compute guidance update to x_0 prediction
+                if (
+                    steering_args is not None
+                    and steering_args["physical_guidance_update"]
+                    and step_idx < num_sampling_steps - 1
+                ):
+                    guidance_update = torch.zeros_like(atom_coords_denoised)
+                    for guidance_step in range(steering_args["num_gd_steps"]):
+                        energy_gradient = torch.zeros_like(atom_coords_denoised)
+                        for potential in potentials:
+                            parameters = potential.compute_parameters(steering_t)
+                            if (
+                                parameters["guidance_weight"] > 0
+                                and (guidance_step) % parameters["guidance_interval"]
+                                == 0
+                            ):
+                                energy_gradient += parameters[
+                                    "guidance_weight"
+                                ] * potential.compute_gradient(
+                                    atom_coords_denoised + guidance_update,
+                                    network_condition_kwargs["feats"],
+                                    parameters,
+                                )
+                        guidance_update -= energy_gradient
+                    atom_coords_denoised += guidance_update
+                    scaled_guidance_update = (
+                        guidance_update
+                        * -1
+                        * self.step_scale
+                        * (sigma_t - t_hat)
+                        / t_hat
+                    )
+
+                if (
+                    steering_args is not None
+                    and steering_args["fk_steering"]
+                    and (
+                        (
+                            step_idx % steering_args["fk_resampling_interval"] == 0
+                            and noise_var > 0
+                        )
+                        or step_idx == num_sampling_steps - 1
+                    )
+                ):
+                    resample_indices = (
+                        torch.multinomial(
+                            resample_weights,
+                            resample_weights.shape[1]
+                            if step_idx < num_sampling_steps - 1
+                            else 1,
+                            replacement=True,
+                        )
+                        + resample_weights.shape[1]
+                        * torch.arange(
+                            resample_weights.shape[0], device=resample_weights.device
+                        ).unsqueeze(-1)
+                    ).flatten()
+
+                    atom_coords = atom_coords[resample_indices]
+                    atom_coords_noisy = atom_coords_noisy[resample_indices]
+                    atom_mask = atom_mask[resample_indices]
+                    if atom_coords_denoised is not None:
+                        atom_coords_denoised = atom_coords_denoised[resample_indices]
+                    energy_traj = energy_traj[resample_indices]
+                    if steering_args["physical_guidance_update"]:
+                        scaled_guidance_update = scaled_guidance_update[
+                            resample_indices
+                        ]
+                    if token_repr is not None:
+                        token_repr = token_repr[resample_indices]
+                    if token_a is not None:
+                        token_a = token_a[resample_indices]
+
+            if self.accumulate_token_repr:
+                if token_repr is None:
+                    token_repr = torch.zeros_like(token_a)
+
+                with torch.set_grad_enabled(train_accumulate_token_repr):
+                    sigma = torch.full(
+                        (atom_coords_denoised.shape[0],),
+                        t_hat,
+                        device=atom_coords_denoised.device,
+                    )
+                    token_repr = self.out_token_feat_update(
+                        times=self.c_noise(sigma), acc_a=token_repr, next_a=token_a
+                    )
+
+            if self.alignment_reverse_diff:
+                with torch.autocast("cuda", enabled=False):
+                    atom_coords_noisy = weighted_rigid_align(
+                        atom_coords_noisy.float(),
+                        atom_coords_denoised.float(),
+                        atom_mask.float(),
+                        atom_mask.float(),
+                    )
+
+                atom_coords_noisy = atom_coords_noisy.to(atom_coords_denoised)
+
+            denoised_over_sigma = (atom_coords_noisy - atom_coords_denoised) / t_hat
+            atom_coords_next = (
+                atom_coords_noisy
+                + self.step_scale * (sigma_t - t_hat) * denoised_over_sigma
+            )
+
+            atom_coords = atom_coords_next
+
+        return dict(sample_atom_coords=atom_coords, diff_token_repr=token_repr)
+
+    def loss_weight(self, sigma):
+        return (sigma**2 + self.sigma_data**2) / ((sigma * self.sigma_data) ** 2)
+
+    def noise_distribution(self, batch_size):
+        return (
+            self.sigma_data
+            * (
+                self.P_mean
+                + self.P_std * torch.randn((batch_size,), device=self.device)
+            ).exp()
+        )
+
+    def forward(
+        self,
+        s_inputs,
+        s_trunk,
+        z_trunk,
+        relative_position_encoding,
+        feats,
+        multiplicity=1,
+    ):
+        # training diffusion step
+        batch_size = feats["coords"].shape[0]
+
+        if self.synchronize_sigmas:
+            sigmas = self.noise_distribution(batch_size).repeat_interleave(
+                multiplicity, 0
+            )
+        else:
+            sigmas = self.noise_distribution(batch_size * multiplicity)
+        padded_sigmas = rearrange(sigmas, "b -> b 1 1")
+
+        atom_coords = feats["coords"]
+        B, N, L = atom_coords.shape[0:3]
+        atom_coords = atom_coords.reshape(B * N, L, 3)
+        atom_coords = atom_coords.repeat_interleave(multiplicity // N, 0)
+        feats["coords"] = atom_coords
+
+        atom_mask = feats["atom_pad_mask"]
+        atom_mask = atom_mask.repeat_interleave(multiplicity, 0)
+
+        atom_coords = center_random_augmentation(
+            atom_coords, atom_mask, augmentation=self.coordinate_augmentation
+        )
+
+        noise = torch.randn_like(atom_coords)
+        noised_atom_coords = atom_coords + padded_sigmas * noise
+
+        denoised_atom_coords, _ = self.preconditioned_network_forward(
+            noised_atom_coords,
+            sigmas,
+            training=True,
+            network_condition_kwargs=dict(
+                s_inputs=s_inputs,
+                s_trunk=s_trunk,
+                z_trunk=z_trunk,
+                relative_position_encoding=relative_position_encoding,
+                feats=feats,
+                multiplicity=multiplicity,
+            ),
+        )
+
+        return dict(
+            noised_atom_coords=noised_atom_coords,
+            denoised_atom_coords=denoised_atom_coords,
+            sigmas=sigmas,
+            aligned_true_atom_coords=atom_coords,
+        )
+
+    def compute_loss(
+        self,
+        feats,
+        out_dict,
+        add_smooth_lddt_loss=True,
+        nucleotide_loss_weight=5.0,
+        ligand_loss_weight=10.0,
+        multiplicity=1,
+    ):
+        denoised_atom_coords = out_dict["denoised_atom_coords"]
+        noised_atom_coords = out_dict["noised_atom_coords"]
+        sigmas = out_dict["sigmas"]
+
+        resolved_atom_mask = feats["atom_resolved_mask"]
+        resolved_atom_mask = resolved_atom_mask.repeat_interleave(multiplicity, 0)
+
+        align_weights = noised_atom_coords.new_ones(noised_atom_coords.shape[:2])
+        atom_type = (
+            torch.bmm(
+                feats["atom_to_token"].float(), feats["mol_type"].unsqueeze(-1).float()
+            )
+            .squeeze(-1)
+            .long()
+        )
+        atom_type_mult = atom_type.repeat_interleave(multiplicity, 0)
+
+        align_weights = align_weights * (
+            1
+            + nucleotide_loss_weight
+            * (
+                torch.eq(atom_type_mult, const.chain_type_ids["DNA"]).float()
+                + torch.eq(atom_type_mult, const.chain_type_ids["RNA"]).float()
+            )
+            + ligand_loss_weight
+            * torch.eq(atom_type_mult, const.chain_type_ids["NONPOLYMER"]).float()
+        )
+
+        with torch.no_grad(), torch.autocast("cuda", enabled=False):
+            atom_coords = out_dict["aligned_true_atom_coords"]
+            atom_coords_aligned_ground_truth = weighted_rigid_align(
+                atom_coords.detach().float(),
+                denoised_atom_coords.detach().float(),
+                align_weights.detach().float(),
+                mask=resolved_atom_mask.detach().float(),
+            )
+
+        # Cast back
+        atom_coords_aligned_ground_truth = atom_coords_aligned_ground_truth.to(
+            denoised_atom_coords
+        )
+
+        # weighted MSE loss of denoised atom positions
+        mse_loss = ((denoised_atom_coords - atom_coords_aligned_ground_truth) ** 2).sum(
+            dim=-1
+        )
+        mse_loss = torch.sum(
+            mse_loss * align_weights * resolved_atom_mask, dim=-1
+        ) / torch.sum(3 * align_weights * resolved_atom_mask, dim=-1)
+
+        # weight by sigma factor
+        loss_weights = self.loss_weight(sigmas)
+        mse_loss = (mse_loss * loss_weights).mean()
+
+        total_loss = mse_loss
+
+        # proposed auxiliary smooth lddt loss
+        lddt_loss = self.zero
+        if add_smooth_lddt_loss:
+            lddt_loss = smooth_lddt_loss(
+                denoised_atom_coords,
+                feats["coords"],
+                torch.eq(atom_type, const.chain_type_ids["DNA"]).float()
+                + torch.eq(atom_type, const.chain_type_ids["RNA"]).float(),
+                coords_mask=feats["atom_resolved_mask"],
+                multiplicity=multiplicity,
+            )
+
+            total_loss = total_loss + lddt_loss
+
+        loss_breakdown = dict(
+            mse_loss=mse_loss,
+            smooth_lddt_loss=lddt_loss,
+        )
+
+        return dict(loss=total_loss, loss_breakdown=loss_breakdown)
diff --git a/forks/boltz/src/boltz/model/modules/diffusion_conditioning.py b/forks/boltz/src/boltz/model/modules/diffusion_conditioning.py
new file mode 100644
index 00000000..374e8278
--- /dev/null
+++ b/forks/boltz/src/boltz/model/modules/diffusion_conditioning.py
@@ -0,0 +1,116 @@
+from __future__ import annotations
+
+import torch
+from torch import nn
+from torch.nn import Module
+
+from boltz.model.modules.encodersv2 import (
+    AtomEncoder,
+    PairwiseConditioning,
+)
+
+
+class DiffusionConditioning(Module):
+    def __init__(
+        self,
+        token_s: int,
+        token_z: int,
+        atom_s: int,
+        atom_z: int,
+        atoms_per_window_queries: int = 32,
+        atoms_per_window_keys: int = 128,
+        atom_encoder_depth: int = 3,
+        atom_encoder_heads: int = 4,
+        token_transformer_depth: int = 24,
+        token_transformer_heads: int = 8,
+        atom_decoder_depth: int = 3,
+        atom_decoder_heads: int = 4,
+        atom_feature_dim: int = 128,
+        conditioning_transition_layers: int = 2,
+        use_no_atom_char: bool = False,
+        use_atom_backbone_feat: bool = False,
+        use_residue_feats_atoms: bool = False,
+    ) -> None:
+        super().__init__()
+
+        self.pairwise_conditioner = PairwiseConditioning(
+            token_z=token_z,
+            dim_token_rel_pos_feats=token_z,
+            num_transitions=conditioning_transition_layers,
+        )
+
+        self.atom_encoder = AtomEncoder(
+            atom_s=atom_s,
+            atom_z=atom_z,
+            token_s=token_s,
+            token_z=token_z,
+            atoms_per_window_queries=atoms_per_window_queries,
+            atoms_per_window_keys=atoms_per_window_keys,
+            atom_feature_dim=atom_feature_dim,
+            structure_prediction=True,
+            use_no_atom_char=use_no_atom_char,
+            use_atom_backbone_feat=use_atom_backbone_feat,
+            use_residue_feats_atoms=use_residue_feats_atoms,
+        )
+
+        self.atom_enc_proj_z = nn.ModuleList()
+        for _ in range(atom_encoder_depth):
+            self.atom_enc_proj_z.append(
+                nn.Sequential(
+                    nn.LayerNorm(atom_z),
+                    nn.Linear(atom_z, atom_encoder_heads, bias=False),
+                )
+            )
+
+        self.atom_dec_proj_z = nn.ModuleList()
+        for _ in range(atom_decoder_depth):
+            self.atom_dec_proj_z.append(
+                nn.Sequential(
+                    nn.LayerNorm(atom_z),
+                    nn.Linear(atom_z, atom_decoder_heads, bias=False),
+                )
+            )
+
+        self.token_trans_proj_z = nn.ModuleList()
+        for _ in range(token_transformer_depth):
+            self.token_trans_proj_z.append(
+                nn.Sequential(
+                    nn.LayerNorm(token_z),
+                    nn.Linear(token_z, token_transformer_heads, bias=False),
+                )
+            )
+
+    def forward(
+        self,
+        s_trunk,  # Float['b n ts']
+        z_trunk,  # Float['b n n tz']
+        relative_position_encoding,  # Float['b n n tz']
+        feats,
+    ):
+        z = self.pairwise_conditioner(
+            z_trunk,
+            relative_position_encoding,
+        )
+
+        q, c, p, to_keys = self.atom_encoder(
+            feats=feats,
+            s_trunk=s_trunk,  # Float['b n ts'],
+            z=z,  # Float['b n n tz'],
+        )
+
+        atom_enc_bias = []
+        for layer in self.atom_enc_proj_z:
+            atom_enc_bias.append(layer(p))
+        atom_enc_bias = torch.cat(atom_enc_bias, dim=-1)
+
+        atom_dec_bias = []
+        for layer in self.atom_dec_proj_z:
+            atom_dec_bias.append(layer(p))
+        atom_dec_bias = torch.cat(atom_dec_bias, dim=-1)
+
+        token_trans_bias = []
+        for layer in self.token_trans_proj_z:
+            token_trans_bias.append(layer(z))
+        token_trans_bias = torch.cat(token_trans_bias, dim=-1)
+
+        return q, c, to_keys, atom_enc_bias, atom_dec_bias, token_trans_bias
diff --git a/forks/boltz/src/boltz/model/modules/diffusionv2.py b/forks/boltz/src/boltz/model/modules/diffusionv2.py
new file mode 100644
index 00000000..fd1af56d
--- /dev/null
+++ b/forks/boltz/src/boltz/model/modules/diffusionv2.py
@@ -0,0 +1,693 @@
+# started from code from https://github.com/lucidrains/alphafold3-pytorch, MIT License, Copyright (c) 2024 Phil Wang
+
+from __future__ import annotations
+
+from math import sqrt
+
+import numpy as np
+import torch
+import torch.nn.functional as F  # noqa: N812
+from einops import rearrange
+from torch import nn
+from torch.nn import Module
+
+import boltz.model.layers.initialize as init
+from boltz.data import const
+from boltz.model.loss.diffusionv2 import (
+    smooth_lddt_loss,
+    weighted_rigid_align,
+)
+from boltz.model.modules.encodersv2 import (
+    AtomAttentionDecoder,
+    AtomAttentionEncoder,
+    SingleConditioning,
+)
+from boltz.model.modules.transformersv2 import (
+    DiffusionTransformer,
+)
+from boltz.model.modules.utils import (
+    LinearNoBias,
+    center_random_augmentation,
+    compute_random_augmentation,
+    default,
+    log,
+)
+from boltz.model.potentials.potentials import get_potentials
+
+
+class DiffusionModule(Module):
+    """Diffusion module"""
+
+    def __init__(
+        self,
+        token_s: int,
+        atom_s: int,
+        atoms_per_window_queries: int = 32,
+        atoms_per_window_keys: int = 128,
+        sigma_data: int = 16,
+        dim_fourier: int = 256,
+        atom_encoder_depth: int = 3,
+        atom_encoder_heads: int = 4,
+        token_transformer_depth: int = 24,
+        token_transformer_heads: int = 8,
+        atom_decoder_depth: int = 3,
+        atom_decoder_heads: int = 4,
+        conditioning_transition_layers: int = 2,
+        activation_checkpointing: bool = False,
+        transformer_post_ln: bool = False,
+    ) -> None:
+        super().__init__()
+
+        self.atoms_per_window_queries = atoms_per_window_queries
+        self.atoms_per_window_keys = atoms_per_window_keys
+        self.sigma_data = sigma_data
+        self.activation_checkpointing = activation_checkpointing
+
+        # conditioning
+        self.single_conditioner = SingleConditioning(
+            sigma_data=sigma_data,
+            token_s=token_s,
+            dim_fourier=dim_fourier,
+            num_transitions=conditioning_transition_layers,
+        )
+
+        self.atom_attention_encoder = AtomAttentionEncoder(
+            atom_s=atom_s,
+            token_s=token_s,
+            atoms_per_window_queries=atoms_per_window_queries,
+            atoms_per_window_keys=atoms_per_window_keys,
+            atom_encoder_depth=atom_encoder_depth,
+            atom_encoder_heads=atom_encoder_heads,
+            structure_prediction=True,
+            activation_checkpointing=activation_checkpointing,
+            transformer_post_layer_norm=transformer_post_ln,
+        )
+
+        self.s_to_a_linear = nn.Sequential(
+            nn.LayerNorm(2 * token_s), LinearNoBias(2 * token_s, 2 * token_s)
+        )
+        init.final_init_(self.s_to_a_linear[1].weight)
+
+        self.token_transformer = DiffusionTransformer(
+            dim=2 * token_s,
+            dim_single_cond=2 * token_s,
+            depth=token_transformer_depth,
+            heads=token_transformer_heads,
+            activation_checkpointing=activation_checkpointing,
+            # post_layer_norm=transformer_post_ln,
+        )
+
+        self.a_norm = nn.LayerNorm(
+            2 * token_s
+        )  # if not transformer_post_ln else nn.Identity()
+
+        self.atom_attention_decoder = AtomAttentionDecoder(
+            atom_s=atom_s,
+            token_s=token_s,
+            attn_window_queries=atoms_per_window_queries,
+            attn_window_keys=atoms_per_window_keys,
+            atom_decoder_depth=atom_decoder_depth,
+            atom_decoder_heads=atom_decoder_heads,
+            activation_checkpointing=activation_checkpointing,
+            # transformer_post_layer_norm=transformer_post_ln,
+        )
+
+    def forward(
+        self,
+        s_inputs,  # Float['b n ts']
+        s_trunk,  # Float['b n ts']
+        r_noisy,  # Float['bm m 3']
+        times,  # Float['bm 1 1']
+        feats,
+        diffusion_conditioning,
+        multiplicity=1,
+    ):
+        if self.activation_checkpointing and self.training:
+            s, normed_fourier = torch.utils.checkpoint.checkpoint(
+                self.single_conditioner,
+                times,
+                s_trunk.repeat_interleave(multiplicity, 0),
+                s_inputs.repeat_interleave(multiplicity, 0),
+            )
+        else:
+            s, normed_fourier = self.single_conditioner(
+                times,
+                s_trunk.repeat_interleave(multiplicity, 0),
+                s_inputs.repeat_interleave(multiplicity, 0),
+            )
+
+        # Sequence-local Atom Attention and aggregation to coarse-grained tokens
+        a, q_skip, c_skip, to_keys = self.atom_attention_encoder(
+            feats=feats,
+            q=diffusion_conditioning["q"].float(),
+            c=diffusion_conditioning["c"].float(),
+            atom_enc_bias=diffusion_conditioning["atom_enc_bias"].float(),
+            to_keys=diffusion_conditioning["to_keys"],
+            r=r_noisy,  # Float['b m 3'],
+            multiplicity=multiplicity,
+        )
+
+        # Full self-attention on token level
+        a = a + self.s_to_a_linear(s)
+
+        mask = feats["token_pad_mask"].repeat_interleave(multiplicity, 0)
+        a = self.token_transformer(
+            a,
+            mask=mask.float(),
+            s=s,
+            bias=diffusion_conditioning[
+                "token_trans_bias"
+            ].float(),  # note z is not expanded with multiplicity until after bias is computed
+            multiplicity=multiplicity,
+        )
+        a = self.a_norm(a)
+
+        # Broadcast token activations to atoms and run Sequence-local Atom Attention
+        r_update = self.atom_attention_decoder(
+            a=a,
+            q=q_skip,
+            c=c_skip,
+            atom_dec_bias=diffusion_conditioning["atom_dec_bias"].float(),
+            feats=feats,
+            multiplicity=multiplicity,
+            to_keys=to_keys,
+        )
+
+        return r_update
+
+
+class AtomDiffusion(Module):
+    def __init__(
+        self,
+        score_model_args,
+        num_sampling_steps: int = 5,  # number of sampling steps
+        sigma_min: float = 0.0004,  # min noise level
+        sigma_max: float = 160.0,  # max noise level
+        sigma_data: float = 16.0,  # standard deviation of data distribution
+        rho: float = 7,  # controls the sampling schedule
+        P_mean: float = -1.2,  # mean of log-normal distribution from which noise is drawn for training
+        P_std: float = 1.5,  # standard deviation of log-normal distribution from which noise is drawn for training
+        gamma_0: float = 0.8,
+        gamma_min: float = 1.0,
+        noise_scale: float = 1.003,
+        step_scale: float = 1.5,
+        step_scale_random: list = None,
+        coordinate_augmentation: bool = True,
+        coordinate_augmentation_inference=None,
+        compile_score: bool = False,
+        alignment_reverse_diff: bool = False,
+        synchronize_sigmas: bool = False,
+    ):
+        super().__init__()
+        self.score_model = DiffusionModule(
+            **score_model_args,
+        )
+        if compile_score:
+            self.score_model = torch.compile(
+                self.score_model, dynamic=False, fullgraph=False
+            )
+
+        # parameters
+        self.sigma_min = sigma_min
+        self.sigma_max = sigma_max
+        self.sigma_data = sigma_data
+        self.rho = rho
+        self.P_mean = P_mean
+        self.P_std = P_std
+        self.num_sampling_steps = num_sampling_steps
+        self.gamma_0 = gamma_0
+        self.gamma_min = gamma_min
+        self.noise_scale = noise_scale
+        self.step_scale = step_scale
+        self.step_scale_random = step_scale_random
+        self.coordinate_augmentation = coordinate_augmentation
+        self.coordinate_augmentation_inference = (
+            coordinate_augmentation_inference
+            if coordinate_augmentation_inference is not None
+            else coordinate_augmentation
+        )
+        self.alignment_reverse_diff = alignment_reverse_diff
+        self.synchronize_sigmas = synchronize_sigmas
+
+        self.token_s = score_model_args["token_s"]
+        self.register_buffer("zero", torch.tensor(0.0), persistent=False)
+
+    @property
+    def device(self):
+        return next(self.score_model.parameters()).device
+
+    def c_skip(self, sigma):
+        return (self.sigma_data**2) / (sigma**2 + self.sigma_data**2)
+
+    def c_out(self, sigma):
+        return sigma * self.sigma_data / torch.sqrt(self.sigma_data**2 + sigma**2)
+
+    def c_in(self, sigma):
+        return 1 / torch.sqrt(sigma**2 + self.sigma_data**2)
+
+    def c_noise(self, sigma):
+        return log(sigma / self.sigma_data) * 0.25
+
+    def preconditioned_network_forward(
+        self,
+        noised_atom_coords,  #: Float['b m 3'],
+        sigma,  #: Float['b'] | Float[' '] | float,
+        network_condition_kwargs: dict,
+    ):
+        batch, device = noised_atom_coords.shape[0], noised_atom_coords.device
+
+        if isinstance(sigma, float):
+            sigma = torch.full((batch,), sigma, device=device)
+
+        padded_sigma = rearrange(sigma, "b -> b 1 1")
+
+        r_update = self.score_model(
+            r_noisy=self.c_in(padded_sigma) * noised_atom_coords,
+            times=self.c_noise(sigma),
+            **network_condition_kwargs,
+        )
+
+        denoised_coords = (
+            self.c_skip(padded_sigma) * noised_atom_coords
+            + self.c_out(padded_sigma) * r_update
+        )
+        return denoised_coords
+
+    def sample_schedule(self, num_sampling_steps=None):
+        num_sampling_steps = default(num_sampling_steps, self.num_sampling_steps)
+        inv_rho = 1 / self.rho
+
+        steps = torch.arange(
+            num_sampling_steps, device=self.device, dtype=torch.float32
+        )
+        sigmas = (
+            self.sigma_max**inv_rho
+            + steps
+            / (num_sampling_steps - 1)
+            * (self.sigma_min**inv_rho - self.sigma_max**inv_rho)
+        ) ** self.rho
+
+        sigmas = sigmas * self.sigma_data
+
+        sigmas = F.pad(sigmas, (0, 1), value=0.0)  # last step is sigma value of 0.
+        return sigmas
+
+    def sample(
+        self,
+        atom_mask,
+        num_sampling_steps=None,
+        multiplicity=1,
+        max_parallel_samples=None,
+        steering_args=None,
+        **network_condition_kwargs,
+    ):
+        if steering_args is not None and (
+            steering_args["fk_steering"]
+            or steering_args["physical_guidance_update"]
+            or steering_args["contact_guidance_update"]
+        ):
+            potentials = get_potentials(steering_args, boltz2=True)
+
+        if steering_args["fk_steering"]:
+            multiplicity = multiplicity * steering_args["num_particles"]
+            energy_traj = torch.empty((multiplicity, 0), device=self.device)
+            resample_weights = torch.ones(multiplicity, device=self.device).reshape(
+                -1, steering_args["num_particles"]
+            )
+        if (
+            steering_args["physical_guidance_update"]
+            or steering_args["contact_guidance_update"]
+        ):
+            scaled_guidance_update = torch.zeros(
+                (multiplicity, *atom_mask.shape[1:], 3),
+                dtype=torch.float32,
+                device=self.device,
+            )
+        if max_parallel_samples is None:
+            max_parallel_samples = multiplicity
+
+        num_sampling_steps = default(num_sampling_steps, self.num_sampling_steps)
+        atom_mask = atom_mask.repeat_interleave(multiplicity, 0)
+
+        shape = (*atom_mask.shape, 3)
+
+        # get the schedule, which is returned as (sigma, gamma) tuple, and pair up with the next sigma and gamma
+        sigmas = self.sample_schedule(num_sampling_steps)
+        gammas = torch.where(sigmas > self.gamma_min, self.gamma_0, 0.0)
+        sigmas_and_gammas = list(zip(sigmas[:-1], sigmas[1:], gammas[1:]))
+        if self.training and self.step_scale_random is not None:
+            step_scale = np.random.choice(self.step_scale_random)
+        else:
+            step_scale = self.step_scale
+
+        # atom position is noise at the beginning
+        init_sigma = sigmas[0]
+        atom_coords = init_sigma * torch.randn(shape, device=self.device)
+        token_repr = None
+        atom_coords_denoised = None
+
+        # gradually denoise
+        for step_idx, (sigma_tm, sigma_t, gamma) in enumerate(sigmas_and_gammas):
+            random_R, random_tr = compute_random_augmentation(
+                multiplicity, device=atom_coords.device, dtype=atom_coords.dtype
+            )
+            atom_coords = atom_coords - atom_coords.mean(dim=-2, keepdims=True)
+            atom_coords = (
+                torch.einsum("bmd,bds->bms", atom_coords, random_R) + random_tr
+            )
+            if atom_coords_denoised is not None:
+                atom_coords_denoised -= atom_coords_denoised.mean(dim=-2, keepdims=True)
+                atom_coords_denoised = (
+                    torch.einsum("bmd,bds->bms", atom_coords_denoised, random_R)
+                    + random_tr
+                )
+            if (
+                steering_args["physical_guidance_update"]
+                or steering_args["contact_guidance_update"]
+            ) and scaled_guidance_update is not None:
+                scaled_guidance_update = torch.einsum(
+                    "bmd,bds->bms", scaled_guidance_update, random_R
+                )
+
+            sigma_tm, sigma_t, gamma = sigma_tm.item(), sigma_t.item(), gamma.item()
+
+            t_hat = sigma_tm * (1 + gamma)
+            steering_t = 1.0 - (step_idx / num_sampling_steps)
+            noise_var = self.noise_scale**2 * (t_hat**2 - sigma_tm**2)
+            eps = sqrt(noise_var) * torch.randn(shape, device=self.device)
+            atom_coords_noisy = atom_coords + eps
+
+            with torch.no_grad():
+                atom_coords_denoised = torch.zeros_like(atom_coords_noisy)
+                sample_ids = torch.arange(multiplicity).to(atom_coords_noisy.device)
+                sample_ids_chunks = sample_ids.chunk(
+                    multiplicity % max_parallel_samples + 1
+                )
+
+                for sample_ids_chunk in sample_ids_chunks:
+                    atom_coords_denoised_chunk = self.preconditioned_network_forward(
+                        atom_coords_noisy[sample_ids_chunk],
+                        t_hat,
+                        network_condition_kwargs=dict(
+                            multiplicity=sample_ids_chunk.numel(),
+                            **network_condition_kwargs,
+                        ),
+                    )
+                    atom_coords_denoised[sample_ids_chunk] = atom_coords_denoised_chunk
+
+                if steering_args["fk_steering"] and (
+                    (
+                        step_idx % steering_args["fk_resampling_interval"] == 0
+                        and noise_var > 0
+                    )
+                    or step_idx == num_sampling_steps - 1
+                ):
+                    # Compute energy of x_0 prediction
+                    energy = torch.zeros(multiplicity, device=self.device)
+                    for potential in potentials:
+                        parameters = potential.compute_parameters(steering_t)
+                        if parameters["resampling_weight"] > 0:
+                            component_energy = potential.compute(
+                                atom_coords_denoised,
+                                network_condition_kwargs["feats"],
+                                parameters,
+                            )
+                            energy += parameters["resampling_weight"] * component_energy
+                    energy_traj = torch.cat((energy_traj, energy.unsqueeze(1)), dim=1)
+
+                    # Compute log G values
+                    if step_idx == 0:
+                        log_G = -1 * energy
+                    else:
+                        log_G = energy_traj[:, -2] - energy_traj[:, -1]
+
+                    # Compute ll difference between guided and unguided transition distribution
+                    if (
+                        steering_args["physical_guidance_update"]
+                        or steering_args["contact_guidance_update"]
+                    ) and noise_var > 0:
+                        ll_difference = (
+                            eps**2 - (eps + scaled_guidance_update) ** 2
+                        ).sum(dim=(-1, -2)) / (2 * noise_var)
+                    else:
+                        ll_difference = torch.zeros_like(energy)
+
+                    # Compute resampling weights
+                    resample_weights = F.softmax(
+                        (ll_difference + steering_args["fk_lambda"] * log_G).reshape(
+                            -1, steering_args["num_particles"]
+                        ),
+                        dim=1,
+                    )
+
+                # Compute guidance update to x_0 prediction
+                if (
+                    steering_args["physical_guidance_update"]
+                    or steering_args["contact_guidance_update"]
+                ) and step_idx < num_sampling_steps - 1:
+                    guidance_update = torch.zeros_like(atom_coords_denoised)
+                    for guidance_step in range(steering_args["num_gd_steps"]):
+                        energy_gradient = torch.zeros_like(atom_coords_denoised)
+                        for potential in potentials:
+                            parameters = potential.compute_parameters(steering_t)
+                            if (
+                                parameters["guidance_weight"] > 0
+                                and (guidance_step) % parameters["guidance_interval"]
+                                == 0
+                            ):
+                                energy_gradient += parameters[
+                                    "guidance_weight"
+                                ] * potential.compute_gradient(
+                                    atom_coords_denoised + guidance_update,
+                                    network_condition_kwargs["feats"],
+                                    parameters,
+                                )
+                        guidance_update -= energy_gradient
+                    atom_coords_denoised += guidance_update
+                    scaled_guidance_update = (
+                        guidance_update
+                        * -1
+                        * self.step_scale
+                        * (sigma_t - t_hat)
+                        / t_hat
+                    )
+
+                if steering_args["fk_steering"] and (
+                    (
+                        step_idx % steering_args["fk_resampling_interval"] == 0
+                        and noise_var > 0
+                    )
+                    or step_idx == num_sampling_steps - 1
+                ):
+                    resample_indices = (
+                        torch.multinomial(
+                            resample_weights,
+                            resample_weights.shape[1]
+                            if step_idx < num_sampling_steps - 1
+                            else 1,
+                            replacement=True,
+                        )
+                        + resample_weights.shape[1]
+                        * torch.arange(
+                            resample_weights.shape[0], device=resample_weights.device
+                        ).unsqueeze(-1)
+                    ).flatten()
+
+                    atom_coords = atom_coords[resample_indices]
+                    atom_coords_noisy = atom_coords_noisy[resample_indices]
+                    atom_mask = atom_mask[resample_indices]
+                    if atom_coords_denoised is not None:
+                        atom_coords_denoised = atom_coords_denoised[resample_indices]
+                    energy_traj = energy_traj[resample_indices]
+                    if (
+                        steering_args["physical_guidance_update"]
+                        or steering_args["contact_guidance_update"]
+                    ):
+                        scaled_guidance_update = scaled_guidance_update[
+                            resample_indices
+                        ]
+                    if token_repr is not None:
+                        token_repr = token_repr[resample_indices]
+
+            if self.alignment_reverse_diff:
+                with torch.autocast("cuda", enabled=False):
+                    atom_coords_noisy = weighted_rigid_align(
+                        atom_coords_noisy.float(),
+                        atom_coords_denoised.float(),
+                        atom_mask.float(),
+                        atom_mask.float(),
+                    )
+
+                atom_coords_noisy = atom_coords_noisy.to(atom_coords_denoised)
+
+            denoised_over_sigma = (atom_coords_noisy - atom_coords_denoised) / t_hat
+            atom_coords_next = (
+                atom_coords_noisy + step_scale * (sigma_t - t_hat) * denoised_over_sigma
+            )
+
+            atom_coords = atom_coords_next
+
+        return dict(sample_atom_coords=atom_coords, diff_token_repr=token_repr)
+
+    def loss_weight(self, sigma):
+        return (sigma**2 + self.sigma_data**2) / ((sigma * self.sigma_data) ** 2)
+
+    def noise_distribution(self, batch_size):
+        return (
+            self.sigma_data
+            * (
+                self.P_mean
+                + self.P_std * torch.randn((batch_size,), device=self.device)
+            ).exp()
+        )
+
+    def forward(
+        self,
+        s_inputs,
+        s_trunk,
+        feats,
+        diffusion_conditioning,
+        multiplicity=1,
+    ):
+        # training diffusion step
+        batch_size = feats["coords"].shape[0] // multiplicity
+
+        if self.synchronize_sigmas:
+            sigmas = self.noise_distribution(batch_size).repeat_interleave(
+                multiplicity, 0
+            )
+        else:
+            sigmas = self.noise_distribution(batch_size * multiplicity)
+        padded_sigmas = rearrange(sigmas, "b -> b 1 1")
+
+        atom_coords = feats["coords"]
+
+        atom_mask = feats["atom_pad_mask"]
+        atom_mask = atom_mask.repeat_interleave(multiplicity, 0)
+
+        atom_coords = center_random_augmentation(
+            atom_coords, atom_mask, augmentation=self.coordinate_augmentation
+        )
+
+        noise = torch.randn_like(atom_coords)
+        noised_atom_coords = atom_coords + padded_sigmas * noise
+
+        denoised_atom_coords = self.preconditioned_network_forward(
+            noised_atom_coords,
+            sigmas,
+            network_condition_kwargs={
+                "s_inputs": s_inputs,
+                "s_trunk": s_trunk,
+                "feats": feats,
+                "multiplicity": multiplicity,
+                "diffusion_conditioning": diffusion_conditioning,
+            },
+        )
+
+        return {
+            "denoised_atom_coords": denoised_atom_coords,
+            "sigmas": sigmas,
+            "aligned_true_atom_coords": atom_coords,
+        }
+
+    def compute_loss(
+        self,
+        feats,
+        out_dict,
+        add_smooth_lddt_loss=True,
+        nucleotide_loss_weight=5.0,
+        ligand_loss_weight=10.0,
+        multiplicity=1,
+        filter_by_plddt=0.0,
+    ):
+        with torch.autocast("cuda", enabled=False):
+            denoised_atom_coords = out_dict["denoised_atom_coords"].float()
+            sigmas = out_dict["sigmas"].float()
+
+            resolved_atom_mask_uni = feats["atom_resolved_mask"].float()
+
+            if filter_by_plddt > 0:
+                plddt_mask = feats["plddt"] > filter_by_plddt
+                resolved_atom_mask_uni = resolved_atom_mask_uni * plddt_mask.float()
+
+            resolved_atom_mask = resolved_atom_mask_uni.repeat_interleave(
+                multiplicity, 0
+            )
+
+            align_weights = denoised_atom_coords.new_ones(denoised_atom_coords.shape[:2])
+            atom_type = (
+                torch.bmm(
+                    feats["atom_to_token"].float(),
+                    feats["mol_type"].unsqueeze(-1).float(),
+                )
+                .squeeze(-1)
+                .long()
+            )
+            atom_type_mult = atom_type.repeat_interleave(multiplicity, 0)
+
+            align_weights = (
+                align_weights
+                * (
+                    1
+                    + nucleotide_loss_weight
+                    * (
+                        torch.eq(atom_type_mult, const.chain_type_ids["DNA"]).float()
+                        + torch.eq(atom_type_mult, const.chain_type_ids["RNA"]).float()
+                    )
+                    + ligand_loss_weight
+                    * torch.eq(
+                        atom_type_mult, const.chain_type_ids["NONPOLYMER"]
+                    ).float()
+                ).float()
+            )
+
+            atom_coords = out_dict["aligned_true_atom_coords"].float()
+            atom_coords_aligned_ground_truth = weighted_rigid_align(
+                atom_coords.detach(),
+                denoised_atom_coords.detach(),
+                align_weights.detach(),
+                mask=feats["atom_resolved_mask"]
+                .float()
+                .repeat_interleave(multiplicity, 0)
+                .detach(),
+            )
+
+            # Cast back
+            atom_coords_aligned_ground_truth = atom_coords_aligned_ground_truth.to(
+                denoised_atom_coords
+            )
+
+            # weighted MSE loss of denoised atom positions
+            mse_loss = (
+                (denoised_atom_coords - atom_coords_aligned_ground_truth) ** 2
+            ).sum(dim=-1)
+            mse_loss = torch.sum(
+                mse_loss * align_weights * resolved_atom_mask, dim=-1
+            ) / (torch.sum(3 * align_weights * resolved_atom_mask, dim=-1) + 1e-5)
+
+            # weight by sigma factor
+            loss_weights = self.loss_weight(sigmas)
+            mse_loss = (mse_loss * loss_weights).mean()
+
+            total_loss = mse_loss
+
+            # proposed auxiliary smooth lddt loss
+            lddt_loss = self.zero
+            if add_smooth_lddt_loss:
+                lddt_loss = smooth_lddt_loss(
+                    denoised_atom_coords,
+                    feats["coords"],
+                    torch.eq(atom_type, const.chain_type_ids["DNA"]).float()
+                    + torch.eq(atom_type, const.chain_type_ids["RNA"]).float(),
+                    coords_mask=resolved_atom_mask_uni,
+                    multiplicity=multiplicity,
+                )
+
+                total_loss = total_loss + lddt_loss
+
+            loss_breakdown = {
+                "mse_loss": mse_loss,
+                "smooth_lddt_loss": lddt_loss,
+            }
+
+        return {"loss": total_loss, "loss_breakdown": loss_breakdown}
diff --git a/forks/boltz/src/boltz/model/modules/encoders.py b/forks/boltz/src/boltz/model/modules/encoders.py
new file mode 100644
index 00000000..d5054de9
--- /dev/null
+++ b/forks/boltz/src/boltz/model/modules/encoders.py
@@ -0,0 +1,639 @@
+# started from code from https://github.com/lucidrains/alphafold3-pytorch, MIT License, Copyright (c) 2024 Phil Wang
+from functools import partial
+from math import pi
+
+import torch
+from einops import rearrange
+from torch import nn
+from torch.nn import Module, ModuleList
+from torch.nn.functional import one_hot
+
+import boltz.model.layers.initialize as init
+from boltz.data import const
+from boltz.model.layers.transition import Transition
+from boltz.model.modules.transformers import AtomTransformer
+from boltz.model.modules.utils import LinearNoBias
+
+
+class FourierEmbedding(Module):
+    """Fourier embedding layer."""
+
+    def __init__(self, dim):
+        """Initialize the Fourier Embeddings.
+
+        Parameters
+        ----------
+        dim : int
+            The dimension of the embeddings.
+
+        """
+        super().__init__()
+        self.proj = nn.Linear(1, dim)
+        torch.nn.init.normal_(self.proj.weight, mean=0, std=1)
+        torch.nn.init.normal_(self.proj.bias, mean=0, std=1)
+        self.proj.requires_grad_(False)
+
+    def forward(
+        self,
+        times,
+    ):
+        times = rearrange(times, "b -> b 1")
+        rand_proj = self.proj(times)
+        return torch.cos(2 * pi * rand_proj)
+
+
+class RelativePositionEncoder(Module):
+    """Relative position encoder."""
+
+    def __init__(self, token_z, r_max=32, s_max=2):
+        """Initialize the relative position encoder.
+
+        Parameters
+        ----------
+        token_z : int
+            The pair representation dimension.
+        r_max : int, optional
+            The maximum index distance, by default 32.
+        s_max : int, optional
+            The maximum chain distance, by default 2.
+
+        """
+        super().__init__()
+        self.r_max = r_max
+        self.s_max = s_max
+        self.linear_layer = LinearNoBias(4 * (r_max + 1) + 2 * (s_max + 1) + 1, token_z)
+
+    def forward(self, feats):
+        b_same_chain = torch.eq(
+            feats["asym_id"][:, :, None], feats["asym_id"][:, None, :]
+        )
+        b_same_residue = torch.eq(
+            feats["residue_index"][:, :, None], feats["residue_index"][:, None, :]
+        )
+        b_same_entity = torch.eq(
+            feats["entity_id"][:, :, None], feats["entity_id"][:, None, :]
+        )
+        rel_pos = (
+            feats["residue_index"][:, :, None] - feats["residue_index"][:, None, :]
+        )
+        if torch.any(feats["cyclic_period"] != 0):
+            period = torch.where(
+                feats["cyclic_period"] > 0,
+                feats["cyclic_period"],
+                torch.zeros_like(feats["cyclic_period"]) + 10000,
+            ).unsqueeze(1)
+            rel_pos = (rel_pos - period * torch.round(rel_pos / period)).long()
+
+        d_residue = torch.clip(
+            rel_pos + self.r_max,
+            0,
+            2 * self.r_max,
+        )
+
+        d_residue = torch.where(
+            b_same_chain, d_residue, torch.zeros_like(d_residue) + 2 * self.r_max + 1
+        )
+        a_rel_pos = one_hot(d_residue, 2 * self.r_max + 2)
+
+        d_token = torch.clip(
+            feats["token_index"][:, :, None]
+            - feats["token_index"][:, None, :]
+            + self.r_max,
+            0,
+            2 * self.r_max,
+        )
+        d_token = torch.where(
+            b_same_chain & b_same_residue,
+            d_token,
+            torch.zeros_like(d_token) + 2 * self.r_max + 1,
+        )
+        a_rel_token = one_hot(d_token, 2 * self.r_max + 2)
+
+        d_chain = torch.clip(
+            feats["sym_id"][:, :, None] - feats["sym_id"][:, None, :] + self.s_max,
+            0,
+            2 * self.s_max,
+        )
+        d_chain = torch.where(
+            b_same_chain, torch.zeros_like(d_chain) + 2 * self.s_max + 1, d_chain
+        )
+        a_rel_chain = one_hot(d_chain, 2 * self.s_max + 2)
+
+        p = self.linear_layer(
+            torch.cat(
+                [
+                    a_rel_pos.float(),
+                    a_rel_token.float(),
+                    b_same_entity.unsqueeze(-1).float(),
+                    a_rel_chain.float(),
+                ],
+                dim=-1,
+            )
+        )
+        return p
+
+
+class SingleConditioning(Module):
+    """Single conditioning layer."""
+
+    def __init__(
+        self,
+        sigma_data: float,
+        token_s=384,
+        dim_fourier=256,
+        num_transitions=2,
+        transition_expansion_factor=2,
+        eps=1e-20,
+    ):
+        """Initialize the single conditioning layer.
+
+        Parameters
+        ----------
+        sigma_data : float
+            The data sigma.
+        token_s : int, optional
+            The single representation dimension, by default 384.
+        dim_fourier : int, optional
+            The fourier embeddings dimension, by default 256.
+        num_transitions : int, optional
+            The number of transitions layers, by default 2.
+        transition_expansion_factor : int, optional
+            The transition expansion factor, by default 2.
+        eps : float, optional
+            The epsilon value, by default 1e-20.
+
+        """
+        super().__init__()
+        self.eps = eps
+        self.sigma_data = sigma_data
+
+        input_dim = (
+            2 * token_s + 2 * const.num_tokens + 1 + len(const.pocket_contact_info)
+        )
+        self.norm_single = nn.LayerNorm(input_dim)
+        self.single_embed = nn.Linear(input_dim, 2 * token_s)
+        self.fourier_embed = FourierEmbedding(dim_fourier)
+        self.norm_fourier = nn.LayerNorm(dim_fourier)
+        self.fourier_to_single = LinearNoBias(dim_fourier, 2 * token_s)
+
+        transitions = ModuleList([])
+        for _ in range(num_transitions):
+            transition = Transition(
+                dim=2 * token_s, hidden=transition_expansion_factor * 2 * token_s
+            )
+            transitions.append(transition)
+
+        self.transitions = transitions
+
+    def forward(
+        self,
+        *,
+        times,
+        s_trunk,
+        s_inputs,
+    ):
+        s = torch.cat((s_trunk, s_inputs), dim=-1)
+        s = self.single_embed(self.norm_single(s))
+        fourier_embed = self.fourier_embed(times)
+        normed_fourier = self.norm_fourier(fourier_embed)
+        fourier_to_single = self.fourier_to_single(normed_fourier)
+
+        s = rearrange(fourier_to_single, "b d -> b 1 d") + s
+
+        for transition in self.transitions:
+            s = transition(s) + s
+
+        return s, normed_fourier
+
+
+class PairwiseConditioning(Module):
+    """Pairwise conditioning layer."""
+
+    def __init__(
+        self,
+        token_z,
+        dim_token_rel_pos_feats,
+        num_transitions=2,
+        transition_expansion_factor=2,
+    ):
+        """Initialize the pairwise conditioning layer.
+
+        Parameters
+        ----------
+        token_z : int
+            The pair representation dimension.
+        dim_token_rel_pos_feats : int
+            The token relative position features dimension.
+        num_transitions : int, optional
+            The number of transitions layers, by default 2.
+        transition_expansion_factor : int, optional
+            The transition expansion factor, by default 2.
+
+        """
+        super().__init__()
+
+        self.dim_pairwise_init_proj = nn.Sequential(
+            nn.LayerNorm(token_z + dim_token_rel_pos_feats),
+            LinearNoBias(token_z + dim_token_rel_pos_feats, token_z),
+        )
+
+        transitions = ModuleList([])
+        for _ in range(num_transitions):
+            transition = Transition(
+                dim=token_z, hidden=transition_expansion_factor * token_z
+            )
+            transitions.append(transition)
+
+        self.transitions = transitions
+
+    def forward(
+        self,
+        z_trunk,
+        token_rel_pos_feats,
+    ):
+        z = torch.cat((z_trunk, token_rel_pos_feats), dim=-1)
+        z = self.dim_pairwise_init_proj(z)
+
+        for transition in self.transitions:
+            z = transition(z) + z
+
+        return z
+
+
+def get_indexing_matrix(K, W, H, device):
+    assert W % 2 == 0
+    assert H % (W // 2) == 0
+
+    h = H // (W // 2)
+    assert h % 2 == 0
+
+    arange = torch.arange(2 * K, device=device)
+    index = ((arange.unsqueeze(0) - arange.unsqueeze(1)) + h // 2).clamp(
+        min=0, max=h + 1
+    )
+    index = index.view(K, 2, 2 * K)[:, 0, :]
+    onehot = one_hot(index, num_classes=h + 2)[..., 1:-1].transpose(1, 0)
+    return onehot.reshape(2 * K, h * K).float()
+
+
+def single_to_keys(single, indexing_matrix, W, H):
+    B, N, D = single.shape
+    K = N // W
+    single = single.view(B, 2 * K, W // 2, D)
+    return torch.einsum("b j i d, j k -> b k i d", single, indexing_matrix).reshape(
+        B, K, H, D
+    )
+
+
+class AtomAttentionEncoder(Module):
+    """Atom attention encoder."""
+
+    def __init__(
+        self,
+        atom_s,
+        atom_z,
+        token_s,
+        token_z,
+        atoms_per_window_queries,
+        atoms_per_window_keys,
+        atom_feature_dim,
+        atom_encoder_depth=3,
+        atom_encoder_heads=4,
+        structure_prediction=True,
+        activation_checkpointing=False,
+    ):
+        """Initialize the atom attention encoder.
+
+        Parameters
+        ----------
+        atom_s : int
+            The atom single representation dimension.
+        atom_z : int
+            The atom pair representation dimension.
+        token_s : int
+            The single representation dimension.
+        token_z : int
+            The pair representation dimension.
+        atoms_per_window_queries : int
+            The number of atoms per window for queries.
+        atoms_per_window_keys : int
+            The number of atoms per window for keys.
+        atom_feature_dim : int
+            The atom feature dimension.
+        atom_encoder_depth : int, optional
+            The number of transformer layers, by default 3.
+        atom_encoder_heads : int, optional
+            The number of transformer heads, by default 4.
+        structure_prediction : bool, optional
+            Whether it is used in the diffusion module, by default True.
+        activation_checkpointing : bool, optional
+            Whether to use activation checkpointing, by default False.
+
+        """
+        super().__init__()
+
+        self.embed_atom_features = LinearNoBias(atom_feature_dim, atom_s)
+        self.embed_atompair_ref_pos = LinearNoBias(3, atom_z)
+        self.embed_atompair_ref_dist = LinearNoBias(1, atom_z)
+        self.embed_atompair_mask = LinearNoBias(1, atom_z)
+        self.atoms_per_window_queries = atoms_per_window_queries
+        self.atoms_per_window_keys = atoms_per_window_keys
+
+        self.structure_prediction = structure_prediction
+        if structure_prediction:
+            self.s_to_c_trans = nn.Sequential(
+                nn.LayerNorm(token_s), LinearNoBias(token_s, atom_s)
+            )
+            init.final_init_(self.s_to_c_trans[1].weight)
+
+            self.z_to_p_trans = nn.Sequential(
+                nn.LayerNorm(token_z), LinearNoBias(token_z, atom_z)
+            )
+            init.final_init_(self.z_to_p_trans[1].weight)
+
+            self.r_to_q_trans = LinearNoBias(10, atom_s)
+            init.final_init_(self.r_to_q_trans.weight)
+
+        self.c_to_p_trans_k = nn.Sequential(
+            nn.ReLU(),
+            LinearNoBias(atom_s, atom_z),
+        )
+        init.final_init_(self.c_to_p_trans_k[1].weight)
+
+        self.c_to_p_trans_q = nn.Sequential(
+            nn.ReLU(),
+            LinearNoBias(atom_s, atom_z),
+        )
+        init.final_init_(self.c_to_p_trans_q[1].weight)
+
+        self.p_mlp = nn.Sequential(
+            nn.ReLU(),
+            LinearNoBias(atom_z, atom_z),
+            nn.ReLU(),
+            LinearNoBias(atom_z, atom_z),
+            nn.ReLU(),
+            LinearNoBias(atom_z, atom_z),
+        )
+        init.final_init_(self.p_mlp[5].weight)
+
+        self.atom_encoder = AtomTransformer(
+            dim=atom_s,
+            dim_single_cond=atom_s,
+            dim_pairwise=atom_z,
+            attn_window_queries=atoms_per_window_queries,
+            attn_window_keys=atoms_per_window_keys,
+            depth=atom_encoder_depth,
+            heads=atom_encoder_heads,
+            activation_checkpointing=activation_checkpointing,
+        )
+
+        self.atom_to_token_trans = nn.Sequential(
+            LinearNoBias(atom_s, 2 * token_s if structure_prediction else token_s),
+            nn.ReLU(),
+        )
+
+    def forward(
+        self,
+        feats,
+        s_trunk=None,
+        z=None,
+        r=None,
+        multiplicity=1,
+        model_cache=None,
+    ):
+        B, N, _ = feats["ref_pos"].shape
+        atom_mask = feats["atom_pad_mask"].bool()
+
+        layer_cache = None
+        if model_cache is not None:
+            cache_prefix = "atomencoder"
+            if cache_prefix not in model_cache:
+                model_cache[cache_prefix] = {}
+            layer_cache = model_cache[cache_prefix]
+
+        if model_cache is None or len(layer_cache) == 0:
+            # either model is not using the cache or it is the first time running it
+
+            atom_ref_pos = feats["ref_pos"]
+            atom_uid = feats["ref_space_uid"]
+            atom_feats = torch.cat(
+                [
+                    atom_ref_pos,
+                    feats["ref_charge"].unsqueeze(-1),
+                    feats["atom_pad_mask"].unsqueeze(-1),
+                    feats["ref_element"],
+                    feats["ref_atom_name_chars"].reshape(B, N, 4 * 64),
+                ],
+                dim=-1,
+            )
+
+            c = self.embed_atom_features(atom_feats)
+
+            # NOTE: we are already creating the windows to make it more efficient
+            W, H = self.atoms_per_window_queries, self.atoms_per_window_keys
+            B, N = c.shape[:2]
+            K = N // W
+            keys_indexing_matrix = get_indexing_matrix(K, W, H, c.device)
+            to_keys = partial(
+                single_to_keys, indexing_matrix=keys_indexing_matrix, W=W, H=H
+            )
+
+            atom_ref_pos_queries = atom_ref_pos.view(B, K, W, 1, 3)
+            atom_ref_pos_keys = to_keys(atom_ref_pos).view(B, K, 1, H, 3)
+
+            d = atom_ref_pos_keys - atom_ref_pos_queries
+            d_norm = torch.sum(d * d, dim=-1, keepdim=True)
+            d_norm = 1 / (1 + d_norm)
+
+            atom_mask_queries = atom_mask.view(B, K, W, 1)
+            atom_mask_keys = (
+                to_keys(atom_mask.unsqueeze(-1).float()).view(B, K, 1, H).bool()
+            )
+            atom_uid_queries = atom_uid.view(B, K, W, 1)
+            atom_uid_keys = (
+                to_keys(atom_uid.unsqueeze(-1).float()).view(B, K, 1, H).long()
+            )
+            v = (
+                (
+                    atom_mask_queries
+                    & atom_mask_keys
+                    & (atom_uid_queries == atom_uid_keys)
+                )
+                .float()
+                .unsqueeze(-1)
+            )
+
+            p = self.embed_atompair_ref_pos(d) * v
+            p = p + self.embed_atompair_ref_dist(d_norm) * v
+            p = p + self.embed_atompair_mask(v) * v
+
+            q = c
+
+            if self.structure_prediction:
+                # run only in structure model not in initial encoding
+                atom_to_token = feats["atom_to_token"].float()
+
+                s_to_c = self.s_to_c_trans(s_trunk)
+                s_to_c = torch.bmm(atom_to_token, s_to_c)
+                c = c + s_to_c
+
+                atom_to_token_queries = atom_to_token.view(
+                    B, K, W, atom_to_token.shape[-1]
+                )
+                atom_to_token_keys = to_keys(atom_to_token)
+                z_to_p = self.z_to_p_trans(z)
+                z_to_p = torch.einsum(
+                    "bijd,bwki,bwlj->bwkld",
+                    z_to_p,
+                    atom_to_token_queries,
+                    atom_to_token_keys,
+                )
+                p = p + z_to_p
+
+            p = p + self.c_to_p_trans_q(c.view(B, K, W, 1, c.shape[-1]))
+            p = p + self.c_to_p_trans_k(to_keys(c).view(B, K, 1, H, c.shape[-1]))
+            p = p + self.p_mlp(p)
+
+            if model_cache is not None:
+                layer_cache["q"] = q
+                layer_cache["c"] = c
+                layer_cache["p"] = p
+                layer_cache["to_keys"] = to_keys
+
+        else:
+            q = layer_cache["q"]
+            c = layer_cache["c"]
+            p = layer_cache["p"]
+            to_keys = layer_cache["to_keys"]
+
+        if self.structure_prediction:
+            # only here the multiplicity kicks in because we use the different positions r
+            q = q.repeat_interleave(multiplicity, 0)
+            r_input = torch.cat(
+                [r, torch.zeros((B * multiplicity, N, 7)).to(r)],
+                dim=-1,
+            )
+            r_to_q = self.r_to_q_trans(r_input)
+            q = q + r_to_q
+
+        c = c.repeat_interleave(multiplicity, 0)
+        atom_mask = atom_mask.repeat_interleave(multiplicity, 0)
+
+        q = self.atom_encoder(
+            q=q,
+            mask=atom_mask,
+            c=c,
+            p=p,
+            multiplicity=multiplicity,
+            to_keys=to_keys,
+            model_cache=layer_cache,
+        )
+
+        q_to_a = self.atom_to_token_trans(q)
+        atom_to_token = feats["atom_to_token"].float()
+        atom_to_token = atom_to_token.repeat_interleave(multiplicity, 0)
+        atom_to_token_mean = atom_to_token / (
+            atom_to_token.sum(dim=1, keepdim=True) + 1e-6
+        )
+        a = torch.bmm(atom_to_token_mean.transpose(1, 2), q_to_a)
+
+        return a, q, c, p, to_keys
+
+
+class AtomAttentionDecoder(Module):
+    """Atom attention decoder."""
+
+    def __init__(
+        self,
+        atom_s,
+        atom_z,
+        token_s,
+        attn_window_queries,
+        attn_window_keys,
+        atom_decoder_depth=3,
+        atom_decoder_heads=4,
+        activation_checkpointing=False,
+    ):
+        """Initialize the atom attention decoder.
+
+        Parameters
+        ----------
+        atom_s : int
+            The atom single representation dimension.
+        atom_z : int
+            The atom pair representation dimension.
+        token_s : int
+            The single representation dimension.
+        attn_window_queries : int
+            The number of atoms per window for queries.
+        attn_window_keys : int
+            The number of atoms per window for keys.
+        atom_decoder_depth : int, optional
+            The number of transformer layers, by default 3.
+        atom_decoder_heads : int, optional
+            The number of transformer heads, by default 4.
+        activation_checkpointing : bool, optional
+            Whether to use activation checkpointing, by default False.
+
+        """
+        super().__init__()
+
+        self.a_to_q_trans = LinearNoBias(2 * token_s, atom_s)
+        init.final_init_(self.a_to_q_trans.weight)
+
+        self.atom_decoder = AtomTransformer(
+            dim=atom_s,
+            dim_single_cond=atom_s,
+            dim_pairwise=atom_z,
+            attn_window_queries=attn_window_queries,
+            attn_window_keys=attn_window_keys,
+            depth=atom_decoder_depth,
+            heads=atom_decoder_heads,
+            activation_checkpointing=activation_checkpointing,
+        )
+
+        self.atom_feat_to_atom_pos_update = nn.Sequential(
+            nn.LayerNorm(atom_s), LinearNoBias(atom_s, 3)
+        )
+        init.final_init_(self.atom_feat_to_atom_pos_update[1].weight)
+
+    def forward(
+        self,
+        a,
+        q,
+        c,
+        p,
+        feats,
+        to_keys,
+        multiplicity=1,
+        model_cache=None,
+    ):
+        atom_mask = feats["atom_pad_mask"]
+        atom_mask = atom_mask.repeat_interleave(multiplicity, 0)
+
+        atom_to_token = feats["atom_to_token"].float()
+        atom_to_token = atom_to_token.repeat_interleave(multiplicity, 0)
+
+        a_to_q = self.a_to_q_trans(a)
+        a_to_q = torch.bmm(atom_to_token, a_to_q)
+        q = q + a_to_q
+
+        layer_cache = None
+        if model_cache is not None:
+            cache_prefix = "atomdecoder"
+            if cache_prefix not in model_cache:
+                model_cache[cache_prefix] = {}
+            layer_cache = model_cache[cache_prefix]
+
+        q = self.atom_decoder(
+            q=q,
+            mask=atom_mask,
+            c=c,
+            p=p,
+            multiplicity=multiplicity,
+            to_keys=to_keys,
+            model_cache=layer_cache,
+        )
+
+        r_update = self.atom_feat_to_atom_pos_update(q)
+        return r_update
diff --git a/forks/boltz/src/boltz/model/modules/encodersv2.py b/forks/boltz/src/boltz/model/modules/encodersv2.py
new file mode 100644
index 00000000..f02cc3ec
--- /dev/null
+++ b/forks/boltz/src/boltz/model/modules/encodersv2.py
@@ -0,0 +1,565 @@
+# started from code from https://github.com/lucidrains/alphafold3-pytorch, MIT License, Copyright (c) 2024 Phil Wang
+from functools import partial
+from math import pi
+
+import torch
+from einops import rearrange
+from torch import nn
+from torch.nn import Linear, Module, ModuleList
+from torch.nn.functional import one_hot
+
+import boltz.model.layers.initialize as init
+from boltz.model.layers.transition import Transition
+from boltz.model.modules.transformersv2 import AtomTransformer
+from boltz.model.modules.utils import LinearNoBias
+
+
+class FourierEmbedding(Module):
+    """Algorithm 22."""
+
+    def __init__(self, dim):
+        super().__init__()
+        self.proj = nn.Linear(1, dim)
+        torch.nn.init.normal_(self.proj.weight, mean=0, std=1)
+        torch.nn.init.normal_(self.proj.bias, mean=0, std=1)
+        self.proj.requires_grad_(False)
+
+    def forward(
+        self,
+        times,  # Float[' b'],
+    ):  # -> Float['b d']:
+        times = rearrange(times, "b -> b 1")
+        rand_proj = self.proj(times)
+        return torch.cos(2 * pi * rand_proj)
+
+
+class RelativePositionEncoder(Module):
+    """Algorithm 3."""
+
+    def __init__(
+        self, token_z, r_max=32, s_max=2, fix_sym_check=False, cyclic_pos_enc=False
+    ):
+        super().__init__()
+        self.r_max = r_max
+        self.s_max = s_max
+        self.linear_layer = LinearNoBias(4 * (r_max + 1) + 2 * (s_max + 1) + 1, token_z)
+        self.fix_sym_check = fix_sym_check
+        self.cyclic_pos_enc = cyclic_pos_enc
+
+    def forward(self, feats):
+        b_same_chain = torch.eq(
+            feats["asym_id"][:, :, None], feats["asym_id"][:, None, :]
+        )
+        b_same_residue = torch.eq(
+            feats["residue_index"][:, :, None], feats["residue_index"][:, None, :]
+        )
+        b_same_entity = torch.eq(
+            feats["entity_id"][:, :, None], feats["entity_id"][:, None, :]
+        )
+
+        d_residue = (
+            feats["residue_index"][:, :, None] - feats["residue_index"][:, None, :]
+        )
+
+        if self.cyclic_pos_enc and torch.any(feats["cyclic_period"] > 0):
+            period = torch.where(
+                feats["cyclic_period"] > 0,
+                feats["cyclic_period"],
+                torch.zeros_like(feats["cyclic_period"]) + 10000,
+            )
+            d_residue = (d_residue - period * torch.round(d_residue / period)).long()
+
+        d_residue = torch.clip(
+            d_residue + self.r_max,
+            0,
+            2 * self.r_max,
+        )
+        d_residue = torch.where(
+            b_same_chain, d_residue, torch.zeros_like(d_residue) + 2 * self.r_max + 1
+        )
+        a_rel_pos = one_hot(d_residue, 2 * self.r_max + 2)
+
+        d_token = torch.clip(
+            feats["token_index"][:, :, None]
+            - feats["token_index"][:, None, :]
+            + self.r_max,
+            0,
+            2 * self.r_max,
+        )
+        d_token = torch.where(
+            b_same_chain & b_same_residue,
+            d_token,
+            torch.zeros_like(d_token) + 2 * self.r_max + 1,
+        )
+        a_rel_token = one_hot(d_token, 2 * self.r_max + 2)
+
+        d_chain = torch.clip(
+            feats["sym_id"][:, :, None] - feats["sym_id"][:, None, :] + self.s_max,
+            0,
+            2 * self.s_max,
+        )
+        d_chain = torch.where(
+            (~b_same_entity) if self.fix_sym_check else b_same_chain,
+            torch.zeros_like(d_chain) + 2 * self.s_max + 1,
+            d_chain,
+        )
+        # Note: added  | (~b_same_entity) based on observation of ProteinX manuscript
+        a_rel_chain = one_hot(d_chain, 2 * self.s_max + 2)
+
+        p = self.linear_layer(
+            torch.cat(
+                [
+                    a_rel_pos.float(),
+                    a_rel_token.float(),
+                    b_same_entity.unsqueeze(-1).float(),
+                    a_rel_chain.float(),
+                ],
+                dim=-1,
+            )
+        )
+        return p
+
+
+class SingleConditioning(Module):
+    """Algorithm 21."""
+
+    def __init__(
+        self,
+        sigma_data: float,
+        token_s: int = 384,
+        dim_fourier: int = 256,
+        num_transitions: int = 2,
+        transition_expansion_factor: int = 2,
+        eps: float = 1e-20,
+        disable_times: bool = False,
+    ) -> None:
+        super().__init__()
+        self.eps = eps
+        self.sigma_data = sigma_data
+        self.disable_times = disable_times
+
+        self.norm_single = nn.LayerNorm(2 * token_s)
+        self.single_embed = nn.Linear(2 * token_s, 2 * token_s)
+        if not self.disable_times:
+            self.fourier_embed = FourierEmbedding(dim_fourier)
+            self.norm_fourier = nn.LayerNorm(dim_fourier)
+            self.fourier_to_single = LinearNoBias(dim_fourier, 2 * token_s)
+
+        transitions = ModuleList([])
+        for _ in range(num_transitions):
+            transition = Transition(
+                dim=2 * token_s, hidden=transition_expansion_factor * 2 * token_s
+            )
+            transitions.append(transition)
+
+        self.transitions = transitions
+
+    def forward(
+        self,
+        times,  # Float[' b'],
+        s_trunk,  # Float['b n ts'],
+        s_inputs,  # Float['b n ts'],
+    ):  # -> Float['b n 2ts']:
+        s = torch.cat((s_trunk, s_inputs), dim=-1)
+        s = self.single_embed(self.norm_single(s))
+        if not self.disable_times:
+            fourier_embed = self.fourier_embed(
+                times
+            )  # note: sigma rescaling done in diffusion module
+            normed_fourier = self.norm_fourier(fourier_embed)
+            fourier_to_single = self.fourier_to_single(normed_fourier)
+
+            s = rearrange(fourier_to_single, "b d -> b 1 d") + s
+
+        for transition in self.transitions:
+            s = transition(s) + s
+
+        return s, normed_fourier if not self.disable_times else None
+
+
+class PairwiseConditioning(Module):
+    """Algorithm 21."""
+
+    def __init__(
+        self,
+        token_z,
+        dim_token_rel_pos_feats,
+        num_transitions=2,
+        transition_expansion_factor=2,
+    ):
+        super().__init__()
+
+        self.dim_pairwise_init_proj = nn.Sequential(
+            nn.LayerNorm(token_z + dim_token_rel_pos_feats),
+            LinearNoBias(token_z + dim_token_rel_pos_feats, token_z),
+        )
+
+        transitions = ModuleList([])
+        for _ in range(num_transitions):
+            transition = Transition(
+                dim=token_z, hidden=transition_expansion_factor * token_z
+            )
+            transitions.append(transition)
+
+        self.transitions = transitions
+
+    def forward(
+        self,
+        z_trunk,  # Float['b n n tz'],
+        token_rel_pos_feats,  # Float['b n n 3'],
+    ):  # -> Float['b n n tz']:
+        z = torch.cat((z_trunk, token_rel_pos_feats), dim=-1)
+        z = self.dim_pairwise_init_proj(z)
+
+        for transition in self.transitions:
+            z = transition(z) + z
+
+        return z
+
+
+def get_indexing_matrix(K, W, H, device):
+    assert W % 2 == 0
+    assert H % (W // 2) == 0
+
+    h = H // (W // 2)
+    assert h % 2 == 0
+
+    arange = torch.arange(2 * K, device=device)
+    index = ((arange.unsqueeze(0) - arange.unsqueeze(1)) + h // 2).clamp(
+        min=0, max=h + 1
+    )
+    index = index.view(K, 2, 2 * K)[:, 0, :]
+    onehot = one_hot(index, num_classes=h + 2)[..., 1:-1].transpose(1, 0)
+    return onehot.reshape(2 * K, h * K).float()
+
+
+def single_to_keys(single, indexing_matrix, W, H):
+    B, N, D = single.shape
+    K = N // W
+    single = single.view(B, 2 * K, W // 2, D)
+    return torch.einsum("b j i d, j k -> b k i d", single, indexing_matrix).reshape(
+        B, K, H, D
+    )  # j = 2K, i = W//2, k = h * K
+
+
+class AtomEncoder(Module):
+    def __init__(
+        self,
+        atom_s,
+        atom_z,
+        token_s,
+        token_z,
+        atoms_per_window_queries,
+        atoms_per_window_keys,
+        atom_feature_dim,
+        structure_prediction=True,
+        use_no_atom_char=False,
+        use_atom_backbone_feat=False,
+        use_residue_feats_atoms=False,
+    ):
+        super().__init__()
+
+        self.embed_atom_features = Linear(atom_feature_dim, atom_s)
+        self.embed_atompair_ref_pos = LinearNoBias(3, atom_z)
+        self.embed_atompair_ref_dist = LinearNoBias(1, atom_z)
+        self.embed_atompair_mask = LinearNoBias(1, atom_z)
+        self.atoms_per_window_queries = atoms_per_window_queries
+        self.atoms_per_window_keys = atoms_per_window_keys
+        self.use_no_atom_char = use_no_atom_char
+        self.use_atom_backbone_feat = use_atom_backbone_feat
+        self.use_residue_feats_atoms = use_residue_feats_atoms
+
+        self.structure_prediction = structure_prediction
+        if structure_prediction:
+            self.s_to_c_trans = nn.Sequential(
+                nn.LayerNorm(token_s), LinearNoBias(token_s, atom_s)
+            )
+            init.final_init_(self.s_to_c_trans[1].weight)
+
+            self.z_to_p_trans = nn.Sequential(
+                nn.LayerNorm(token_z), LinearNoBias(token_z, atom_z)
+            )
+            init.final_init_(self.z_to_p_trans[1].weight)
+
+        self.c_to_p_trans_k = nn.Sequential(
+            nn.ReLU(),
+            LinearNoBias(atom_s, atom_z),
+        )
+        init.final_init_(self.c_to_p_trans_k[1].weight)
+
+        self.c_to_p_trans_q = nn.Sequential(
+            nn.ReLU(),
+            LinearNoBias(atom_s, atom_z),
+        )
+        init.final_init_(self.c_to_p_trans_q[1].weight)
+
+        self.p_mlp = nn.Sequential(
+            nn.ReLU(),
+            LinearNoBias(atom_z, atom_z),
+            nn.ReLU(),
+            LinearNoBias(atom_z, atom_z),
+            nn.ReLU(),
+            LinearNoBias(atom_z, atom_z),
+        )
+        init.final_init_(self.p_mlp[5].weight)
+
+    def forward(
+        self,
+        feats,
+        s_trunk=None,  # Float['bm n ts'],
+        z=None,  # Float['bm n n tz'],
+    ):
+        with torch.autocast("cuda", enabled=False):
+            B, N, _ = feats["ref_pos"].shape
+            atom_mask = feats["atom_pad_mask"].bool()  # Bool['b m'],
+
+            atom_ref_pos = feats["ref_pos"]  # Float['b m 3'],
+            atom_uid = feats["ref_space_uid"]  # Long['b m'],
+
+            atom_feats = [
+                atom_ref_pos,
+                feats["ref_charge"].unsqueeze(-1),
+                feats["ref_element"],
+            ]
+            if not self.use_no_atom_char:
+                atom_feats.append(feats["ref_atom_name_chars"].reshape(B, N, 4 * 64))
+            if self.use_atom_backbone_feat:
+                atom_feats.append(feats["atom_backbone_feat"])
+            if self.use_residue_feats_atoms:
+                res_feats = torch.cat(
+                    [
+                        feats["res_type"],
+                        feats["modified"].unsqueeze(-1),
+                        one_hot(feats["mol_type"], num_classes=4).float(),
+                    ],
+                    dim=-1,
+                )
+                atom_to_token = feats["atom_to_token"].float()
+                atom_res_feats = torch.bmm(atom_to_token, res_feats)
+                atom_feats.append(atom_res_feats)
+
+            atom_feats = torch.cat(atom_feats, dim=-1)
+
+            c = self.embed_atom_features(atom_feats)
+
+            # note we are already creating the windows to make it more efficient
+            W, H = self.atoms_per_window_queries, self.atoms_per_window_keys
+            B, N = c.shape[:2]
+            K = N // W
+            keys_indexing_matrix = get_indexing_matrix(K, W, H, c.device)
+            to_keys = partial(
+                single_to_keys, indexing_matrix=keys_indexing_matrix, W=W, H=H
+            )
+
+            atom_ref_pos_queries = atom_ref_pos.view(B, K, W, 1, 3)
+            atom_ref_pos_keys = to_keys(atom_ref_pos).view(B, K, 1, H, 3)
+
+            d = atom_ref_pos_keys - atom_ref_pos_queries  # Float['b k w h 3']
+            d_norm = torch.sum(d * d, dim=-1, keepdim=True)  # Float['b k w h 1']
+            d_norm = 1 / (
+                1 + d_norm
+            )  # AF3 feeds in the reciprocal of the distance norm
+
+            atom_mask_queries = atom_mask.view(B, K, W, 1)
+            atom_mask_keys = (
+                to_keys(atom_mask.unsqueeze(-1).float()).view(B, K, 1, H).bool()
+            )
+            atom_uid_queries = atom_uid.view(B, K, W, 1)
+            atom_uid_keys = (
+                to_keys(atom_uid.unsqueeze(-1).float()).view(B, K, 1, H).long()
+            )
+            v = (
+                (
+                    atom_mask_queries
+                    & atom_mask_keys
+                    & (atom_uid_queries == atom_uid_keys)
+                )
+                .float()
+                .unsqueeze(-1)
+            )  # Bool['b k w h 1']
+
+            p = self.embed_atompair_ref_pos(d) * v
+            p = p + self.embed_atompair_ref_dist(d_norm) * v
+            p = p + self.embed_atompair_mask(v) * v
+
+            q = c
+
+            if self.structure_prediction:
+                # run only in structure model not in initial encoding
+                atom_to_token = feats["atom_to_token"].float()  # Long['b m n'],
+
+                s_to_c = self.s_to_c_trans(s_trunk.float())
+                s_to_c = torch.bmm(atom_to_token, s_to_c)
+                c = c + s_to_c.to(c)
+
+                atom_to_token_queries = atom_to_token.view(
+                    B, K, W, atom_to_token.shape[-1]
+                )
+                atom_to_token_keys = to_keys(atom_to_token)
+                z_to_p = self.z_to_p_trans(z.float())
+                z_to_p = torch.einsum(
+                    "bijd,bwki,bwlj->bwkld",
+                    z_to_p,
+                    atom_to_token_queries,
+                    atom_to_token_keys,
+                )
+                p = p + z_to_p.to(p)
+
+            p = p + self.c_to_p_trans_q(c.view(B, K, W, 1, c.shape[-1]))
+            p = p + self.c_to_p_trans_k(to_keys(c).view(B, K, 1, H, c.shape[-1]))
+            p = p + self.p_mlp(p)
+        return q, c, p, to_keys
+
+
+class AtomAttentionEncoder(Module):
+    def __init__(
+        self,
+        atom_s,
+        token_s,
+        atoms_per_window_queries,
+        atoms_per_window_keys,
+        atom_encoder_depth=3,
+        atom_encoder_heads=4,
+        structure_prediction=True,
+        activation_checkpointing=False,
+        transformer_post_layer_norm=False,
+    ):
+        super().__init__()
+
+        self.structure_prediction = structure_prediction
+        if structure_prediction:
+            self.r_to_q_trans = LinearNoBias(3, atom_s)
+            init.final_init_(self.r_to_q_trans.weight)
+
+        self.atom_encoder = AtomTransformer(
+            dim=atom_s,
+            dim_single_cond=atom_s,
+            attn_window_queries=atoms_per_window_queries,
+            attn_window_keys=atoms_per_window_keys,
+            depth=atom_encoder_depth,
+            heads=atom_encoder_heads,
+            activation_checkpointing=activation_checkpointing,
+            post_layer_norm=transformer_post_layer_norm,
+        )
+
+        self.atom_to_token_trans = nn.Sequential(
+            LinearNoBias(atom_s, 2 * token_s if structure_prediction else token_s),
+            nn.ReLU(),
+        )
+
+    def forward(
+        self,
+        feats,
+        q,
+        c,
+        atom_enc_bias,
+        to_keys,
+        r=None,  # Float['bm m 3'],
+        multiplicity=1,
+    ):
+        B, N, _ = feats["ref_pos"].shape
+        atom_mask = feats["atom_pad_mask"].bool()  # Bool['b m'],
+
+        if self.structure_prediction:
+            # only here the multiplicity kicks in because we use the different positions r
+            q = q.repeat_interleave(multiplicity, 0)
+            r_to_q = self.r_to_q_trans(r)
+            q = q + r_to_q
+
+        c = c.repeat_interleave(multiplicity, 0)
+        atom_mask = atom_mask.repeat_interleave(multiplicity, 0)
+
+        q = self.atom_encoder(
+            q=q,
+            mask=atom_mask,
+            c=c,
+            bias=atom_enc_bias,
+            multiplicity=multiplicity,
+            to_keys=to_keys,
+        )
+
+        with torch.autocast("cuda", enabled=False):
+            q_to_a = self.atom_to_token_trans(q).float()
+            atom_to_token = feats["atom_to_token"].float()
+            atom_to_token = atom_to_token.repeat_interleave(multiplicity, 0)
+            atom_to_token_mean = atom_to_token / (
+                atom_to_token.sum(dim=1, keepdim=True) + 1e-6
+            )
+            a = torch.bmm(atom_to_token_mean.transpose(1, 2), q_to_a)
+
+        a = a.to(q)
+
+        return a, q, c, to_keys
+
+
+class AtomAttentionDecoder(Module):
+    """Algorithm 6."""
+
+    def __init__(
+        self,
+        atom_s,
+        token_s,
+        attn_window_queries,
+        attn_window_keys,
+        atom_decoder_depth=3,
+        atom_decoder_heads=4,
+        activation_checkpointing=False,
+        transformer_post_layer_norm=False,
+    ):
+        super().__init__()
+
+        self.a_to_q_trans = LinearNoBias(2 * token_s, atom_s)
+        init.final_init_(self.a_to_q_trans.weight)
+
+        self.atom_decoder = AtomTransformer(
+            dim=atom_s,
+            dim_single_cond=atom_s,
+            attn_window_queries=attn_window_queries,
+            attn_window_keys=attn_window_keys,
+            depth=atom_decoder_depth,
+            heads=atom_decoder_heads,
+            activation_checkpointing=activation_checkpointing,
+            post_layer_norm=transformer_post_layer_norm,
+        )
+
+        if transformer_post_layer_norm:
+            self.atom_feat_to_atom_pos_update = LinearNoBias(atom_s, 3)
+            init.final_init_(self.atom_feat_to_atom_pos_update.weight)
+        else:
+            self.atom_feat_to_atom_pos_update = nn.Sequential(
+                nn.LayerNorm(atom_s), LinearNoBias(atom_s, 3)
+            )
+            init.final_init_(self.atom_feat_to_atom_pos_update[1].weight)
+
+    def forward(
+        self,
+        a,  # Float['bm n 2ts'],
+        q,  # Float['bm m as'],
+        c,  # Float['bm m as'],
+        atom_dec_bias,  # Float['bm m m az'],
+        feats,
+        to_keys,
+        multiplicity=1,
+    ):
+        with torch.autocast("cuda", enabled=False):
+            atom_to_token = feats["atom_to_token"].float()
+            atom_to_token = atom_to_token.repeat_interleave(multiplicity, 0)
+
+            a_to_q = self.a_to_q_trans(a.float())
+            a_to_q = torch.bmm(atom_to_token, a_to_q)
+
+        q = q + a_to_q.to(q)
+        atom_mask = feats["atom_pad_mask"]  # Bool['b m'],
+        atom_mask = atom_mask.repeat_interleave(multiplicity, 0)
+
+        q = self.atom_decoder(
+            q=q,
+            mask=atom_mask,
+            c=c,
+            bias=atom_dec_bias,
+            multiplicity=multiplicity,
+            to_keys=to_keys,
+        )
+
+        r_update = self.atom_feat_to_atom_pos_update(q)
+        return r_update
diff --git a/forks/boltz/src/boltz/model/modules/transformers.py b/forks/boltz/src/boltz/model/modules/transformers.py
new file mode 100644
index 00000000..b1e1fbae
--- /dev/null
+++ b/forks/boltz/src/boltz/model/modules/transformers.py
@@ -0,0 +1,322 @@
+# started from code from https://github.com/lucidrains/alphafold3-pytorch, MIT License, Copyright (c) 2024 Phil Wang
+
+from fairscale.nn.checkpoint.checkpoint_activations import checkpoint_wrapper
+from torch import nn, sigmoid
+from torch.nn import (
+    LayerNorm,
+    Linear,
+    Module,
+    ModuleList,
+    Sequential,
+)
+
+from boltz.model.layers.attention import AttentionPairBias
+from boltz.model.modules.utils import LinearNoBias, SwiGLU, default
+
+
+class AdaLN(Module):
+    """Adaptive Layer Normalization"""
+
+    def __init__(self, dim, dim_single_cond):
+        """Initialize the adaptive layer normalization.
+
+        Parameters
+        ----------
+        dim : int
+            The input dimension.
+        dim_single_cond : int
+            The single condition dimension.
+
+        """
+        super().__init__()
+        self.a_norm = LayerNorm(dim, elementwise_affine=False, bias=False)
+        self.s_norm = LayerNorm(dim_single_cond, bias=False)
+        self.s_scale = Linear(dim_single_cond, dim)
+        self.s_bias = LinearNoBias(dim_single_cond, dim)
+
+    def forward(self, a, s):
+        a = self.a_norm(a)
+        s = self.s_norm(s)
+        a = sigmoid(self.s_scale(s)) * a + self.s_bias(s)
+        return a
+
+
+class ConditionedTransitionBlock(Module):
+    """Conditioned Transition Block"""
+
+    def __init__(self, dim_single, dim_single_cond, expansion_factor=2):
+        """Initialize the conditioned transition block.
+
+        Parameters
+        ----------
+        dim_single : int
+            The single dimension.
+        dim_single_cond : int
+            The single condition dimension.
+        expansion_factor : int, optional
+            The expansion factor, by default 2
+
+        """
+        super().__init__()
+
+        self.adaln = AdaLN(dim_single, dim_single_cond)
+
+        dim_inner = int(dim_single * expansion_factor)
+        self.swish_gate = Sequential(
+            LinearNoBias(dim_single, dim_inner * 2),
+            SwiGLU(),
+        )
+        self.a_to_b = LinearNoBias(dim_single, dim_inner)
+        self.b_to_a = LinearNoBias(dim_inner, dim_single)
+
+        output_projection_linear = Linear(dim_single_cond, dim_single)
+        nn.init.zeros_(output_projection_linear.weight)
+        nn.init.constant_(output_projection_linear.bias, -2.0)
+
+        self.output_projection = nn.Sequential(output_projection_linear, nn.Sigmoid())
+
+    def forward(
+        self,
+        a,
+        s,
+    ):
+        a = self.adaln(a, s)
+        b = self.swish_gate(a) * self.a_to_b(a)
+        a = self.output_projection(s) * self.b_to_a(b)
+
+        return a
+
+
+class DiffusionTransformer(Module):
+    """Diffusion Transformer"""
+
+    def __init__(
+        self,
+        depth,
+        heads,
+        dim=384,
+        dim_single_cond=None,
+        dim_pairwise=128,
+        activation_checkpointing=False,
+        offload_to_cpu=False,
+    ):
+        """Initialize the diffusion transformer.
+
+        Parameters
+        ----------
+        depth : int
+            The depth.
+        heads : int
+            The number of heads.
+        dim : int, optional
+            The dimension, by default 384
+        dim_single_cond : int, optional
+            The single condition dimension, by default None
+        dim_pairwise : int, optional
+            The pairwise dimension, by default 128
+        activation_checkpointing : bool, optional
+            Whether to use activation checkpointing, by default False
+        offload_to_cpu : bool, optional
+            Whether to offload to CPU, by default False
+
+        """
+        super().__init__()
+        self.activation_checkpointing = activation_checkpointing
+        dim_single_cond = default(dim_single_cond, dim)
+
+        self.layers = ModuleList()
+        for _ in range(depth):
+            if activation_checkpointing:
+                self.layers.append(
+                    checkpoint_wrapper(
+                        DiffusionTransformerLayer(
+                            heads,
+                            dim,
+                            dim_single_cond,
+                            dim_pairwise,
+                        ),
+                        offload_to_cpu=offload_to_cpu,
+                    )
+                )
+            else:
+                self.layers.append(
+                    DiffusionTransformerLayer(
+                        heads,
+                        dim,
+                        dim_single_cond,
+                        dim_pairwise,
+                    )
+                )
+
+    def forward(
+        self,
+        a,
+        s,
+        z,
+        mask=None,
+        to_keys=None,
+        multiplicity=1,
+        model_cache=None,
+    ):
+        for i, layer in enumerate(self.layers):
+            layer_cache = None
+            if model_cache is not None:
+                prefix_cache = "layer_" + str(i)
+                if prefix_cache not in model_cache:
+                    model_cache[prefix_cache] = {}
+                layer_cache = model_cache[prefix_cache]
+            a = layer(
+                a,
+                s,
+                z,
+                mask=mask,
+                to_keys=to_keys,
+                multiplicity=multiplicity,
+                layer_cache=layer_cache,
+            )
+        return a
+
+
+class DiffusionTransformerLayer(Module):
+    """Diffusion Transformer Layer"""
+
+    def __init__(
+        self,
+        heads,
+        dim=384,
+        dim_single_cond=None,
+        dim_pairwise=128,
+    ):
+        """Initialize the diffusion transformer layer.
+
+        Parameters
+        ----------
+        heads : int
+            The number of heads.
+        dim : int, optional
+            The dimension, by default 384
+        dim_single_cond : int, optional
+            The single condition dimension, by default None
+        dim_pairwise : int, optional
+            The pairwise dimension, by default 128
+
+        """
+        super().__init__()
+
+        dim_single_cond = default(dim_single_cond, dim)
+
+        self.adaln = AdaLN(dim, dim_single_cond)
+
+        self.pair_bias_attn = AttentionPairBias(
+            c_s=dim, c_z=dim_pairwise, num_heads=heads, initial_norm=False
+        )
+
+        self.output_projection_linear = Linear(dim_single_cond, dim)
+        nn.init.zeros_(self.output_projection_linear.weight)
+        nn.init.constant_(self.output_projection_linear.bias, -2.0)
+
+        self.output_projection = nn.Sequential(
+            self.output_projection_linear, nn.Sigmoid()
+        )
+        self.transition = ConditionedTransitionBlock(
+            dim_single=dim, dim_single_cond=dim_single_cond
+        )
+
+    def forward(
+        self,
+        a,
+        s,
+        z,
+        mask=None,
+        to_keys=None,
+        multiplicity=1,
+        layer_cache=None,
+    ):
+        b = self.adaln(a, s)
+        b = self.pair_bias_attn(
+            s=b,
+            z=z,
+            mask=mask,
+            multiplicity=multiplicity,
+            to_keys=to_keys,
+            model_cache=layer_cache,
+        )
+        b = self.output_projection(s) * b
+
+        # NOTE: Added residual connection!
+        a = a + b
+        a = a + self.transition(a, s)
+        return a
+
+
+class AtomTransformer(Module):
+    """Atom Transformer"""
+
+    def __init__(
+        self,
+        attn_window_queries=None,
+        attn_window_keys=None,
+        **diffusion_transformer_kwargs,
+    ):
+        """Initialize the atom transformer.
+
+        Parameters
+        ----------
+        attn_window_queries : int, optional
+            The attention window queries, by default None
+        attn_window_keys : int, optional
+            The attention window keys, by default None
+        diffusion_transformer_kwargs : dict
+            The diffusion transformer keyword arguments
+
+        """
+        super().__init__()
+        self.attn_window_queries = attn_window_queries
+        self.attn_window_keys = attn_window_keys
+        self.diffusion_transformer = DiffusionTransformer(
+            **diffusion_transformer_kwargs
+        )
+
+    def forward(
+        self,
+        q,
+        c,
+        p,
+        to_keys=None,
+        mask=None,
+        multiplicity=1,
+        model_cache=None,
+    ):
+        W = self.attn_window_queries
+        H = self.attn_window_keys
+
+        if W is not None:
+            B, N, D = q.shape
+            NW = N // W
+
+            # reshape tokens
+            q = q.view((B * NW, W, -1))
+            c = c.view((B * NW, W, -1))
+            if mask is not None:
+                mask = mask.view(B * NW, W)
+            p = p.view((p.shape[0] * NW, W, H, -1))
+
+            to_keys_new = lambda x: to_keys(x.view(B, NW * W, -1)).view(B * NW, H, -1)
+        else:
+            to_keys_new = None
+
+        # main transformer
+        q = self.diffusion_transformer(
+            a=q,
+            s=c,
+            z=p,
+            mask=mask.float(),
+            multiplicity=multiplicity,
+            to_keys=to_keys_new,
+            model_cache=model_cache,
+        )
+
+        if W is not None:
+            q = q.view((B, NW * W, D))
+
+        return q
diff --git a/forks/boltz/src/boltz/model/modules/transformersv2.py b/forks/boltz/src/boltz/model/modules/transformersv2.py
new file mode 100644
index 00000000..5f76ddac
--- /dev/null
+++ b/forks/boltz/src/boltz/model/modules/transformersv2.py
@@ -0,0 +1,261 @@
+# started from code from https://github.com/lucidrains/alphafold3-pytorch, MIT License, Copyright (c) 2024 Phil Wang
+
+import torch
+from torch import nn, sigmoid
+from torch.nn import (
+    LayerNorm,
+    Linear,
+    Module,
+    ModuleList,
+    Sequential,
+)
+
+from boltz.model.layers.attentionv2 import AttentionPairBias
+from boltz.model.modules.utils import LinearNoBias, SwiGLU, default
+
+
+class AdaLN(Module):
+    """Algorithm 26"""
+
+    def __init__(self, dim, dim_single_cond):
+        super().__init__()
+        self.a_norm = LayerNorm(dim, elementwise_affine=False, bias=False)
+        self.s_norm = LayerNorm(dim_single_cond, bias=False)
+        self.s_scale = Linear(dim_single_cond, dim)
+        self.s_bias = LinearNoBias(dim_single_cond, dim)
+
+    def forward(self, a, s):
+        a = self.a_norm(a)
+        s = self.s_norm(s)
+        a = sigmoid(self.s_scale(s)) * a + self.s_bias(s)
+        return a
+
+
+class ConditionedTransitionBlock(Module):
+    """Algorithm 25"""
+
+    def __init__(self, dim_single, dim_single_cond, expansion_factor=2):
+        super().__init__()
+
+        self.adaln = AdaLN(dim_single, dim_single_cond)
+
+        dim_inner = int(dim_single * expansion_factor)
+        self.swish_gate = Sequential(
+            LinearNoBias(dim_single, dim_inner * 2),
+            SwiGLU(),
+        )
+        self.a_to_b = LinearNoBias(dim_single, dim_inner)
+        self.b_to_a = LinearNoBias(dim_inner, dim_single)
+
+        output_projection_linear = Linear(dim_single_cond, dim_single)
+        nn.init.zeros_(output_projection_linear.weight)
+        nn.init.constant_(output_projection_linear.bias, -2.0)
+
+        self.output_projection = nn.Sequential(output_projection_linear, nn.Sigmoid())
+
+    def forward(
+        self,
+        a,  # Float['... d']
+        s,
+    ):  # -> Float['... d']:
+        a = self.adaln(a, s)
+        b = self.swish_gate(a) * self.a_to_b(a)
+        a = self.output_projection(s) * self.b_to_a(b)
+
+        return a
+
+
+class DiffusionTransformer(Module):
+    """Algorithm 23"""
+
+    def __init__(
+        self,
+        depth,
+        heads,
+        dim=384,
+        dim_single_cond=None,
+        pair_bias_attn=True,
+        activation_checkpointing=False,
+        post_layer_norm=False,
+    ):
+        super().__init__()
+        self.activation_checkpointing = activation_checkpointing
+        dim_single_cond = default(dim_single_cond, dim)
+        self.pair_bias_attn = pair_bias_attn
+
+        self.layers = ModuleList()
+        for _ in range(depth):
+            self.layers.append(
+                DiffusionTransformerLayer(
+                    heads,
+                    dim,
+                    dim_single_cond,
+                    post_layer_norm,
+                )
+            )
+
+    def forward(
+        self,
+        a,  # Float['bm n d'],
+        s,  # Float['bm n ds'],
+        bias=None,  # Float['b n n dp']
+        mask=None,  # Bool['b n'] | None = None
+        to_keys=None,
+        multiplicity=1,
+    ):
+        if self.pair_bias_attn:
+            B, N, M, D = bias.shape
+            L = len(self.layers)
+            bias = bias.view(B, N, M, L, D // L)
+
+        for i, layer in enumerate(self.layers):
+            if self.pair_bias_attn:
+                bias_l = bias[:, :, :, i]
+            else:
+                bias_l = None
+
+            if self.activation_checkpointing and self.training:
+                a = torch.utils.checkpoint.checkpoint(
+                    layer,
+                    a,
+                    s,
+                    bias_l,
+                    mask,
+                    to_keys,
+                    multiplicity,
+                )
+
+            else:
+                a = layer(
+                    a,  # Float['bm n d'],
+                    s,  # Float['bm n ds'],
+                    bias_l,  # Float['b n n dp']
+                    mask,  # Bool['b n'] | None = None
+                    to_keys,
+                    multiplicity,
+                )
+        return a
+
+
+class DiffusionTransformerLayer(Module):
+    """Algorithm 23"""
+
+    def __init__(
+        self,
+        heads,
+        dim=384,
+        dim_single_cond=None,
+        post_layer_norm=False,
+    ):
+        super().__init__()
+
+        dim_single_cond = default(dim_single_cond, dim)
+
+        self.adaln = AdaLN(dim, dim_single_cond)
+        self.pair_bias_attn = AttentionPairBias(
+            c_s=dim, num_heads=heads, compute_pair_bias=False
+        )
+
+        self.output_projection_linear = Linear(dim_single_cond, dim)
+        nn.init.zeros_(self.output_projection_linear.weight)
+        nn.init.constant_(self.output_projection_linear.bias, -2.0)
+
+        self.output_projection = nn.Sequential(
+            self.output_projection_linear, nn.Sigmoid()
+        )
+        self.transition = ConditionedTransitionBlock(
+            dim_single=dim, dim_single_cond=dim_single_cond
+        )
+
+        if post_layer_norm:
+            self.post_lnorm = nn.LayerNorm(dim)
+        else:
+            self.post_lnorm = nn.Identity()
+
+    def forward(
+        self,
+        a,  # Float['bm n d'],
+        s,  # Float['bm n ds'],
+        bias=None,  # Float['b n n dp']
+        mask=None,  # Bool['b n'] | None = None
+        to_keys=None,
+        multiplicity=1,
+    ):
+        b = self.adaln(a, s)
+
+        k_in = b
+        if to_keys is not None:
+            k_in = to_keys(b)
+            mask = to_keys(mask.unsqueeze(-1)).squeeze(-1)
+
+        if self.pair_bias_attn:
+            b = self.pair_bias_attn(
+                s=b,
+                z=bias,
+                mask=mask,
+                multiplicity=multiplicity,
+                k_in=k_in,
+            )
+        else:
+            b = self.no_pair_bias_attn(s=b, mask=mask, k_in=k_in)
+
+        b = self.output_projection(s) * b
+
+        a = a + b
+        a = a + self.transition(a, s)
+
+        a = self.post_lnorm(a)
+        return a
+
+
+class AtomTransformer(Module):
+    """Algorithm 7"""
+
+    def __init__(
+        self,
+        attn_window_queries,
+        attn_window_keys,
+        **diffusion_transformer_kwargs,
+    ):
+        super().__init__()
+        self.attn_window_queries = attn_window_queries
+        self.attn_window_keys = attn_window_keys
+        self.diffusion_transformer = DiffusionTransformer(
+            **diffusion_transformer_kwargs
+        )
+
+    def forward(
+        self,
+        q,  # Float['b m d'],
+        c,  # Float['b m ds'],
+        bias,  # Float['b m m dp']
+        to_keys,
+        mask,  # Bool['b m'] | None = None
+        multiplicity=1,
+    ):
+        W = self.attn_window_queries
+        H = self.attn_window_keys
+
+        B, N, D = q.shape
+        NW = N // W
+
+        # reshape tokens
+        q = q.view((B * NW, W, -1))
+        c = c.view((B * NW, W, -1))
+        mask = mask.view(B * NW, W)
+        bias = bias.view((bias.shape[0] * NW, W, H, -1))
+
+        to_keys_new = lambda x: to_keys(x.view(B, NW * W, -1)).view(B * NW, H, -1)
+
+        # main transformer
+        q = self.diffusion_transformer(
+            a=q,
+            s=c,
+            bias=bias,
+            mask=mask.float(),
+            multiplicity=multiplicity,
+            to_keys=to_keys_new,
+        )
+
+        q = q.view((B, NW * W, D))
+        return q
diff --git a/forks/boltz/src/boltz/model/modules/trunk.py b/forks/boltz/src/boltz/model/modules/trunk.py
new file mode 100644
index 00000000..a83e0148
--- /dev/null
+++ b/forks/boltz/src/boltz/model/modules/trunk.py
@@ -0,0 +1,688 @@
+from typing import Optional
+
+import torch
+from fairscale.nn.checkpoint.checkpoint_activations import checkpoint_wrapper
+from torch import Tensor, nn
+
+from boltz.data import const
+from boltz.model.layers.attention import AttentionPairBias
+from boltz.model.layers.dropout import get_dropout_mask
+from boltz.model.layers.outer_product_mean import OuterProductMean
+from boltz.model.layers.pair_averaging import PairWeightedAveraging
+from boltz.model.layers.transition import Transition
+from boltz.model.layers.triangular_attention.attention import (
+    TriangleAttentionEndingNode,
+    TriangleAttentionStartingNode,
+)
+from boltz.model.layers.triangular_mult import (
+    TriangleMultiplicationIncoming,
+    TriangleMultiplicationOutgoing,
+)
+from boltz.model.modules.encoders import AtomAttentionEncoder
+
+
+class InputEmbedder(nn.Module):
+    """Input embedder."""
+
+    def __init__(
+        self,
+        atom_s: int,
+        atom_z: int,
+        token_s: int,
+        token_z: int,
+        atoms_per_window_queries: int,
+        atoms_per_window_keys: int,
+        atom_feature_dim: int,
+        atom_encoder_depth: int,
+        atom_encoder_heads: int,
+        no_atom_encoder: bool = False,
+    ) -> None:
+        """Initialize the input embedder.
+
+        Parameters
+        ----------
+        atom_s : int
+            The atom single representation dimension.
+        atom_z : int
+            The atom pair representation dimension.
+        token_s : int
+            The single token representation dimension.
+        token_z : int
+            The pair token representation dimension.
+        atoms_per_window_queries : int
+            The number of atoms per window for queries.
+        atoms_per_window_keys : int
+            The number of atoms per window for keys.
+        atom_feature_dim : int
+            The atom feature dimension.
+        atom_encoder_depth : int
+            The atom encoder depth.
+        atom_encoder_heads : int
+            The atom encoder heads.
+        no_atom_encoder : bool, optional
+            Whether to use the atom encoder, by default False
+
+        """
+        super().__init__()
+        self.token_s = token_s
+        self.no_atom_encoder = no_atom_encoder
+
+        if not no_atom_encoder:
+            self.atom_attention_encoder = AtomAttentionEncoder(
+                atom_s=atom_s,
+                atom_z=atom_z,
+                token_s=token_s,
+                token_z=token_z,
+                atoms_per_window_queries=atoms_per_window_queries,
+                atoms_per_window_keys=atoms_per_window_keys,
+                atom_feature_dim=atom_feature_dim,
+                atom_encoder_depth=atom_encoder_depth,
+                atom_encoder_heads=atom_encoder_heads,
+                structure_prediction=False,
+            )
+
+    def forward(self, feats: dict[str, Tensor]) -> Tensor:
+        """Perform the forward pass.
+
+        Parameters
+        ----------
+        feats : Dict[str, Tensor]
+            Input features
+
+        Returns
+        -------
+        Tensor
+            The embedded tokens.
+
+        """
+        # Load relevant features
+        res_type = feats["res_type"]
+        profile = feats["profile"]
+        deletion_mean = feats["deletion_mean"].unsqueeze(-1)
+        pocket_feature = feats["pocket_feature"]
+
+        # Compute input embedding
+        if self.no_atom_encoder:
+            a = torch.zeros(
+                (res_type.shape[0], res_type.shape[1], self.token_s),
+                device=res_type.device,
+            )
+        else:
+            a, _, _, _, _ = self.atom_attention_encoder(feats)
+        s = torch.cat([a, res_type, profile, deletion_mean, pocket_feature], dim=-1)
+        return s
+
+
+class MSAModule(nn.Module):
+    """MSA module."""
+
+    def __init__(
+        self,
+        msa_s: int,
+        token_z: int,
+        s_input_dim: int,
+        msa_blocks: int,
+        msa_dropout: float,
+        z_dropout: float,
+        pairwise_head_width: int = 32,
+        pairwise_num_heads: int = 4,
+        activation_checkpointing: bool = False,
+        use_paired_feature: bool = False,
+        offload_to_cpu: bool = False,
+        subsample_msa: bool = False,
+        num_subsampled_msa: int = 1024,
+        **kwargs,
+    ) -> None:
+        """Initialize the MSA module.
+
+        Parameters
+        ----------
+        msa_s : int
+            The MSA embedding size.
+        token_z : int
+            The token pairwise embedding size.
+        s_input_dim : int
+            The input sequence dimension.
+        msa_blocks : int
+            The number of MSA blocks.
+        msa_dropout : float
+            The MSA dropout.
+        z_dropout : float
+            The pairwise dropout.
+        pairwise_head_width : int, optional
+            The pairwise head width, by default 32
+        pairwise_num_heads : int, optional
+            The number of pairwise heads, by default 4
+        activation_checkpointing : bool, optional
+            Whether to use activation checkpointing, by default False
+        use_paired_feature : bool, optional
+            Whether to use the paired feature, by default False
+        offload_to_cpu : bool, optional
+            Whether to offload to CPU, by default False
+
+        """
+        super().__init__()
+        self.msa_blocks = msa_blocks
+        self.msa_dropout = msa_dropout
+        self.z_dropout = z_dropout
+        self.use_paired_feature = use_paired_feature
+        self.subsample_msa = subsample_msa
+        self.num_subsampled_msa = num_subsampled_msa
+
+        self.s_proj = nn.Linear(s_input_dim, msa_s, bias=False)
+        self.msa_proj = nn.Linear(
+            const.num_tokens + 2 + int(use_paired_feature),
+            msa_s,
+            bias=False,
+        )
+        self.layers = nn.ModuleList()
+        for i in range(msa_blocks):
+            if activation_checkpointing:
+                self.layers.append(
+                    checkpoint_wrapper(
+                        MSALayer(
+                            msa_s,
+                            token_z,
+                            msa_dropout,
+                            z_dropout,
+                            pairwise_head_width,
+                            pairwise_num_heads,
+                        ),
+                        offload_to_cpu=offload_to_cpu,
+                    )
+                )
+            else:
+                self.layers.append(
+                    MSALayer(
+                        msa_s,
+                        token_z,
+                        msa_dropout,
+                        z_dropout,
+                        pairwise_head_width,
+                        pairwise_num_heads,
+                    )
+                )
+
+    def forward(
+        self,
+        z: Tensor,
+        emb: Tensor,
+        feats: dict[str, Tensor],
+        use_kernels: bool = False,
+    ) -> Tensor:
+        """Perform the forward pass.
+
+        Parameters
+        ----------
+        z : Tensor
+            The pairwise embeddings
+        emb : Tensor
+            The input embeddings
+        feats : dict[str, Tensor]
+            Input features
+
+        Returns
+        -------
+        Tensor
+            The output pairwise embeddings.
+
+        """
+        # Set chunk sizes
+        if not self.training:
+            if z.shape[1] > const.chunk_size_threshold:
+                chunk_heads_pwa = True
+                chunk_size_transition_z = 64
+                chunk_size_transition_msa = 32
+                chunk_size_outer_product = 4
+                chunk_size_tri_attn = 128
+            else:
+                chunk_heads_pwa = False
+                chunk_size_transition_z = None
+                chunk_size_transition_msa = None
+                chunk_size_outer_product = None
+                chunk_size_tri_attn = 512
+        else:
+            chunk_heads_pwa = False
+            chunk_size_transition_z = None
+            chunk_size_transition_msa = None
+            chunk_size_outer_product = None
+            chunk_size_tri_attn = None
+
+        # Load relevant features
+        msa = feats["msa"]
+        has_deletion = feats["has_deletion"].unsqueeze(-1)
+        deletion_value = feats["deletion_value"].unsqueeze(-1)
+        is_paired = feats["msa_paired"].unsqueeze(-1)
+        msa_mask = feats["msa_mask"]
+        token_mask = feats["token_pad_mask"].float()
+        token_mask = token_mask[:, :, None] * token_mask[:, None, :]
+
+        # Compute MSA embeddings
+        if self.use_paired_feature:
+            m = torch.cat([msa, has_deletion, deletion_value, is_paired], dim=-1)
+        else:
+            m = torch.cat([msa, has_deletion, deletion_value], dim=-1)
+
+        if self.subsample_msa:
+            msa_indices = torch.randperm(m.shape[1])[: self.num_subsampled_msa]
+            m = m[:, msa_indices]
+            msa_mask = msa_mask[:, msa_indices]
+
+        # Compute input projections
+        m = self.msa_proj(m)
+        m = m + self.s_proj(emb).unsqueeze(1)
+
+        # Perform MSA blocks
+        for i in range(self.msa_blocks):
+            z, m = self.layers[i](
+                z,
+                m,
+                token_mask,
+                msa_mask,
+                chunk_heads_pwa,
+                chunk_size_transition_z,
+                chunk_size_transition_msa,
+                chunk_size_outer_product,
+                chunk_size_tri_attn,
+                use_kernels=use_kernels,
+            )
+        return z
+
+
+class MSALayer(nn.Module):
+    """MSA module."""
+
+    def __init__(
+        self,
+        msa_s: int,
+        token_z: int,
+        msa_dropout: float,
+        z_dropout: float,
+        pairwise_head_width: int = 32,
+        pairwise_num_heads: int = 4,
+    ) -> None:
+        """Initialize the MSA module.
+
+        Parameters
+        ----------
+
+        msa_s : int
+            The MSA embedding size.
+        token_z : int
+            The pair representation dimention.
+        msa_dropout : float
+            The MSA dropout.
+        z_dropout : float
+            The pair dropout.
+        pairwise_head_width : int, optional
+            The pairwise head width, by default 32
+        pairwise_num_heads : int, optional
+            The number of pairwise heads, by default 4
+
+        """
+        super().__init__()
+        self.msa_dropout = msa_dropout
+        self.z_dropout = z_dropout
+        self.msa_transition = Transition(dim=msa_s, hidden=msa_s * 4)
+        self.pair_weighted_averaging = PairWeightedAveraging(
+            c_m=msa_s,
+            c_z=token_z,
+            c_h=32,
+            num_heads=8,
+        )
+
+        self.tri_mul_out = TriangleMultiplicationOutgoing(token_z)
+        self.tri_mul_in = TriangleMultiplicationIncoming(token_z)
+        self.tri_att_start = TriangleAttentionStartingNode(
+            token_z, pairwise_head_width, pairwise_num_heads, inf=1e9
+        )
+        self.tri_att_end = TriangleAttentionEndingNode(
+            token_z, pairwise_head_width, pairwise_num_heads, inf=1e9
+        )
+        self.z_transition = Transition(
+            dim=token_z,
+            hidden=token_z * 4,
+        )
+        self.outer_product_mean = OuterProductMean(
+            c_in=msa_s,
+            c_hidden=32,
+            c_out=token_z,
+        )
+
+    def forward(
+        self,
+        z: Tensor,
+        m: Tensor,
+        token_mask: Tensor,
+        msa_mask: Tensor,
+        chunk_heads_pwa: bool = False,
+        chunk_size_transition_z: int = None,
+        chunk_size_transition_msa: int = None,
+        chunk_size_outer_product: int = None,
+        chunk_size_tri_attn: int = None,
+        use_kernels: bool = False,
+    ) -> tuple[Tensor, Tensor]:
+        """Perform the forward pass.
+
+        Parameters
+        ----------
+        z : Tensor
+            The pair representation
+        m : Tensor
+            The msa representation
+        token_mask : Tensor
+            The token mask
+        msa_mask : Dict[str, Tensor]
+            The MSA mask
+
+        Returns
+        -------
+        Tensor
+            The output pairwise embeddings.
+        Tensor
+            The output MSA embeddings.
+
+        """
+        # Communication to MSA stack
+        msa_dropout = get_dropout_mask(self.msa_dropout, m, self.training)
+        m = m + msa_dropout * self.pair_weighted_averaging(
+            m, z, token_mask, chunk_heads_pwa
+        )
+        m = m + self.msa_transition(m, chunk_size_transition_msa)
+
+        # Communication to pairwise stack
+        z = z + self.outer_product_mean(m, msa_mask, chunk_size_outer_product)
+
+        # Compute pairwise stack
+        dropout = get_dropout_mask(self.z_dropout, z, self.training)
+        z = z + dropout * self.tri_mul_out(z, mask=token_mask)
+
+        dropout = get_dropout_mask(self.z_dropout, z, self.training)
+        z = z + dropout * self.tri_mul_in(z, mask=token_mask)
+
+        dropout = get_dropout_mask(self.z_dropout, z, self.training)
+        z = z + dropout * self.tri_att_start(
+            z,
+            mask=token_mask,
+            chunk_size=chunk_size_tri_attn,
+            use_kernels=use_kernels,
+        )
+
+        dropout = get_dropout_mask(self.z_dropout, z, self.training, columnwise=True)
+        z = z + dropout * self.tri_att_end(
+            z,
+            mask=token_mask,
+            chunk_size=chunk_size_tri_attn,
+            use_kernels=use_kernels,
+        )
+
+        z = z + self.z_transition(z, chunk_size_transition_z)
+
+        return z, m
+
+
+class PairformerModule(nn.Module):
+    """Pairformer module."""
+
+    def __init__(
+        self,
+        token_s: int,
+        token_z: int,
+        num_blocks: int,
+        num_heads: int = 16,
+        dropout: float = 0.25,
+        pairwise_head_width: int = 32,
+        pairwise_num_heads: int = 4,
+        activation_checkpointing: bool = False,
+        no_update_s: bool = False,
+        no_update_z: bool = False,
+        offload_to_cpu: bool = False,
+        **kwargs,
+    ) -> None:
+        """Initialize the Pairformer module.
+
+        Parameters
+        ----------
+        token_s : int
+            The token single embedding size.
+        token_z : int
+            The token pairwise embedding size.
+        num_blocks : int
+            The number of blocks.
+        num_heads : int, optional
+            The number of heads, by default 16
+        dropout : float, optional
+            The dropout rate, by default 0.25
+        pairwise_head_width : int, optional
+            The pairwise head width, by default 32
+        pairwise_num_heads : int, optional
+            The number of pairwise heads, by default 4
+        activation_checkpointing : bool, optional
+            Whether to use activation checkpointing, by default False
+        no_update_s : bool, optional
+            Whether to update the single embeddings, by default False
+        no_update_z : bool, optional
+            Whether to update the pairwise embeddings, by default False
+        offload_to_cpu : bool, optional
+            Whether to offload to CPU, by default False
+
+        """
+        super().__init__()
+        self.token_z = token_z
+        self.num_blocks = num_blocks
+        self.dropout = dropout
+        self.num_heads = num_heads
+
+        self.layers = nn.ModuleList()
+        for i in range(num_blocks):
+            if activation_checkpointing:
+                self.layers.append(
+                    checkpoint_wrapper(
+                        PairformerLayer(
+                            token_s,
+                            token_z,
+                            num_heads,
+                            dropout,
+                            pairwise_head_width,
+                            pairwise_num_heads,
+                            no_update_s,
+                            False if i < num_blocks - 1 else no_update_z,
+                        ),
+                        offload_to_cpu=offload_to_cpu,
+                    )
+                )
+            else:
+                self.layers.append(
+                    PairformerLayer(
+                        token_s,
+                        token_z,
+                        num_heads,
+                        dropout,
+                        pairwise_head_width,
+                        pairwise_num_heads,
+                        no_update_s,
+                        False if i < num_blocks - 1 else no_update_z,
+                    )
+                )
+
+    def forward(
+        self,
+        s: Tensor,
+        z: Tensor,
+        mask: Tensor,
+        pair_mask: Tensor,
+        chunk_size_tri_attn: Optional[int] = None,
+        use_kernels: bool = False,
+    ) -> tuple[Tensor, Tensor]:
+        """Perform the forward pass.
+
+        Parameters
+        ----------
+        s : Tensor
+            The sequence embeddings
+        z : Tensor
+            The pairwise embeddings
+        mask : Tensor
+            The token mask
+        pair_mask : Tensor
+            The pairwise mask
+        Returns
+        -------
+        Tensor
+            The updated sequence embeddings.
+        Tensor
+            The updated pairwise embeddings.
+
+        """
+        if not self.training:
+            if z.shape[1] > const.chunk_size_threshold:
+                chunk_size_tri_attn = 128
+            else:
+                chunk_size_tri_attn = 512
+        else:
+            chunk_size_tri_attn = None
+
+        for layer in self.layers:
+            s, z = layer(
+                s,
+                z,
+                mask,
+                pair_mask,
+                chunk_size_tri_attn,
+                use_kernels=use_kernels,
+            )
+        return s, z
+
+
+class PairformerLayer(nn.Module):
+    """Pairformer module."""
+
+    def __init__(
+        self,
+        token_s: int,
+        token_z: int,
+        num_heads: int = 16,
+        dropout: float = 0.25,
+        pairwise_head_width: int = 32,
+        pairwise_num_heads: int = 4,
+        no_update_s: bool = False,
+        no_update_z: bool = False,
+    ) -> None:
+        """Initialize the Pairformer module.
+
+        Parameters
+        ----------
+        token_s : int
+            The token single embedding size.
+        token_z : int
+            The token pairwise embedding size.
+        num_heads : int, optional
+            The number of heads, by default 16
+        dropout : float, optiona
+            The dropout rate, by default 0.25
+        pairwise_head_width : int, optional
+            The pairwise head width, by default 32
+        pairwise_num_heads : int, optional
+            The number of pairwise heads, by default 4
+        no_update_s : bool, optional
+            Whether to update the single embeddings, by default False
+        no_update_z : bool, optional
+            Whether to update the pairwise embeddings, by default False
+
+        """
+        super().__init__()
+        self.token_z = token_z
+        self.dropout = dropout
+        self.num_heads = num_heads
+        self.no_update_s = no_update_s
+        self.no_update_z = no_update_z
+        if not self.no_update_s:
+            self.attention = AttentionPairBias(token_s, token_z, num_heads)
+        self.tri_mul_out = TriangleMultiplicationOutgoing(token_z)
+        self.tri_mul_in = TriangleMultiplicationIncoming(token_z)
+        self.tri_att_start = TriangleAttentionStartingNode(
+            token_z, pairwise_head_width, pairwise_num_heads, inf=1e9
+        )
+        self.tri_att_end = TriangleAttentionEndingNode(
+            token_z, pairwise_head_width, pairwise_num_heads, inf=1e9
+        )
+        if not self.no_update_s:
+            self.transition_s = Transition(token_s, token_s * 4)
+        self.transition_z = Transition(token_z, token_z * 4)
+
+    def forward(
+        self,
+        s: Tensor,
+        z: Tensor,
+        mask: Tensor,
+        pair_mask: Tensor,
+        chunk_size_tri_attn: Optional[int] = None,
+        use_kernels: bool = False,
+    ) -> tuple[Tensor, Tensor]:
+        """Perform the forward pass."""
+        # Compute pairwise stack
+        dropout = get_dropout_mask(self.dropout, z, self.training)
+        z = z + dropout * self.tri_mul_out(z, mask=pair_mask)
+
+        dropout = get_dropout_mask(self.dropout, z, self.training)
+        z = z + dropout * self.tri_mul_in(z, mask=pair_mask)
+
+        dropout = get_dropout_mask(self.dropout, z, self.training)
+        z = z + dropout * self.tri_att_start(
+            z,
+            mask=pair_mask,
+            chunk_size=chunk_size_tri_attn,
+            use_kernels=use_kernels,
+        )
+
+        dropout = get_dropout_mask(self.dropout, z, self.training, columnwise=True)
+        z = z + dropout * self.tri_att_end(
+            z,
+            mask=pair_mask,
+            chunk_size=chunk_size_tri_attn,
+            use_kernels=use_kernels,
+        )
+
+        z = z + self.transition_z(z)
+
+        # Compute sequence stack
+        if not self.no_update_s:
+            s = s + self.attention(s, z, mask)
+            s = s + self.transition_s(s)
+
+        return s, z
+
+
+class DistogramModule(nn.Module):
+    """Distogram Module."""
+
+    def __init__(self, token_z: int, num_bins: int) -> None:
+        """Initialize the distogram module.
+
+        Parameters
+        ----------
+        token_z : int
+            The token pairwise embedding size.
+        num_bins : int
+            The number of bins.
+
+        """
+        super().__init__()
+        self.distogram = nn.Linear(token_z, num_bins)
+
+    def forward(self, z: Tensor) -> Tensor:
+        """Perform the forward pass.
+
+        Parameters
+        ----------
+        z : Tensor
+            The pairwise embeddings
+
+        Returns
+        -------
+        Tensor
+            The predicted distogram.
+
+        """
+        z = z + z.transpose(1, 2)
+        return self.distogram(z)
diff --git a/forks/boltz/src/boltz/model/modules/trunkv2.py b/forks/boltz/src/boltz/model/modules/trunkv2.py
new file mode 100644
index 00000000..ebd7a2ec
--- /dev/null
+++ b/forks/boltz/src/boltz/model/modules/trunkv2.py
@@ -0,0 +1,828 @@
+import torch
+from torch import Tensor, nn
+from torch.nn.functional import one_hot
+
+from boltz.data import const
+from boltz.model.layers.outer_product_mean import OuterProductMean
+from boltz.model.layers.pair_averaging import PairWeightedAveraging
+from boltz.model.layers.pairformer import (
+    PairformerNoSeqLayer,
+    PairformerNoSeqModule,
+    get_dropout_mask,
+)
+from boltz.model.layers.transition import Transition
+from boltz.model.modules.encodersv2 import (
+    AtomAttentionEncoder,
+    AtomEncoder,
+    FourierEmbedding,
+)
+
+
+class ContactConditioning(nn.Module):
+    def __init__(self, token_z: int, cutoff_min: float, cutoff_max: float):
+        super().__init__()
+
+        self.fourier_embedding = FourierEmbedding(token_z)
+        self.encoder = nn.Linear(
+            token_z + len(const.contact_conditioning_info) - 1, token_z
+        )
+        self.encoding_unspecified = nn.Parameter(torch.zeros(token_z))
+        self.encoding_unselected = nn.Parameter(torch.zeros(token_z))
+        self.cutoff_min = cutoff_min
+        self.cutoff_max = cutoff_max
+
+    def forward(self, feats):
+        assert const.contact_conditioning_info["UNSPECIFIED"] == 0
+        assert const.contact_conditioning_info["UNSELECTED"] == 1
+        contact_conditioning = feats["contact_conditioning"][:, :, :, 2:]
+        contact_threshold = feats["contact_threshold"]
+        contact_threshold_normalized = (contact_threshold - self.cutoff_min) / (
+            self.cutoff_max - self.cutoff_min
+        )
+        contact_threshold_fourier = self.fourier_embedding(
+            contact_threshold_normalized.flatten()
+        ).reshape(contact_threshold_normalized.shape + (-1,))
+
+        contact_conditioning = torch.cat(
+            [
+                contact_conditioning,
+                contact_threshold_normalized.unsqueeze(-1),
+                contact_threshold_fourier,
+            ],
+            dim=-1,
+        )
+        contact_conditioning = self.encoder(contact_conditioning)
+
+        contact_conditioning = (
+            contact_conditioning
+            * (
+                1
+                - feats["contact_conditioning"][:, :, :, 0:2].sum(dim=-1, keepdim=True)
+            )
+            + self.encoding_unspecified * feats["contact_conditioning"][:, :, :, 0:1]
+            + self.encoding_unselected * feats["contact_conditioning"][:, :, :, 1:2]
+        )
+        return contact_conditioning
+
+
+class InputEmbedder(nn.Module):
+    def __init__(
+        self,
+        atom_s: int,
+        atom_z: int,
+        token_s: int,
+        token_z: int,
+        atoms_per_window_queries: int,
+        atoms_per_window_keys: int,
+        atom_feature_dim: int,
+        atom_encoder_depth: int,
+        atom_encoder_heads: int,
+        activation_checkpointing: bool = False,
+        add_method_conditioning: bool = False,
+        add_modified_flag: bool = False,
+        add_cyclic_flag: bool = False,
+        add_mol_type_feat: bool = False,
+        use_no_atom_char: bool = False,
+        use_atom_backbone_feat: bool = False,
+        use_residue_feats_atoms: bool = False,
+    ) -> None:
+        """Initialize the input embedder.
+
+        Parameters
+        ----------
+        atom_s : int
+            The atom embedding size.
+        atom_z : int
+            The atom pairwise embedding size.
+        token_s : int
+            The token embedding size.
+
+        """
+        super().__init__()
+        self.token_s = token_s
+        self.add_method_conditioning = add_method_conditioning
+        self.add_modified_flag = add_modified_flag
+        self.add_cyclic_flag = add_cyclic_flag
+        self.add_mol_type_feat = add_mol_type_feat
+
+        self.atom_encoder = AtomEncoder(
+            atom_s=atom_s,
+            atom_z=atom_z,
+            token_s=token_s,
+            token_z=token_z,
+            atoms_per_window_queries=atoms_per_window_queries,
+            atoms_per_window_keys=atoms_per_window_keys,
+            atom_feature_dim=atom_feature_dim,
+            structure_prediction=False,
+            use_no_atom_char=use_no_atom_char,
+            use_atom_backbone_feat=use_atom_backbone_feat,
+            use_residue_feats_atoms=use_residue_feats_atoms,
+        )
+
+        self.atom_enc_proj_z = nn.Sequential(
+            nn.LayerNorm(atom_z),
+            nn.Linear(atom_z, atom_encoder_depth * atom_encoder_heads, bias=False),
+        )
+
+        self.atom_attention_encoder = AtomAttentionEncoder(
+            atom_s=atom_s,
+            token_s=token_s,
+            atoms_per_window_queries=atoms_per_window_queries,
+            atoms_per_window_keys=atoms_per_window_keys,
+            atom_encoder_depth=atom_encoder_depth,
+            atom_encoder_heads=atom_encoder_heads,
+            structure_prediction=False,
+            activation_checkpointing=activation_checkpointing,
+        )
+
+        self.res_type_encoding = nn.Linear(const.num_tokens, token_s, bias=False)
+        self.msa_profile_encoding = nn.Linear(const.num_tokens + 1, token_s, bias=False)
+
+        if add_method_conditioning:
+            self.method_conditioning_init = nn.Embedding(
+                const.num_method_types, token_s
+            )
+            self.method_conditioning_init.weight.data.fill_(0)
+        if add_modified_flag:
+            self.modified_conditioning_init = nn.Embedding(2, token_s)
+            self.modified_conditioning_init.weight.data.fill_(0)
+        if add_cyclic_flag:
+            self.cyclic_conditioning_init = nn.Linear(1, token_s, bias=False)
+            self.cyclic_conditioning_init.weight.data.fill_(0)
+        if add_mol_type_feat:
+            self.mol_type_conditioning_init = nn.Embedding(
+                len(const.chain_type_ids), token_s
+            )
+            self.mol_type_conditioning_init.weight.data.fill_(0)
+
+    def forward(self, feats: dict[str, Tensor], affinity: bool = False) -> Tensor:
+        """Perform the forward pass.
+
+        Parameters
+        ----------
+        feats : dict[str, Tensor]
+            Input features
+
+        Returns
+        -------
+        Tensor
+            The embedded tokens.
+
+        """
+        # Load relevant features
+        res_type = feats["res_type"].float()
+        if affinity:
+            profile = feats["profile_affinity"]
+            deletion_mean = feats["deletion_mean_affinity"].unsqueeze(-1)
+        else:
+            profile = feats["profile"]
+            deletion_mean = feats["deletion_mean"].unsqueeze(-1)
+
+        # Compute input embedding
+        q, c, p, to_keys = self.atom_encoder(feats)
+        atom_enc_bias = self.atom_enc_proj_z(p)
+        a, _, _, _ = self.atom_attention_encoder(
+            feats=feats,
+            q=q,
+            c=c,
+            atom_enc_bias=atom_enc_bias,
+            to_keys=to_keys,
+        )
+
+        s = (
+            a
+            + self.res_type_encoding(res_type)
+            + self.msa_profile_encoding(torch.cat([profile, deletion_mean], dim=-1))
+        )
+
+        if self.add_method_conditioning:
+            s = s + self.method_conditioning_init(feats["method_feature"])
+        if self.add_modified_flag:
+            s = s + self.modified_conditioning_init(feats["modified"])
+        if self.add_cyclic_flag:
+            cyclic = feats["cyclic_period"].clamp(max=1.0).unsqueeze(-1)
+            s = s + self.cyclic_conditioning_init(cyclic)
+        if self.add_mol_type_feat:
+            s = s + self.mol_type_conditioning_init(feats["mol_type"])
+
+        return s
+
+
+class TemplateModule(nn.Module):
+    """Template module."""
+
+    def __init__(
+        self,
+        token_z: int,
+        template_dim: int,
+        template_blocks: int,
+        dropout: float = 0.25,
+        pairwise_head_width: int = 32,
+        pairwise_num_heads: int = 4,
+        post_layer_norm: bool = False,
+        activation_checkpointing: bool = False,
+        min_dist: float = 3.25,
+        max_dist: float = 50.75,
+        num_bins: int = 38,
+        **kwargs,
+    ) -> None:
+        """Initialize the template module.
+
+        Parameters
+        ----------
+        token_z : int
+            The token pairwise embedding size.
+
+        """
+        super().__init__()
+        self.min_dist = min_dist
+        self.max_dist = max_dist
+        self.num_bins = num_bins
+        self.relu = nn.ReLU()
+        self.z_norm = nn.LayerNorm(token_z)
+        self.v_norm = nn.LayerNorm(template_dim)
+        self.z_proj = nn.Linear(token_z, template_dim, bias=False)
+        self.a_proj = nn.Linear(
+            const.num_tokens * 2 + num_bins + 5,
+            template_dim,
+            bias=False,
+        )
+        self.u_proj = nn.Linear(template_dim, token_z, bias=False)
+        self.pairformer = PairformerNoSeqModule(
+            template_dim,
+            num_blocks=template_blocks,
+            dropout=dropout,
+            pairwise_head_width=pairwise_head_width,
+            pairwise_num_heads=pairwise_num_heads,
+            post_layer_norm=post_layer_norm,
+            activation_checkpointing=activation_checkpointing,
+        )
+
+    def forward(
+        self,
+        z: Tensor,
+        feats: dict[str, Tensor],
+        pair_mask: Tensor,
+        use_kernels: bool = False,
+    ) -> Tensor:
+        """Perform the forward pass.
+
+        Parameters
+        ----------
+        z : Tensor
+            The pairwise embeddings
+        feats : dict[str, Tensor]
+            Input features
+        pair_mask : Tensor
+            The pair mask
+
+        Returns
+        -------
+        Tensor
+            The updated pairwise embeddings.
+
+        """
+        # Load relevant features
+        asym_id = feats["asym_id"]
+        res_type = feats["template_restype"]
+        frame_rot = feats["template_frame_rot"]
+        frame_t = feats["template_frame_t"]
+        frame_mask = feats["template_mask_frame"]
+        cb_coords = feats["template_cb"]
+        ca_coords = feats["template_ca"]
+        cb_mask = feats["template_mask_cb"]
+        template_mask = feats["template_mask"].any(dim=2).float()
+        num_templates = template_mask.sum(dim=1)
+        num_templates = num_templates.clamp(min=1)
+
+        # Compute pairwise masks
+        b_cb_mask = cb_mask[:, :, :, None] * cb_mask[:, :, None, :]
+        b_frame_mask = frame_mask[:, :, :, None] * frame_mask[:, :, None, :]
+
+        b_cb_mask = b_cb_mask[..., None]
+        b_frame_mask = b_frame_mask[..., None]
+
+        # Compute asym mask, template features only attend within the same chain
+        B, T = res_type.shape[:2]  # noqa: N806
+        asym_mask = (asym_id[:, :, None] == asym_id[:, None, :]).float()
+        asym_mask = asym_mask[:, None].expand(-1, T, -1, -1)
+
+        # Compute template features
+        with torch.autocast(device_type="cuda", enabled=False):
+            # Compute distogram
+            cb_dists = torch.cdist(cb_coords, cb_coords)
+            boundaries = torch.linspace(self.min_dist, self.max_dist, self.num_bins - 1)
+            boundaries = boundaries.to(cb_dists.device)
+            distogram = (cb_dists[..., None] > boundaries).sum(dim=-1).long()
+            distogram = one_hot(distogram, num_classes=self.num_bins)
+
+            # Compute unit vector in each frame
+            frame_rot = frame_rot.unsqueeze(2).transpose(-1, -2)
+            frame_t = frame_t.unsqueeze(2).unsqueeze(-1)
+            ca_coords = ca_coords.unsqueeze(3).unsqueeze(-1)
+            vector = torch.matmul(frame_rot, (ca_coords - frame_t))
+            norm = torch.norm(vector, dim=-1, keepdim=True)
+            unit_vector = torch.where(norm > 0, vector / norm, torch.zeros_like(vector))
+            unit_vector = unit_vector.squeeze(-1)
+
+            # Concatenate input features
+            a_tij = [distogram, b_cb_mask, unit_vector, b_frame_mask]
+            a_tij = torch.cat(a_tij, dim=-1)
+            a_tij = a_tij * asym_mask.unsqueeze(-1)
+
+            res_type_i = res_type[:, :, :, None]
+            res_type_j = res_type[:, :, None, :]
+            res_type_i = res_type_i.expand(-1, -1, -1, res_type.size(2), -1)
+            res_type_j = res_type_j.expand(-1, -1, res_type.size(2), -1, -1)
+            a_tij = torch.cat([a_tij, res_type_i, res_type_j], dim=-1)
+            a_tij = self.a_proj(a_tij)
+
+        # Expand mask
+        pair_mask = pair_mask[:, None].expand(-1, T, -1, -1)
+        pair_mask = pair_mask.reshape(B * T, *pair_mask.shape[2:])
+
+        # Compute input projections
+        v = self.z_proj(self.z_norm(z[:, None])) + a_tij
+        v = v.view(B * T, *v.shape[2:])
+        v = v + self.pairformer(v, pair_mask, use_kernels=use_kernels)
+        v = self.v_norm(v)
+        v = v.view(B, T, *v.shape[1:])
+
+        # Aggregate templates
+        template_mask = template_mask[:, :, None, None, None]
+        num_templates = num_templates[:, None, None, None]
+        u = (v * template_mask).sum(dim=1) / num_templates.to(v)
+
+        # Compute output projection
+        u = self.u_proj(self.relu(u))
+        return u
+
+
+class TemplateV2Module(nn.Module):
+    """Template module."""
+
+    def __init__(
+        self,
+        token_z: int,
+        template_dim: int,
+        template_blocks: int,
+        dropout: float = 0.25,
+        pairwise_head_width: int = 32,
+        pairwise_num_heads: int = 4,
+        post_layer_norm: bool = False,
+        activation_checkpointing: bool = False,
+        min_dist: float = 3.25,
+        max_dist: float = 50.75,
+        num_bins: int = 38,
+        **kwargs,
+    ) -> None:
+        """Initialize the template module.
+
+        Parameters
+        ----------
+        token_z : int
+            The token pairwise embedding size.
+
+        """
+        super().__init__()
+        self.min_dist = min_dist
+        self.max_dist = max_dist
+        self.num_bins = num_bins
+        self.relu = nn.ReLU()
+        self.z_norm = nn.LayerNorm(token_z)
+        self.v_norm = nn.LayerNorm(template_dim)
+        self.z_proj = nn.Linear(token_z, template_dim, bias=False)
+        self.a_proj = nn.Linear(
+            const.num_tokens * 2 + num_bins + 5,
+            template_dim,
+            bias=False,
+        )
+        self.u_proj = nn.Linear(template_dim, token_z, bias=False)
+        self.pairformer = PairformerNoSeqModule(
+            template_dim,
+            num_blocks=template_blocks,
+            dropout=dropout,
+            pairwise_head_width=pairwise_head_width,
+            pairwise_num_heads=pairwise_num_heads,
+            post_layer_norm=post_layer_norm,
+            activation_checkpointing=activation_checkpointing,
+        )
+
+    def forward(
+        self,
+        z: Tensor,
+        feats: dict[str, Tensor],
+        pair_mask: Tensor,
+        use_kernels: bool = False,
+    ) -> Tensor:
+        """Perform the forward pass.
+
+        Parameters
+        ----------
+        z : Tensor
+            The pairwise embeddings
+        feats : dict[str, Tensor]
+            Input features
+        pair_mask : Tensor
+            The pair mask
+
+        Returns
+        -------
+        Tensor
+            The updated pairwise embeddings.
+
+        """
+        # Load relevant features
+        res_type = feats["template_restype"]
+        frame_rot = feats["template_frame_rot"]
+        frame_t = feats["template_frame_t"]
+        frame_mask = feats["template_mask_frame"]
+        cb_coords = feats["template_cb"]
+        ca_coords = feats["template_ca"]
+        cb_mask = feats["template_mask_cb"]
+        visibility_ids = feats["visibility_ids"]
+        template_mask = feats["template_mask"].any(dim=2).float()
+        num_templates = template_mask.sum(dim=1)
+        num_templates = num_templates.clamp(min=1)
+
+        # Compute pairwise masks
+        b_cb_mask = cb_mask[:, :, :, None] * cb_mask[:, :, None, :]
+        b_frame_mask = frame_mask[:, :, :, None] * frame_mask[:, :, None, :]
+
+        b_cb_mask = b_cb_mask[..., None]
+        b_frame_mask = b_frame_mask[..., None]
+
+        # Compute asym mask, template features only attend within the same chain
+        B, T = res_type.shape[:2]  # noqa: N806
+        tmlp_pair_mask = (
+            visibility_ids[:, :, :, None] == visibility_ids[:, :, None, :]
+        ).float()
+
+        # Compute template features
+        with torch.autocast(device_type="cuda", enabled=False):
+            # Compute distogram
+            cb_dists = torch.cdist(cb_coords, cb_coords)
+            boundaries = torch.linspace(self.min_dist, self.max_dist, self.num_bins - 1)
+            boundaries = boundaries.to(cb_dists.device)
+            distogram = (cb_dists[..., None] > boundaries).sum(dim=-1).long()
+            distogram = one_hot(distogram, num_classes=self.num_bins)
+
+            # Compute unit vector in each frame
+            frame_rot = frame_rot.unsqueeze(2).transpose(-1, -2)
+            frame_t = frame_t.unsqueeze(2).unsqueeze(-1)
+            ca_coords = ca_coords.unsqueeze(3).unsqueeze(-1)
+            vector = torch.matmul(frame_rot, (ca_coords - frame_t))
+            norm = torch.norm(vector, dim=-1, keepdim=True)
+            unit_vector = torch.where(norm > 0, vector / norm, torch.zeros_like(vector))
+            unit_vector = unit_vector.squeeze(-1)
+
+            # Concatenate input features
+            a_tij = [distogram, b_cb_mask, unit_vector, b_frame_mask]
+            a_tij = torch.cat(a_tij, dim=-1)
+            a_tij = a_tij * tmlp_pair_mask.unsqueeze(-1)
+
+            res_type_i = res_type[:, :, :, None]
+            res_type_j = res_type[:, :, None, :]
+            res_type_i = res_type_i.expand(-1, -1, -1, res_type.size(2), -1)
+            res_type_j = res_type_j.expand(-1, -1, res_type.size(2), -1, -1)
+            a_tij = torch.cat([a_tij, res_type_i, res_type_j], dim=-1)
+            a_tij = self.a_proj(a_tij)
+
+        # Expand mask
+        pair_mask = pair_mask[:, None].expand(-1, T, -1, -1)
+        pair_mask = pair_mask.reshape(B * T, *pair_mask.shape[2:])
+
+        # Compute input projections
+        v = self.z_proj(self.z_norm(z[:, None])) + a_tij
+        v = v.view(B * T, *v.shape[2:])
+        v = v + self.pairformer(v, pair_mask, use_kernels=use_kernels)
+        v = self.v_norm(v)
+        v = v.view(B, T, *v.shape[1:])
+
+        # Aggregate templates
+        template_mask = template_mask[:, :, None, None, None]
+        num_templates = num_templates[:, None, None, None]
+        u = (v * template_mask).sum(dim=1) / num_templates.to(v)
+
+        # Compute output projection
+        u = self.u_proj(self.relu(u))
+        return u
+
+
+class MSAModule(nn.Module):
+    """MSA module."""
+
+    def __init__(
+        self,
+        msa_s: int,
+        token_z: int,
+        token_s: int,
+        msa_blocks: int,
+        msa_dropout: float,
+        z_dropout: float,
+        pairwise_head_width: int = 32,
+        pairwise_num_heads: int = 4,
+        activation_checkpointing: bool = False,
+        use_paired_feature: bool = True,
+        subsample_msa: bool = False,
+        num_subsampled_msa: int = 1024,
+        **kwargs,
+    ) -> None:
+        """Initialize the MSA module.
+
+        Parameters
+        ----------
+        token_z : int
+            The token pairwise embedding size.
+
+        """
+        super().__init__()
+        self.msa_blocks = msa_blocks
+        self.msa_dropout = msa_dropout
+        self.z_dropout = z_dropout
+        self.use_paired_feature = use_paired_feature
+        self.activation_checkpointing = activation_checkpointing
+        self.subsample_msa = subsample_msa
+        self.num_subsampled_msa = num_subsampled_msa
+
+        self.s_proj = nn.Linear(token_s, msa_s, bias=False)
+        self.msa_proj = nn.Linear(
+            const.num_tokens + 2 + int(use_paired_feature),
+            msa_s,
+            bias=False,
+        )
+        self.layers = nn.ModuleList()
+        for i in range(msa_blocks):
+            self.layers.append(
+                MSALayer(
+                    msa_s,
+                    token_z,
+                    msa_dropout,
+                    z_dropout,
+                    pairwise_head_width,
+                    pairwise_num_heads,
+                )
+            )
+
+    def forward(
+        self,
+        z: Tensor,
+        emb: Tensor,
+        feats: dict[str, Tensor],
+        use_kernels: bool = False,
+    ) -> Tensor:
+        """Perform the forward pass.
+
+        Parameters
+        ----------
+        z : Tensor
+            The pairwise embeddings
+        emb : Tensor
+            The input embeddings
+        feats : dict[str, Tensor]
+            Input features
+        use_kernels: bool
+            Whether to use kernels for triangular updates
+
+        Returns
+        -------
+        Tensor
+            The output pairwise embeddings.
+
+        """
+        # Set chunk sizes
+        if not self.training:
+            if z.shape[1] > const.chunk_size_threshold:
+                chunk_heads_pwa = True
+                chunk_size_transition_z = 64
+                chunk_size_transition_msa = 32
+                chunk_size_outer_product = 4
+                chunk_size_tri_attn = 128
+            else:
+                chunk_heads_pwa = False
+                chunk_size_transition_z = None
+                chunk_size_transition_msa = None
+                chunk_size_outer_product = None
+                chunk_size_tri_attn = 512
+        else:
+            chunk_heads_pwa = False
+            chunk_size_transition_z = None
+            chunk_size_transition_msa = None
+            chunk_size_outer_product = None
+            chunk_size_tri_attn = None
+
+        # Load relevant features
+        msa = feats["msa"]
+        msa = torch.nn.functional.one_hot(msa, num_classes=const.num_tokens)
+        has_deletion = feats["has_deletion"].unsqueeze(-1)
+        deletion_value = feats["deletion_value"].unsqueeze(-1)
+        is_paired = feats["msa_paired"].unsqueeze(-1)
+        msa_mask = feats["msa_mask"]
+        token_mask = feats["token_pad_mask"].float()
+        token_mask = token_mask[:, :, None] * token_mask[:, None, :]
+
+        # Compute MSA embeddings
+        if self.use_paired_feature:
+            m = torch.cat([msa, has_deletion, deletion_value, is_paired], dim=-1)
+        else:
+            m = torch.cat([msa, has_deletion, deletion_value], dim=-1)
+
+        # Subsample the MSA
+        if self.subsample_msa:
+            msa_indices = torch.randperm(msa.shape[1])[: self.num_subsampled_msa]
+            m = m[:, msa_indices]
+            msa_mask = msa_mask[:, msa_indices]
+
+        # Compute input projections
+        m = self.msa_proj(m)
+        m = m + self.s_proj(emb).unsqueeze(1)
+
+        # Perform MSA blocks
+        for i in range(self.msa_blocks):
+            if self.activation_checkpointing and self.training:
+                z, m = torch.utils.checkpoint.checkpoint(
+                    self.layers[i],
+                    z,
+                    m,
+                    token_mask,
+                    msa_mask,
+                    chunk_heads_pwa,
+                    chunk_size_transition_z,
+                    chunk_size_transition_msa,
+                    chunk_size_outer_product,
+                    chunk_size_tri_attn,
+                    use_kernels,
+                )
+            else:
+                z, m = self.layers[i](
+                    z,
+                    m,
+                    token_mask,
+                    msa_mask,
+                    chunk_heads_pwa,
+                    chunk_size_transition_z,
+                    chunk_size_transition_msa,
+                    chunk_size_outer_product,
+                    chunk_size_tri_attn,
+                    use_kernels,
+                )
+        return z
+
+
+class MSALayer(nn.Module):
+    """MSA module."""
+
+    def __init__(
+        self,
+        msa_s: int,
+        token_z: int,
+        msa_dropout: float,
+        z_dropout: float,
+        pairwise_head_width: int = 32,
+        pairwise_num_heads: int = 4,
+    ) -> None:
+        """Initialize the MSA module.
+
+        Parameters
+        ----------
+        token_z : int
+            The token pairwise embedding size.
+
+        """
+        super().__init__()
+        self.msa_dropout = msa_dropout
+        self.msa_transition = Transition(dim=msa_s, hidden=msa_s * 4)
+        self.pair_weighted_averaging = PairWeightedAveraging(
+            c_m=msa_s,
+            c_z=token_z,
+            c_h=32,
+            num_heads=8,
+        )
+
+        self.pairformer_layer = PairformerNoSeqLayer(
+            token_z=token_z,
+            dropout=z_dropout,
+            pairwise_head_width=pairwise_head_width,
+            pairwise_num_heads=pairwise_num_heads,
+        )
+        self.outer_product_mean = OuterProductMean(
+            c_in=msa_s,
+            c_hidden=32,
+            c_out=token_z,
+        )
+
+    def forward(
+        self,
+        z: Tensor,
+        m: Tensor,
+        token_mask: Tensor,
+        msa_mask: Tensor,
+        chunk_heads_pwa: bool = False,
+        chunk_size_transition_z: int = None,
+        chunk_size_transition_msa: int = None,
+        chunk_size_outer_product: int = None,
+        chunk_size_tri_attn: int = None,
+        use_kernels: bool = False,
+    ) -> tuple[Tensor, Tensor]:
+        """Perform the forward pass.
+
+        Parameters
+        ----------
+        z : Tensor
+            The pairwise embeddings
+        emb : Tensor
+            The input embeddings
+        feats : dict[str, Tensor]
+            Input features
+
+        Returns
+        -------
+        Tensor
+            The output pairwise embeddings.
+
+        """
+        # Communication to MSA stack
+        msa_dropout = get_dropout_mask(self.msa_dropout, m, self.training)
+        m = m + msa_dropout * self.pair_weighted_averaging(
+            m, z, token_mask, chunk_heads_pwa
+        )
+        m = m + self.msa_transition(m, chunk_size_transition_msa)
+
+        z = z + self.outer_product_mean(m, msa_mask, chunk_size_outer_product)
+
+        # Compute pairwise stack
+        z = self.pairformer_layer(
+            z, token_mask, chunk_size_tri_attn, use_kernels=use_kernels
+        )
+
+        return z, m
+
+
+class BFactorModule(nn.Module):
+    """BFactor Module."""
+
+    def __init__(self, token_s: int, num_bins: int) -> None:
+        """Initialize the bfactor module.
+
+        Parameters
+        ----------
+        token_s : int
+            The token embedding size.
+
+        """
+        super().__init__()
+        self.bfactor = nn.Linear(token_s, num_bins)
+        self.num_bins = num_bins
+
+    def forward(self, s: Tensor) -> Tensor:
+        """Perform the forward pass.
+
+        Parameters
+        ----------
+        s : Tensor
+            The sequence embeddings
+
+        Returns
+        -------
+        Tensor
+            The predicted bfactor histogram.
+
+        """
+        return self.bfactor(s)
+
+
+class DistogramModule(nn.Module):
+    """Distogram Module."""
+
+    def __init__(self, token_z: int, num_bins: int, num_distograms: int = 1) -> None:
+        """Initialize the distogram module.
+
+        Parameters
+        ----------
+        token_z : int
+            The token pairwise embedding size.
+
+        """
+        super().__init__()
+        self.distogram = nn.Linear(token_z, num_distograms * num_bins)
+        self.num_distograms = num_distograms
+        self.num_bins = num_bins
+
+    def forward(self, z: Tensor) -> Tensor:
+        """Perform the forward pass.
+
+        Parameters
+        ----------
+        z : Tensor
+            The pairwise embeddings
+
+        Returns
+        -------
+        Tensor
+            The predicted distogram.
+
+        """
+        z = z + z.transpose(1, 2)
+        return self.distogram(z).reshape(
+            z.shape[0], z.shape[1], z.shape[2], self.num_distograms, self.num_bins
+        )
diff --git a/forks/boltz/src/boltz/model/modules/utils.py b/forks/boltz/src/boltz/model/modules/utils.py
new file mode 100644
index 00000000..a5a1f2e2
--- /dev/null
+++ b/forks/boltz/src/boltz/model/modules/utils.py
@@ -0,0 +1,303 @@
+# started from code from https://github.com/lucidrains/alphafold3-pytorch, MIT License, Copyright (c) 2024 Phil Wang
+
+from functools import partial
+from typing import Optional
+
+import torch
+import torch.nn.functional as F
+from torch.nn import (
+    Linear,
+    Module,
+)
+from torch.types import Device
+
+LinearNoBias = partial(Linear, bias=False)
+
+
+def exists(v):
+    return v is not None
+
+
+def default(v, d):
+    return v if exists(v) else d
+
+
+def log(t, eps=1e-20):
+    return torch.log(t.clamp(min=eps))
+
+
+class SwiGLU(Module):
+    def forward(
+        self,
+        x,  #: Float['... d']
+    ):  # -> Float[' ... (d//2)']:
+        x, gates = x.chunk(2, dim=-1)
+        return F.silu(gates) * x
+
+
+def center(atom_coords, atom_mask):
+    atom_mean = torch.sum(
+        atom_coords * atom_mask[:, :, None], dim=1, keepdim=True
+    ) / torch.sum(atom_mask[:, :, None], dim=1, keepdim=True)
+    atom_coords = atom_coords - atom_mean
+    return atom_coords
+
+
+def compute_random_augmentation(
+    multiplicity, s_trans=1.0, device=None, dtype=torch.float32
+):
+    R = random_rotations(multiplicity, dtype=dtype, device=device)
+    random_trans = (
+        torch.randn((multiplicity, 1, 3), dtype=dtype, device=device) * s_trans
+    )
+    return R, random_trans
+
+
+def randomly_rotate(coords, return_second_coords=False, second_coords=None):
+    R = random_rotations(len(coords), coords.dtype, coords.device)
+
+    if return_second_coords:
+        return torch.einsum("bmd,bds->bms", coords, R), torch.einsum(
+            "bmd,bds->bms", second_coords, R
+        ) if second_coords is not None else None
+
+    return torch.einsum("bmd,bds->bms", coords, R)
+
+
+def center_random_augmentation(
+    atom_coords,
+    atom_mask,
+    s_trans=1.0,
+    augmentation=True,
+    centering=True,
+    return_second_coords=False,
+    second_coords=None,
+):
+    """Algorithm 19"""
+    if centering:
+        atom_mean = torch.sum(
+            atom_coords * atom_mask[:, :, None], dim=1, keepdim=True
+        ) / torch.sum(atom_mask[:, :, None], dim=1, keepdim=True)
+        atom_coords = atom_coords - atom_mean
+
+        if second_coords is not None:
+            # apply same transformation also to this input
+            second_coords = second_coords - atom_mean
+
+    if augmentation:
+        atom_coords, second_coords = randomly_rotate(
+            atom_coords, return_second_coords=True, second_coords=second_coords
+        )
+        random_trans = torch.randn_like(atom_coords[:, 0:1, :]) * s_trans
+        atom_coords = atom_coords + random_trans
+
+        if second_coords is not None:
+            second_coords = second_coords + random_trans
+
+    if return_second_coords:
+        return atom_coords, second_coords
+
+    return atom_coords
+
+
+class ExponentialMovingAverage:
+    """from https://github.com/yang-song/score_sde_pytorch/blob/main/models/ema.py, Apache-2.0 license
+    Maintains (exponential) moving average of a set of parameters."""
+
+    def __init__(self, parameters, decay, use_num_updates=True):
+        """
+        Args:
+          parameters: Iterable of `torch.nn.Parameter`; usually the result of
+            `model.parameters()`.
+          decay: The exponential decay.
+          use_num_updates: Whether to use number of updates when computing
+            averages.
+        """
+        if decay < 0.0 or decay > 1.0:
+            raise ValueError("Decay must be between 0 and 1")
+        self.decay = decay
+        self.num_updates = 0 if use_num_updates else None
+        self.shadow_params = [p.clone().detach() for p in parameters if p.requires_grad]
+        self.collected_params = []
+
+    def update(self, parameters):
+        """
+        Update currently maintained parameters.
+        Call this every time the parameters are updated, such as the result of
+        the `optimizer.step()` call.
+        Args:
+          parameters: Iterable of `torch.nn.Parameter`; usually the same set of
+            parameters used to initialize this object.
+        """
+        decay = self.decay
+        if self.num_updates is not None:
+            self.num_updates += 1
+            decay = min(decay, (1 + self.num_updates) / (10 + self.num_updates))
+        one_minus_decay = 1.0 - decay
+        with torch.no_grad():
+            parameters = [p for p in parameters if p.requires_grad]
+            for s_param, param in zip(self.shadow_params, parameters):
+                s_param.sub_(one_minus_decay * (s_param - param))
+
+    def compatible(self, parameters):
+        if len(self.shadow_params) != len(parameters):
+            print(
+                f"Model has {len(self.shadow_params)} parameter tensors, the incoming ema {len(parameters)}"
+            )
+            return False
+
+        for s_param, param in zip(self.shadow_params, parameters):
+            if param.data.shape != s_param.data.shape:
+                print(
+                    f"Model has parameter tensor of shape {s_param.data.shape} , the incoming ema {param.data.shape}"
+                )
+                return False
+        return True
+
+    def copy_to(self, parameters):
+        """
+        Copy current parameters into given collection of parameters.
+        Args:
+          parameters: Iterable of `torch.nn.Parameter`; the parameters to be
+            updated with the stored moving averages.
+        """
+        parameters = [p for p in parameters if p.requires_grad]
+        for s_param, param in zip(self.shadow_params, parameters):
+            if param.requires_grad:
+                param.data.copy_(s_param.data)
+
+    def store(self, parameters):
+        """
+        Save the current parameters for restoring later.
+        Args:
+          parameters: Iterable of `torch.nn.Parameter`; the parameters to be
+            temporarily stored.
+        """
+        self.collected_params = [param.clone() for param in parameters]
+
+    def restore(self, parameters):
+        """
+        Restore the parameters stored with the `store` method.
+        Useful to validate the model with EMA parameters without affecting the
+        original optimization process. Store the parameters before the
+        `copy_to` method. After validation (or model saving), use this to
+        restore the former parameters.
+        Args:
+          parameters: Iterable of `torch.nn.Parameter`; the parameters to be
+            updated with the stored parameters.
+        """
+        for c_param, param in zip(self.collected_params, parameters):
+            param.data.copy_(c_param.data)
+
+    def state_dict(self):
+        return dict(
+            decay=self.decay,
+            num_updates=self.num_updates,
+            shadow_params=self.shadow_params,
+        )
+
+    def load_state_dict(self, state_dict, device):
+        self.decay = state_dict["decay"]
+        self.num_updates = state_dict["num_updates"]
+        self.shadow_params = [
+            tensor.to(device) for tensor in state_dict["shadow_params"]
+        ]
+
+    def to(self, device):
+        self.shadow_params = [tensor.to(device) for tensor in self.shadow_params]
+
+
+# the following is copied from Torch3D, BSD License, Copyright (c) Meta Platforms, Inc. and affiliates.
+
+
+def _copysign(a: torch.Tensor, b: torch.Tensor) -> torch.Tensor:
+    """
+    Return a tensor where each element has the absolute value taken from the,
+    corresponding element of a, with sign taken from the corresponding
+    element of b. This is like the standard copysign floating-point operation,
+    but is not careful about negative 0 and NaN.
+
+    Args:
+        a: source tensor.
+        b: tensor whose signs will be used, of the same shape as a.
+
+    Returns:
+        Tensor of the same shape as a with the signs of b.
+    """
+    signs_differ = (a < 0) != (b < 0)
+    return torch.where(signs_differ, -a, a)
+
+
+def quaternion_to_matrix(quaternions: torch.Tensor) -> torch.Tensor:
+    """
+    Convert rotations given as quaternions to rotation matrices.
+
+    Args:
+        quaternions: quaternions with real part first,
+            as tensor of shape (..., 4).
+
+    Returns:
+        Rotation matrices as tensor of shape (..., 3, 3).
+    """
+    r, i, j, k = torch.unbind(quaternions, -1)
+    # pyre-fixme[58]: `/` is not supported for operand types `float` and `Tensor`.
+    two_s = 2.0 / (quaternions * quaternions).sum(-1)
+
+    o = torch.stack(
+        (
+            1 - two_s * (j * j + k * k),
+            two_s * (i * j - k * r),
+            two_s * (i * k + j * r),
+            two_s * (i * j + k * r),
+            1 - two_s * (i * i + k * k),
+            two_s * (j * k - i * r),
+            two_s * (i * k - j * r),
+            two_s * (j * k + i * r),
+            1 - two_s * (i * i + j * j),
+        ),
+        -1,
+    )
+    return o.reshape(quaternions.shape[:-1] + (3, 3))
+
+
+def random_quaternions(
+    n: int, dtype: Optional[torch.dtype] = None, device: Optional[Device] = None
+) -> torch.Tensor:
+    """
+    Generate random quaternions representing rotations,
+    i.e. versors with nonnegative real part.
+
+    Args:
+        n: Number of quaternions in a batch to return.
+        dtype: Type to return.
+        device: Desired device of returned tensor. Default:
+            uses the current device for the default tensor type.
+
+    Returns:
+        Quaternions as tensor of shape (N, 4).
+    """
+    if isinstance(device, str):
+        device = torch.device(device)
+    o = torch.randn((n, 4), dtype=dtype, device=device)
+    s = (o * o).sum(1)
+    o = o / _copysign(torch.sqrt(s), o[:, 0])[:, None]
+    return o
+
+
+def random_rotations(
+    n: int, dtype: Optional[torch.dtype] = None, device: Optional[Device] = None
+) -> torch.Tensor:
+    """
+    Generate random rotations as 3x3 rotation matrices.
+
+    Args:
+        n: Number of rotation matrices in a batch to return.
+        dtype: Type to return.
+        device: Device of returned tensor. Default: if None,
+            uses the current device for the default tensor type.
+
+    Returns:
+        Rotation matrices as tensor of shape (n, 3, 3).
+    """
+    quaternions = random_quaternions(n, dtype=dtype, device=device)
+    return quaternion_to_matrix(quaternions)
diff --git a/forks/boltz/src/boltz/model/optim/__init__.py b/forks/boltz/src/boltz/model/optim/__init__.py
new file mode 100644
index 00000000..e69de29b
diff --git a/forks/boltz/src/boltz/model/optim/ema.py b/forks/boltz/src/boltz/model/optim/ema.py
new file mode 100644
index 00000000..c50ec7f8
--- /dev/null
+++ b/forks/boltz/src/boltz/model/optim/ema.py
@@ -0,0 +1,389 @@
+# --------------------------------------------------------------------------------------
+# Modified from Bio-Diffusion (https://github.com/BioinfoMachineLearning/bio-diffusion):
+# Modified from : https://github.com/BioinfoMachineLearning/bio-diffusion/blob/main/src/utils/__init__.py
+# --------------------------------------------------------------------------------------
+
+from typing import Any, Optional
+
+import torch
+from pytorch_lightning import Callback, LightningModule, Trainer
+from pytorch_lightning.utilities.exceptions import MisconfigurationException
+from pytorch_lightning.utilities.types import STEP_OUTPUT
+
+
+class EMA(Callback):
+    """Implements Exponential Moving Averaging (EMA).
+
+    When training a model, this callback maintains moving averages
+    of the trained parameters. When evaluating, we use the moving
+    averages copy of the trained parameters. When saving, we save
+    an additional set of parameters with the prefix `ema`.
+
+    Adapted from:
+    https://github.com/NVIDIA/NeMo/blob/main/nemo/collections/common/callbacks/ema.py
+    https://github.com/BioinfoMachineLearning/bio-diffusion/blob/main/src/utils/__init__.py
+
+    """
+
+    def __init__(
+        self,
+        decay: float = 0.999,
+        apply_ema_every_n_steps: int = 1,
+        start_step: int = 0,
+        eval_with_ema: bool = True,
+        warm_start: bool = True,
+    ) -> None:
+        """Initialize the EMA callback.
+
+        Parameters
+        ----------
+        decay: float
+            The exponential decay, has to be between 0-1.
+        apply_ema_every_n_steps: int, optional (default=1)
+            Apply EMA every n global steps.
+        start_step: int, optional (default=0)
+            Start applying EMA from ``start_step`` global step onwards.
+        eval_with_ema: bool, optional (default=True)
+            Validate the EMA weights instead of the original weights.
+            Note this means that when saving the model, the
+            validation metrics are calculated with the EMA weights.
+
+        """
+        if not (0 <= decay <= 1):
+            msg = "EMA decay value must be between 0 and 1"
+            raise MisconfigurationException(msg)
+
+        self._ema_weights: Optional[dict[str, torch.Tensor]] = None
+        self._cur_step: Optional[int] = None
+        self._weights_buffer: Optional[dict[str, torch.Tensor]] = None
+        self.apply_ema_every_n_steps = apply_ema_every_n_steps
+        self.start_step = start_step
+        self.eval_with_ema = eval_with_ema
+        self.decay = decay
+        self.warm_start = warm_start
+
+    @property
+    def ema_initialized(self) -> bool:
+        """Check if EMA weights have been initialized.
+
+        Returns
+        -------
+        bool
+            Whether the EMA weights have been initialized.
+
+        """
+        return self._ema_weights is not None
+
+    def state_dict(self) -> dict[str, Any]:
+        """Return the current state of the callback.
+
+        Returns
+        -------
+        dict[str, Any]
+            The current state of the callback.
+
+        """
+        return {
+            "cur_step": self._cur_step,
+            "ema_weights": self._ema_weights,
+        }
+
+    def load_state_dict(self, state_dict: dict[str, Any]) -> None:
+        """Load the state of the callback.
+
+        Parameters
+        ----------
+        state_dict: dict[str, Any]
+            The state of the callback to load.
+
+        """
+        self._cur_step = state_dict["cur_step"]
+        self._ema_weights = state_dict["ema_weights"]
+
+    def should_apply_ema(self, step: int) -> bool:
+        """Check if EMA should be applied at the current step.
+
+        Parameters
+        ----------
+        step: int
+            The current global step.
+
+        Returns
+        -------
+        bool
+            True if EMA should be applied, False otherwise.
+
+        """
+        return (
+            step != self._cur_step
+            and step >= self.start_step
+            and step % self.apply_ema_every_n_steps == 0
+        )
+
+    def apply_ema(self, pl_module: LightningModule) -> None:
+        """Apply EMA to the model weights.
+
+        Parameters
+        ----------
+        pl_module: LightningModule
+            The LightningModule instance.
+
+        """
+        decay = self.decay
+        if self.warm_start:
+            decay = min(decay, (1 + self._cur_step) / (10 + self._cur_step))
+
+        for k, orig_weight in pl_module.state_dict().items():
+            ema_weight = self._ema_weights[k]
+            if (
+                ema_weight.data.dtype != torch.long  # noqa: PLR1714
+                and orig_weight.data.dtype != torch.long  # skip non-trainable weights
+            ):
+                diff = ema_weight.data - orig_weight.data
+                diff.mul_(1.0 - decay)
+                ema_weight.sub_(diff)
+
+    def on_load_checkpoint(
+        self,
+        trainer: Trainer,
+        pl_module: LightningModule,  # noqa: ARG002
+        checkpoint: dict[str, Any],
+    ) -> None:
+        """Load the EMA weights from the checkpoint.
+
+        Parameters
+        ----------
+        trainer: Trainer
+            The Trainer instance.
+        pl_module: LightningModule
+            The LightningModule instance.
+        checkpoint: dict[str, Any]
+            The checkpoint to load.
+
+        """
+        if "ema" in checkpoint:
+            print("LOADING CHECKPOINT RUNNING")
+            self.load_state_dict(checkpoint["ema"])
+
+    def on_save_checkpoint(
+        self,
+        trainer: Trainer,  # noqa: ARG002
+        pl_module: LightningModule,  # noqa: ARG002
+        checkpoint: dict[str, Any],
+    ) -> None:
+        """Save the EMA weights to the checkpoint.
+
+        Parameters
+        ----------
+        trainer: Trainer
+            The Trainer instance.
+        pl_module: LightningModule
+            The LightningModule instance.
+        checkpoint: dict[str, Any]
+            The checkpoint to save.
+
+        """
+        if self.ema_initialized:
+            checkpoint["ema"] = self.state_dict()
+
+    def on_train_start(self, trainer: Trainer, pl_module: LightningModule) -> None:  # noqa: ARG002
+        """Initialize EMA weights and move to device.
+
+        Parameters
+        ----------
+        trainer: pl.Trainer
+            The Trainer instance.
+        pl_module: pl.LightningModule
+            The LightningModule instance.
+
+        """
+        # Create EMA weights if not already initialized
+        if not self.ema_initialized:
+            self._ema_weights = {
+                k: p.detach().clone() for k, p in pl_module.state_dict().items()
+            }
+
+        # Move EMA weights to the correct device
+        self._ema_weights = {
+            k: p.to(pl_module.device) for k, p in self._ema_weights.items()
+        }
+
+    def on_train_batch_end(
+        self,
+        trainer: Trainer,
+        pl_module: LightningModule,
+        outputs: STEP_OUTPUT,  # noqa: ARG002
+        batch: Any,  # noqa: ARG002
+        batch_idx: int,  # noqa: ARG002
+    ) -> None:
+        """Apply EMA to the model weights at the end of each training batch.
+
+        Parameters
+        ----------
+        trainer: Trainer
+            The Trainer instance.
+        pl_module: LightningModule
+            The LightningModule instance.
+        outputs: STEP_OUTPUT
+            The outputs of the model.
+        batch: Any
+            The current batch.
+        batch_idx: int
+            The index of the current batch.
+
+        """
+        if self.should_apply_ema(trainer.global_step):
+            self._cur_step = trainer.global_step
+            self.apply_ema(pl_module)
+
+    def replace_model_weights(self, pl_module: LightningModule) -> None:
+        """Replace model weights with EMA weights.
+
+        Parameters
+        ----------
+        pl_module: LightningModule
+            The LightningModule instance.
+
+        """
+        self._weights_buffer = {
+            k: p.detach().clone().to("cpu") for k, p in pl_module.state_dict().items()
+        }
+        pl_module.load_state_dict(self._ema_weights, strict=False)
+
+    def restore_original_weights(self, pl_module: LightningModule) -> None:
+        """Restore model weights to original weights.
+
+        Parameters
+        ----------
+        pl_module: LightningModule
+            The LightningModule instance.
+
+        """
+        pl_module.load_state_dict(self._weights_buffer, strict=False)
+        del self._weights_buffer
+
+    def _on_eval_start(self, pl_module: LightningModule) -> None:
+        """Use EMA weights for evaluation.
+
+        Parameters
+        ----------
+        pl_module: LightningModule
+            The LightningModule instance.
+
+        """
+        if self.ema_initialized and self.eval_with_ema:
+            self.replace_model_weights(pl_module)
+
+    def _on_eval_end(self, pl_module: LightningModule) -> None:
+        """Restore original weights after evaluation.
+
+        Parameters
+        ----------
+        pl_module: LightningModule
+            The LightningModule instance.
+
+        """
+        if self.ema_initialized and self.eval_with_ema:
+            self.restore_original_weights(pl_module)
+
+    def on_validation_start(
+        self,
+        trainer: Trainer,  # noqa: ARG002
+        pl_module: LightningModule,
+    ) -> None:
+        """Use EMA weights for validation.
+
+        Parameters
+        ----------
+        trainer: Trainer
+            The Trainer instance.
+        pl_module: LightningModule
+            The LightningModule instance.
+
+        """
+        self._on_eval_start(pl_module)
+
+    def on_validation_end(
+        self,
+        trainer: Trainer,  # noqa: ARG002
+        pl_module: LightningModule,
+    ) -> None:
+        """Restore original weights after validation.
+
+        Parameters
+        ----------
+        trainer: Trainer
+            The Trainer instance.
+        pl_module: LightningModule
+            The LightningModule instance.
+
+        """
+        self._on_eval_end(pl_module)
+
+    def on_test_start(
+        self,
+        trainer: Trainer,  # noqa: ARG002
+        pl_module: LightningModule,
+    ) -> None:
+        """Use EMA weights for testing.
+
+        Parameters
+        ----------
+        trainer: Trainer
+            The Trainer instance.
+        pl_module: LightningModule
+            The LightningModule instance.
+
+        """
+        self._on_eval_start(pl_module)
+
+    def on_test_end(
+        self,
+        trainer: Trainer,  # noqa: ARG002
+        pl_module: LightningModule,
+    ) -> None:
+        """Restore original weights after testing.
+
+        Parameters
+        ----------
+        trainer: Trainer
+            The Trainer instance.
+        pl_module: LightningModule
+            The LightningModule instance.
+
+        """
+        self._on_eval_end(pl_module)
+
+    def on_predict_start(
+        self,
+        trainer: Trainer,  # noqa: ARG002
+        pl_module: LightningModule,
+    ) -> None:
+        """Use EMA weights for prediction.
+
+        Parameters
+        ----------
+        trainer: Trainer
+            The Trainer instance.
+        pl_module: LightningModule
+            The LightningModule instance.
+
+        """
+        self._on_eval_start(pl_module)
+
+    def on_predict_end(
+        self,
+        trainer: Trainer,  # noqa: ARG002
+        pl_module: LightningModule,
+    ) -> None:
+        """Restore original weights after prediction.
+
+        Parameters
+        ----------
+        trainer: Trainer
+            The Trainer instance.
+        pl_module: LightningModule
+            The LightningModule instance.
+
+        """
+        self._on_eval_end(pl_module)
diff --git a/forks/boltz/src/boltz/model/optim/scheduler.py b/forks/boltz/src/boltz/model/optim/scheduler.py
new file mode 100644
index 00000000..bdc86ef4
--- /dev/null
+++ b/forks/boltz/src/boltz/model/optim/scheduler.py
@@ -0,0 +1,99 @@
+import torch
+
+
+class AlphaFoldLRScheduler(torch.optim.lr_scheduler._LRScheduler):
+    """Implements the learning rate schedule defined AF3.
+
+    A linear warmup is followed by a plateau at the maximum
+    learning rate and then exponential decay. Note that the
+    initial learning rate of the optimizer in question is
+    ignored; use this class' base_lr parameter to specify
+    the starting point of the warmup.
+
+    """
+
+    def __init__(
+        self,
+        optimizer: torch.optim.Optimizer,
+        last_epoch: int = -1,
+        base_lr: float = 0.0,
+        max_lr: float = 1.8e-3,
+        warmup_no_steps: int = 1000,
+        start_decay_after_n_steps: int = 50000,
+        decay_every_n_steps: int = 50000,
+        decay_factor: float = 0.95,
+    ) -> None:
+        """Initialize the learning rate scheduler.
+
+        Parameters
+        ----------
+        optimizer : torch.optim.Optimizer
+            The optimizer.
+        last_epoch : int, optional
+            The last epoch, by default -1
+        base_lr : float, optional
+            The base learning rate, by default 0.0
+        max_lr : float, optional
+            The maximum learning rate, by default 1.8e-3
+        warmup_no_steps : int, optional
+            The number of warmup steps, by default 1000
+        start_decay_after_n_steps : int, optional
+            The number of steps after which to start decay, by default 50000
+        decay_every_n_steps : int, optional
+            The number of steps after which to decay, by default 50000
+        decay_factor : float, optional
+            The decay factor, by default 0.95
+
+        """
+        step_counts = {
+            "warmup_no_steps": warmup_no_steps,
+            "start_decay_after_n_steps": start_decay_after_n_steps,
+        }
+
+        for k, v in step_counts.items():
+            if v < 0:
+                msg = f"{k} must be nonnegative"
+                raise ValueError(msg)
+
+        if warmup_no_steps > start_decay_after_n_steps:
+            msg = "warmup_no_steps must not exceed start_decay_after_n_steps"
+            raise ValueError(msg)
+
+        self.optimizer = optimizer
+        self.last_epoch = last_epoch
+        self.base_lr = base_lr
+        self.max_lr = max_lr
+        self.warmup_no_steps = warmup_no_steps
+        self.start_decay_after_n_steps = start_decay_after_n_steps
+        self.decay_every_n_steps = decay_every_n_steps
+        self.decay_factor = decay_factor
+
+        super().__init__(optimizer, last_epoch=last_epoch)
+
+    def state_dict(self) -> dict:
+        state_dict = {k: v for k, v in self.__dict__.items() if k not in ["optimizer"]}
+        return state_dict
+
+    def load_state_dict(self, state_dict):
+        self.__dict__.update(state_dict)
+
+    def get_lr(self):
+        if not self._get_lr_called_within_step:
+            msg = (
+                "To get the last learning rate computed by the scheduler, use "
+                "get_last_lr()"
+            )
+            raise RuntimeError(msg)
+
+        step_no = self.last_epoch
+
+        if step_no <= self.warmup_no_steps:
+            lr = self.base_lr + (step_no / self.warmup_no_steps) * self.max_lr
+        elif step_no > self.start_decay_after_n_steps:
+            steps_since_decay = step_no - self.start_decay_after_n_steps
+            exp = (steps_since_decay // self.decay_every_n_steps) + 1
+            lr = self.max_lr * (self.decay_factor**exp)
+        else:  # plateau
+            lr = self.max_lr
+
+        return [lr for group in self.optimizer.param_groups]
diff --git a/forks/boltz/src/boltz/model/potentials/__init__.py b/forks/boltz/src/boltz/model/potentials/__init__.py
new file mode 100644
index 00000000..e69de29b
diff --git a/forks/boltz/src/boltz/model/potentials/potentials.py b/forks/boltz/src/boltz/model/potentials/potentials.py
new file mode 100644
index 00000000..95ea95ca
--- /dev/null
+++ b/forks/boltz/src/boltz/model/potentials/potentials.py
@@ -0,0 +1,772 @@
+from abc import ABC, abstractmethod
+from typing import Optional, Dict, Any, Set, List, Union
+
+import torch
+import numpy as np
+from boltz.data import const
+from boltz.model.potentials.schedules import (
+    ParameterSchedule,
+    ExponentialInterpolation,
+    PiecewiseStepFunction,
+)
+from boltz.model.loss.diffusionv2 import weighted_rigid_align
+
+
+class Potential(ABC):
+    def __init__(
+        self,
+        parameters: Optional[
+            Dict[str, Union[ParameterSchedule, float, int, bool]]
+        ] = None,
+    ):
+        self.parameters = parameters
+
+    def compute(self, coords, feats, parameters):
+        index, args, com_args, ref_args, operator_args = self.compute_args(
+            feats, parameters
+        )
+
+        if index.shape[1] == 0:
+            return torch.zeros(coords.shape[:-2], device=coords.device)
+
+        if com_args is not None:
+            com_index, atom_pad_mask = com_args
+            unpad_com_index = com_index[atom_pad_mask]
+            unpad_coords = coords[..., atom_pad_mask, :]
+            coords = torch.zeros(
+                (*unpad_coords.shape[:-2], unpad_com_index.max() + 1, 3),
+                device=coords.device,
+            ).scatter_reduce(
+                -2,
+                unpad_com_index.unsqueeze(-1).expand_as(unpad_coords),
+                unpad_coords,
+                "mean",
+            )
+        else:
+            com_index, atom_pad_mask = None, None
+
+        if ref_args is not None:
+            ref_coords, ref_mask, ref_atom_index, ref_token_index = ref_args
+            coords = coords[..., ref_atom_index, :]
+        else:
+            ref_coords, ref_mask, ref_atom_index, ref_token_index = (
+                None,
+                None,
+                None,
+                None,
+            )
+
+        if operator_args is not None:
+            negation_mask, union_index = operator_args
+        else:
+            negation_mask, union_index = None, None
+
+        value = self.compute_variable(
+            coords,
+            index,
+            ref_coords=ref_coords,
+            ref_mask=ref_mask,
+            compute_gradient=False,
+        )
+        energy = self.compute_function(
+            value, *args, negation_mask=negation_mask, compute_derivative=False
+        )
+
+        if union_index is not None:
+            neg_exp_energy = torch.exp(-1 * parameters["union_lambda"] * energy)
+            Z = torch.zeros(
+                (*energy.shape[:-1], union_index.max() + 1), device=union_index.device
+            ).scatter_reduce(
+                -1,
+                union_index.expand_as(neg_exp_energy),
+                neg_exp_energy,
+                "sum",
+            )
+            softmax_energy = neg_exp_energy / Z[..., union_index]
+            softmax_energy[Z[..., union_index] == 0] = 0
+            return (energy * softmax_energy).sum(dim=-1)
+
+        return energy.sum(dim=tuple(range(1, energy.dim())))
+
+    def compute_gradient(self, coords, feats, parameters):
+        index, args, com_args, ref_args, operator_args = self.compute_args(
+            feats, parameters
+        )
+        if index.shape[1] == 0:
+            return torch.zeros_like(coords)
+
+        if com_args is not None:
+            com_index, atom_pad_mask = com_args
+            unpad_coords = coords[..., atom_pad_mask, :]
+            unpad_com_index = com_index[atom_pad_mask]
+            coords = torch.zeros(
+                (*unpad_coords.shape[:-2], unpad_com_index.max() + 1, 3),
+                device=coords.device,
+            ).scatter_reduce(
+                -2,
+                unpad_com_index.unsqueeze(-1).expand_as(unpad_coords),
+                unpad_coords,
+                "mean",
+            )
+            com_counts = torch.bincount(com_index[atom_pad_mask])
+        else:
+            com_index, atom_pad_mask = None, None
+
+        if ref_args is not None:
+            ref_coords, ref_mask, ref_atom_index, ref_token_index = ref_args
+            coords = coords[..., ref_atom_index, :]
+        else:
+            ref_coords, ref_mask, ref_atom_index, ref_token_index = (
+                None,
+                None,
+                None,
+                None,
+            )
+
+        if operator_args is not None:
+            negation_mask, union_index = operator_args
+        else:
+            negation_mask, union_index = None, None
+
+        value, grad_value = self.compute_variable(
+            coords,
+            index,
+            ref_coords=ref_coords,
+            ref_mask=ref_mask,
+            compute_gradient=True,
+        )
+        energy, dEnergy = self.compute_function(
+            value, *args, negation_mask=negation_mask, compute_derivative=True
+        )
+        if union_index is not None:
+            neg_exp_energy = torch.exp(-1 * parameters["union_lambda"] * energy)
+            Z = torch.zeros(
+                (*energy.shape[:-1], union_index.max() + 1), device=union_index.device
+            ).scatter_reduce(
+                -1,
+                union_index.expand_as(energy),
+                neg_exp_energy,
+                "sum",
+            )
+            softmax_energy = neg_exp_energy / Z[..., union_index]
+            softmax_energy[Z[..., union_index] == 0] = 0
+            f = torch.zeros(
+                (*energy.shape[:-1], union_index.max() + 1), device=union_index.device
+            ).scatter_reduce(
+                -1,
+                union_index.expand_as(energy),
+                energy * softmax_energy,
+                "sum",
+            )
+            dSoftmax = (
+                dEnergy
+                * softmax_energy
+                * (1 + parameters["union_lambda"] * (energy - f[..., union_index]))
+            )
+            prod = dSoftmax.tile(grad_value.shape[-3]).unsqueeze(
+                -1
+            ) * grad_value.flatten(start_dim=-3, end_dim=-2)
+            if prod.dim() > 3:
+                prod = prod.sum(dim=list(range(1, prod.dim() - 2)))
+            grad_atom = torch.zeros_like(coords).scatter_reduce(
+                -2,
+                index.flatten(start_dim=0, end_dim=1)
+                .unsqueeze(-1)
+                .expand((*coords.shape[:-2], -1, 3)),
+                dSoftmax.tile(grad_value.shape[-3]).unsqueeze(-1)
+                * grad_value.flatten(start_dim=-3, end_dim=-2),
+                "sum",
+            )
+        else:
+            prod = dEnergy.tile(grad_value.shape[-3]).unsqueeze(
+                -1
+            ) * grad_value.flatten(start_dim=-3, end_dim=-2)
+            if prod.dim() > 3:
+                prod = prod.sum(dim=list(range(1, prod.dim() - 2)))
+            grad_atom = torch.zeros_like(coords).scatter_reduce(
+                -2,
+                index.flatten(start_dim=0, end_dim=1)
+                .unsqueeze(-1)
+                .expand((*coords.shape[:-2], -1, 3)),  # 9 x 516 x 3
+                prod,
+                "sum",
+            )
+
+        if com_index is not None:
+            grad_atom = grad_atom[..., com_index, :]
+        elif ref_token_index is not None:
+            grad_atom = grad_atom[..., ref_token_index, :]
+
+        return grad_atom
+
+    def compute_parameters(self, t):
+        if self.parameters is None:
+            return None
+        parameters = {
+            name: parameter
+            if not isinstance(parameter, ParameterSchedule)
+            else parameter.compute(t)
+            for name, parameter in self.parameters.items()
+        }
+        return parameters
+
+    @abstractmethod
+    def compute_function(
+        self, value, *args, negation_mask=None, compute_derivative=False
+    ):
+        raise NotImplementedError
+
+    @abstractmethod
+    def compute_variable(self, coords, index, compute_gradient=False):
+        raise NotImplementedError
+
+    @abstractmethod
+    def compute_args(self, t, feats, **parameters):
+        raise NotImplementedError
+
+    def get_reference_coords(self, feats, parameters):
+        return None, None
+
+
+class FlatBottomPotential(Potential):
+    def compute_function(
+        self,
+        value,
+        k,
+        lower_bounds,
+        upper_bounds,
+        negation_mask=None,
+        compute_derivative=False,
+    ):
+        if lower_bounds is None:
+            lower_bounds = torch.full(value.shape[1:], float("-inf")).to(value)
+        if upper_bounds is None:
+            upper_bounds = torch.full(value.shape[1:], float("inf")).to(value)
+
+        if negation_mask is not None:
+            unbounded_below_mask = torch.isneginf(lower_bounds)
+            unbounded_above_mask = torch.isposinf(upper_bounds)
+            unbounded_mask = unbounded_below_mask + unbounded_above_mask
+            assert torch.all(unbounded_mask + negation_mask)
+            lower_bounds[~unbounded_above_mask * ~negation_mask] = upper_bounds[
+                ~unbounded_above_mask * ~negation_mask
+            ]
+            upper_bounds[~unbounded_above_mask * ~negation_mask] = float("inf")
+            upper_bounds[~unbounded_below_mask * ~negation_mask] = lower_bounds[
+                ~unbounded_below_mask * ~negation_mask
+            ]
+            lower_bounds[~unbounded_below_mask * ~negation_mask] = float("-inf")
+
+        neg_overflow_mask = value < lower_bounds
+        pos_overflow_mask = value > upper_bounds
+
+        energy = torch.zeros_like(value)
+        energy[neg_overflow_mask] = (k * (lower_bounds - value))[neg_overflow_mask]
+        energy[pos_overflow_mask] = (k * (value - upper_bounds))[pos_overflow_mask]
+        if not compute_derivative:
+            return energy
+
+        dEnergy = torch.zeros_like(value)
+        dEnergy[neg_overflow_mask] = (
+            -1 * k.expand_as(neg_overflow_mask)[neg_overflow_mask]
+        )
+        dEnergy[pos_overflow_mask] = (
+            1 * k.expand_as(pos_overflow_mask)[pos_overflow_mask]
+        )
+
+        return energy, dEnergy
+
+
+class ReferencePotential(Potential):
+    def compute_variable(
+        self, coords, index, ref_coords, ref_mask, compute_gradient=False
+    ):
+        aligned_ref_coords = weighted_rigid_align(
+            ref_coords.float(),
+            coords[:, index].float(),
+            ref_mask,
+            ref_mask,
+        )
+
+        r = coords[:, index] - aligned_ref_coords
+        r_norm = torch.linalg.norm(r, dim=-1)
+
+        if not compute_gradient:
+            return r_norm
+
+        r_hat = r / r_norm.unsqueeze(-1)
+        grad = (r_hat * ref_mask.unsqueeze(-1)).unsqueeze(1)
+        return r_norm, grad
+
+
+class DistancePotential(Potential):
+    def compute_variable(
+        self, coords, index, ref_coords=None, ref_mask=None, compute_gradient=False
+    ):
+        r_ij = coords.index_select(-2, index[0]) - coords.index_select(-2, index[1])
+        r_ij_norm = torch.linalg.norm(r_ij, dim=-1)
+        r_hat_ij = r_ij / r_ij_norm.unsqueeze(-1)
+
+        if not compute_gradient:
+            return r_ij_norm
+
+        grad_i = r_hat_ij
+        grad_j = -1 * r_hat_ij
+        grad = torch.stack((grad_i, grad_j), dim=1)
+        return r_ij_norm, grad
+
+
+class DihedralPotential(Potential):
+    def compute_variable(
+        self, coords, index, ref_coords=None, ref_mask=None, compute_gradient=False
+    ):
+        r_ij = coords.index_select(-2, index[0]) - coords.index_select(-2, index[1])
+        r_kj = coords.index_select(-2, index[2]) - coords.index_select(-2, index[1])
+        r_kl = coords.index_select(-2, index[2]) - coords.index_select(-2, index[3])
+
+        n_ijk = torch.cross(r_ij, r_kj, dim=-1)
+        n_jkl = torch.cross(r_kj, r_kl, dim=-1)
+
+        r_kj_norm = torch.linalg.norm(r_kj, dim=-1)
+        n_ijk_norm = torch.linalg.norm(n_ijk, dim=-1)
+        n_jkl_norm = torch.linalg.norm(n_jkl, dim=-1)
+
+        sign_phi = torch.sign(
+            r_kj.unsqueeze(-2) @ torch.cross(n_ijk, n_jkl, dim=-1).unsqueeze(-1)
+        ).squeeze(-1, -2)
+        phi = sign_phi * torch.arccos(
+            torch.clamp(
+                (n_ijk.unsqueeze(-2) @ n_jkl.unsqueeze(-1)).squeeze(-1, -2)
+                / (n_ijk_norm * n_jkl_norm),
+                -1 + 1e-8,
+                1 - 1e-8,
+            )
+        )
+
+        if not compute_gradient:
+            return phi
+
+        a = (
+            (r_ij.unsqueeze(-2) @ r_kj.unsqueeze(-1)).squeeze(-1, -2) / (r_kj_norm**2)
+        ).unsqueeze(-1)
+        b = (
+            (r_kl.unsqueeze(-2) @ r_kj.unsqueeze(-1)).squeeze(-1, -2) / (r_kj_norm**2)
+        ).unsqueeze(-1)
+
+        grad_i = n_ijk * (r_kj_norm / n_ijk_norm**2).unsqueeze(-1)
+        grad_l = -1 * n_jkl * (r_kj_norm / n_jkl_norm**2).unsqueeze(-1)
+        grad_j = (a - 1) * grad_i - b * grad_l
+        grad_k = (b - 1) * grad_l - a * grad_i
+        grad = torch.stack((grad_i, grad_j, grad_k, grad_l), dim=1)
+        return phi, grad
+
+
+class AbsDihedralPotential(DihedralPotential):
+    def compute_variable(
+        self, coords, index, ref_coords=None, ref_mask=None, compute_gradient=False
+    ):
+        if not compute_gradient:
+            phi = super().compute_variable(
+                coords, index, compute_gradient=compute_gradient
+            )
+            phi = torch.abs(phi)
+            return phi
+
+        phi, grad = super().compute_variable(
+            coords, index, compute_gradient=compute_gradient
+        )
+        grad[(phi < 0)[..., None, :, None].expand_as(grad)] *= -1
+        phi = torch.abs(phi)
+
+        return phi, grad
+
+
+class PoseBustersPotential(FlatBottomPotential, DistancePotential):
+    def compute_args(self, feats, parameters):
+        pair_index = feats["rdkit_bounds_index"][0]
+        lower_bounds = feats["rdkit_lower_bounds"][0].clone()
+        upper_bounds = feats["rdkit_upper_bounds"][0].clone()
+        bond_mask = feats["rdkit_bounds_bond_mask"][0]
+        angle_mask = feats["rdkit_bounds_angle_mask"][0]
+
+        lower_bounds[bond_mask * ~angle_mask] *= 1.0 - parameters["bond_buffer"]
+        upper_bounds[bond_mask * ~angle_mask] *= 1.0 + parameters["bond_buffer"]
+        lower_bounds[~bond_mask * angle_mask] *= 1.0 - parameters["angle_buffer"]
+        upper_bounds[~bond_mask * angle_mask] *= 1.0 + parameters["angle_buffer"]
+        lower_bounds[bond_mask * angle_mask] *= 1.0 - min(
+            parameters["bond_buffer"], parameters["angle_buffer"]
+        )
+        upper_bounds[bond_mask * angle_mask] *= 1.0 + min(
+            parameters["bond_buffer"], parameters["angle_buffer"]
+        )
+        lower_bounds[~bond_mask * ~angle_mask] *= 1.0 - parameters["clash_buffer"]
+        upper_bounds[~bond_mask * ~angle_mask] = float("inf")
+
+        k = torch.ones_like(lower_bounds)
+
+        return pair_index, (k, lower_bounds, upper_bounds), None, None, None
+
+
+class ConnectionsPotential(FlatBottomPotential, DistancePotential):
+    def compute_args(self, feats, parameters):
+        pair_index = feats["connected_atom_index"][0]
+        lower_bounds = None
+        upper_bounds = torch.full(
+            (pair_index.shape[1],), parameters["buffer"], device=pair_index.device
+        )
+        k = torch.ones_like(upper_bounds)
+
+        return pair_index, (k, lower_bounds, upper_bounds), None, None, None
+
+
+class VDWOverlapPotential(FlatBottomPotential, DistancePotential):
+    def compute_args(self, feats, parameters):
+        atom_chain_id = (
+            torch.bmm(
+                feats["atom_to_token"].float(), feats["asym_id"].unsqueeze(-1).float()
+            )
+            .squeeze(-1)
+            .long()
+        )[0]
+        atom_pad_mask = feats["atom_pad_mask"][0].bool()
+        chain_sizes = torch.bincount(atom_chain_id[atom_pad_mask])
+        single_ion_mask = (chain_sizes > 1)[atom_chain_id]
+
+        vdw_radii = torch.zeros(
+            const.num_elements, dtype=torch.float32, device=atom_chain_id.device
+        )
+        vdw_radii[1:119] = torch.tensor(
+            const.vdw_radii, dtype=torch.float32, device=atom_chain_id.device
+        )
+        atom_vdw_radii = (
+            feats["ref_element"].float() @ vdw_radii.unsqueeze(-1)
+        ).squeeze(-1)[0]
+
+        pair_index = torch.triu_indices(
+            atom_chain_id.shape[0],
+            atom_chain_id.shape[0],
+            1,
+            device=atom_chain_id.device,
+        )
+
+        pair_pad_mask = atom_pad_mask[pair_index].all(dim=0)
+        pair_ion_mask = single_ion_mask[pair_index[0]] * single_ion_mask[pair_index[1]]
+
+        num_chains = atom_chain_id.max() + 1
+        connected_chain_index = feats["connected_chain_index"][0]
+        connected_chain_matrix = torch.eye(
+            num_chains, device=atom_chain_id.device, dtype=torch.bool
+        )
+        connected_chain_matrix[connected_chain_index[0], connected_chain_index[1]] = (
+            True
+        )
+        connected_chain_matrix[connected_chain_index[1], connected_chain_index[0]] = (
+            True
+        )
+        connected_chain_mask = connected_chain_matrix[
+            atom_chain_id[pair_index[0]], atom_chain_id[pair_index[1]]
+        ]
+
+        pair_index = pair_index[
+            :, pair_pad_mask * pair_ion_mask * ~connected_chain_mask
+        ]
+
+        lower_bounds = atom_vdw_radii[pair_index].sum(dim=0) * (
+            1.0 - parameters["buffer"]
+        )
+        upper_bounds = None
+        k = torch.ones_like(lower_bounds)
+
+        return pair_index, (k, lower_bounds, upper_bounds), None, None, None
+
+
+class SymmetricChainCOMPotential(FlatBottomPotential, DistancePotential):
+    def compute_args(self, feats, parameters):
+        atom_chain_id = (
+            torch.bmm(
+                feats["atom_to_token"].float(), feats["asym_id"].unsqueeze(-1).float()
+            )
+            .squeeze(-1)
+            .long()
+        )[0]
+        atom_pad_mask = feats["atom_pad_mask"][0].bool()
+        chain_sizes = torch.bincount(atom_chain_id[atom_pad_mask])
+        single_ion_mask = chain_sizes > 1
+
+        pair_index = feats["symmetric_chain_index"][0]
+        pair_ion_mask = single_ion_mask[pair_index[0]] * single_ion_mask[pair_index[1]]
+        pair_index = pair_index[:, pair_ion_mask]
+        lower_bounds = torch.full(
+            (pair_index.shape[1],),
+            parameters["buffer"],
+            dtype=torch.float32,
+            device=pair_index.device,
+        )
+        upper_bounds = None
+        k = torch.ones_like(lower_bounds)
+
+        return (
+            pair_index,
+            (k, lower_bounds, upper_bounds),
+            (atom_chain_id, atom_pad_mask),
+            None,
+            None,
+        )
+
+
+class StereoBondPotential(FlatBottomPotential, AbsDihedralPotential):
+    def compute_args(self, feats, parameters):
+        stereo_bond_index = feats["stereo_bond_index"][0]
+        stereo_bond_orientations = feats["stereo_bond_orientations"][0].bool()
+
+        lower_bounds = torch.zeros(
+            stereo_bond_orientations.shape, device=stereo_bond_orientations.device
+        )
+        upper_bounds = torch.zeros(
+            stereo_bond_orientations.shape, device=stereo_bond_orientations.device
+        )
+        lower_bounds[stereo_bond_orientations] = torch.pi - parameters["buffer"]
+        upper_bounds[stereo_bond_orientations] = float("inf")
+        lower_bounds[~stereo_bond_orientations] = float("-inf")
+        upper_bounds[~stereo_bond_orientations] = parameters["buffer"]
+
+        k = torch.ones_like(lower_bounds)
+
+        return stereo_bond_index, (k, lower_bounds, upper_bounds), None, None, None
+
+
+class ChiralAtomPotential(FlatBottomPotential, DihedralPotential):
+    def compute_args(self, feats, parameters):
+        chiral_atom_index = feats["chiral_atom_index"][0]
+        chiral_atom_orientations = feats["chiral_atom_orientations"][0].bool()
+
+        lower_bounds = torch.zeros(
+            chiral_atom_orientations.shape, device=chiral_atom_orientations.device
+        )
+        upper_bounds = torch.zeros(
+            chiral_atom_orientations.shape, device=chiral_atom_orientations.device
+        )
+        lower_bounds[chiral_atom_orientations] = parameters["buffer"]
+        upper_bounds[chiral_atom_orientations] = float("inf")
+        upper_bounds[~chiral_atom_orientations] = -1 * parameters["buffer"]
+        lower_bounds[~chiral_atom_orientations] = float("-inf")
+
+        k = torch.ones_like(lower_bounds)
+        return chiral_atom_index, (k, lower_bounds, upper_bounds), None, None, None
+
+
+class PlanarBondPotential(FlatBottomPotential, AbsDihedralPotential):
+    def compute_args(self, feats, parameters):
+        double_bond_index = feats["planar_bond_index"][0].T
+        double_bond_improper_index = torch.tensor(
+            [
+                [1, 2, 3, 0],
+                [4, 5, 0, 3],
+            ],
+            device=double_bond_index.device,
+        ).T
+        improper_index = (
+            double_bond_index[:, double_bond_improper_index]
+            .swapaxes(0, 1)
+            .flatten(start_dim=1)
+        )
+        lower_bounds = None
+        upper_bounds = torch.full(
+            (improper_index.shape[1],),
+            parameters["buffer"],
+            device=improper_index.device,
+        )
+        k = torch.ones_like(upper_bounds)
+
+        return improper_index, (k, lower_bounds, upper_bounds), None, None, None
+
+
+class TemplateReferencePotential(FlatBottomPotential, ReferencePotential):
+    def compute_args(self, feats, parameters):
+        if "template_mask_cb" not in feats or "template_force" not in feats:
+            return torch.empty([1, 0]), None, None, None, None
+
+        template_mask = feats["template_mask_cb"][feats["template_force"]]
+        if template_mask.shape[0] == 0:
+            return torch.empty([1, 0]), None, None, None, None
+
+        ref_coords = feats["template_cb"][feats["template_force"]].clone()
+        ref_mask = feats["template_mask_cb"][feats["template_force"]].clone()
+        ref_atom_index = (
+            torch.bmm(
+                feats["token_to_rep_atom"].float(),
+                torch.arange(
+                    feats["atom_pad_mask"].shape[1],
+                    device=feats["atom_pad_mask"].device,
+                    dtype=torch.float32,
+                )[None, :, None],
+            )
+            .squeeze(-1)
+            .long()
+        )[0]
+        ref_token_index = (
+            torch.bmm(
+                feats["atom_to_token"].float(),
+                feats["token_index"].unsqueeze(-1).float(),
+            )
+            .squeeze(-1)
+            .long()
+        )[0]
+
+        index = torch.arange(
+            template_mask.shape[-1], dtype=torch.long, device=template_mask.device
+        )[None]
+        upper_bounds = torch.full(
+            template_mask.shape, float("inf"), device=index.device, dtype=torch.float32
+        )
+        ref_idxs = torch.argwhere(template_mask).T
+        upper_bounds[ref_idxs.unbind()] = feats["template_force_threshold"][
+            feats["template_force"]
+        ][ref_idxs[0]]
+
+        lower_bounds = None
+        k = torch.ones_like(upper_bounds)
+        return (
+            index,
+            (k, lower_bounds, upper_bounds),
+            None,
+            (ref_coords, ref_mask, ref_atom_index, ref_token_index),
+            None,
+        )
+
+
+class ContactPotentital(FlatBottomPotential, DistancePotential):
+    def compute_args(self, feats, parameters):
+        index = feats["contact_pair_index"][0]
+        union_index = feats["contact_union_index"][0]
+        negation_mask = feats["contact_negation_mask"][0]
+        lower_bounds = None
+        upper_bounds = feats["contact_thresholds"][0].clone()
+        k = torch.ones_like(upper_bounds)
+        return (
+            index,
+            (k, lower_bounds, upper_bounds),
+            None,
+            None,
+            (negation_mask, union_index),
+        )
+
+
+def get_potentials(steering_args, boltz2=False):
+    potentials = []
+    if steering_args["fk_steering"] or steering_args["physical_guidance_update"]:
+        potentials.extend(
+            [
+                SymmetricChainCOMPotential(
+                    parameters={
+                        "guidance_interval": 4,
+                        "guidance_weight": 0.5
+                        if steering_args["contact_guidance_update"]
+                        else 0.0,
+                        "resampling_weight": 0.5,
+                        "buffer": ExponentialInterpolation(
+                            start=1.0, end=5.0, alpha=-2.0
+                        ),
+                    }
+                ),
+                VDWOverlapPotential(
+                    parameters={
+                        "guidance_interval": 5,
+                        "guidance_weight": (
+                            PiecewiseStepFunction(thresholds=[0.4], values=[0.125, 0.0])
+                            if steering_args["contact_guidance_update"]
+                            else 0.0
+                        ),
+                        "resampling_weight": PiecewiseStepFunction(
+                            thresholds=[0.6], values=[0.01, 0.0]
+                        ),
+                        "buffer": 0.225,
+                    }
+                ),
+                ConnectionsPotential(
+                    parameters={
+                        "guidance_interval": 1,
+                        "guidance_weight": 0.15
+                        if steering_args["contact_guidance_update"]
+                        else 0.0,
+                        "resampling_weight": 1.0,
+                        "buffer": 2.0,
+                    }
+                ),
+                PoseBustersPotential(
+                    parameters={
+                        "guidance_interval": 1,
+                        "guidance_weight": 0.01
+                        if steering_args["contact_guidance_update"]
+                        else 0.0,
+                        "resampling_weight": 0.1,
+                        "bond_buffer": 0.2,
+                        "angle_buffer": 0.2,
+                        "clash_buffer": 0.15,
+                    }
+                ),
+                ChiralAtomPotential(
+                    parameters={
+                        "guidance_interval": 1,
+                        "guidance_weight": 0.1
+                        if steering_args["contact_guidance_update"]
+                        else 0.0,
+                        "resampling_weight": 1.0,
+                        "buffer": 0.52360,
+                    }
+                ),
+                StereoBondPotential(
+                    parameters={
+                        "guidance_interval": 1,
+                        "guidance_weight": 0.05
+                        if steering_args["contact_guidance_update"]
+                        else 0.0,
+                        "resampling_weight": 1.0,
+                        "buffer": 0.52360,
+                    }
+                ),
+                PlanarBondPotential(
+                    parameters={
+                        "guidance_interval": 1,
+                        "guidance_weight": 0.05
+                        if steering_args["contact_guidance_update"]
+                        else 0.0,
+                        "resampling_weight": 1.0,
+                        "buffer": 0.26180,
+                    }
+                ),
+            ]
+        )
+    if boltz2 and (
+        steering_args["fk_steering"] or steering_args["contact_guidance_update"]
+    ):
+        potentials.extend(
+            [
+                ContactPotentital(
+                    parameters={
+                        "guidance_interval": 4,
+                        "guidance_weight": (
+                            PiecewiseStepFunction(
+                                thresholds=[0.25, 0.75], values=[0.0, 0.5, 1.0]
+                            )
+                            if steering_args["contact_guidance_update"]
+                            else 0.0
+                        ),
+                        "resampling_weight": 1.0,
+                        "union_lambda": ExponentialInterpolation(
+                            start=8.0, end=0.0, alpha=-2.0
+                        ),
+                    }
+                ),
+                TemplateReferencePotential(
+                    parameters={
+                        "guidance_interval": 2,
+                        "guidance_weight": 0.1
+                        if steering_args["contact_guidance_update"]
+                        else 0.0,
+                        "resampling_weight": 1.0,
+                    }
+                ),
+            ]
+        )
+    return potentials
diff --git a/forks/boltz/src/boltz/model/potentials/schedules.py b/forks/boltz/src/boltz/model/potentials/schedules.py
new file mode 100644
index 00000000..564249aa
--- /dev/null
+++ b/forks/boltz/src/boltz/model/potentials/schedules.py
@@ -0,0 +1,37 @@
+import math
+from abc import ABC
+
+
+class ParameterSchedule(ABC):
+    def compute(self, t):
+        raise NotImplementedError
+
+
+class ExponentialInterpolation(ParameterSchedule):
+    def __init__(self, start, end, alpha):
+        self.start = start
+        self.end = end
+        self.alpha = alpha
+
+    def compute(self, t):
+        if self.alpha != 0:
+            return self.start + (self.end - self.start) * (
+                math.exp(self.alpha * t) - 1
+            ) / (math.exp(self.alpha) - 1)
+        else:
+            return self.start + (self.end - self.start) * t
+
+
+class PiecewiseStepFunction(ParameterSchedule):
+    def __init__(self, thresholds, values):
+        self.thresholds = thresholds
+        self.values = values
+
+    def compute(self, t):
+        assert len(self.thresholds) > 0
+        assert len(self.values) == len(self.thresholds) + 1
+
+        idx = 0
+        while idx < len(self.thresholds) and t > self.thresholds[idx]:
+            idx += 1
+        return self.values[idx]
diff --git a/forks/boltz/tests/model/layers/test_outer_product_mean.py b/forks/boltz/tests/model/layers/test_outer_product_mean.py
new file mode 100644
index 00000000..a9623e45
--- /dev/null
+++ b/forks/boltz/tests/model/layers/test_outer_product_mean.py
@@ -0,0 +1,38 @@
+import pytorch_lightning
+import torch
+import torch.nn as nn
+
+import unittest
+
+from boltz.model.layers.outer_product_mean import OuterProductMean
+
+
+class OuterProductMeanTest(unittest.TestCase):
+    def setUp(self):
+        self.c_in = 32
+        self.c_hidden = 16
+        self.c_out = 64
+
+        torch.set_grad_enabled(False)
+        pytorch_lightning.seed_everything(1100)
+        self.layer = OuterProductMean(self.c_in, self.c_hidden, self.c_out)
+
+        # Initialize layer
+        for name, param in self.layer.named_parameters():
+            nn.init.normal_(param, mean=1.0, std=1.0)
+
+        # Set to eval mode
+        self.layer.eval()
+
+    def test_chunk(self):
+        chunk_sizes = [16, 33, 64, 83, 100]
+        B, S, N = 1, 49, 84
+        m = torch.randn(size=(B, S, N, self.c_in))
+        mask = torch.randint(low=0, high=1, size=(B, S, N))
+
+        with torch.no_grad():
+            exp_output = self.layer(m=m, mask=mask)
+            for chunk_size in chunk_sizes:
+                with self.subTest(chunk_size=chunk_size):
+                    act_output = self.layer(m=m, mask=mask, chunk_size=chunk_size)
+                    assert torch.allclose(exp_output, act_output, atol=1e-8)
diff --git a/forks/boltz/tests/model/layers/test_triangle_attention.py b/forks/boltz/tests/model/layers/test_triangle_attention.py
new file mode 100644
index 00000000..e9fa5118
--- /dev/null
+++ b/forks/boltz/tests/model/layers/test_triangle_attention.py
@@ -0,0 +1,35 @@
+import pytorch_lightning
+import torch
+import torch.nn as nn
+
+import unittest
+
+from boltz.model.layers.triangular_attention.attention import TriangleAttention
+
+
+class OuterProductMeanTest(unittest.TestCase):
+    def setUp(self):
+        self.c_in = 128
+        self.c_hidden = 32
+        self.no_heads = 1
+
+        torch.set_grad_enabled(False)
+        pytorch_lightning.seed_everything(1100)
+        self.layer = TriangleAttention(self.c_in, self.c_hidden, self.no_heads)
+
+        # Initialize layer
+        for name, param in self.layer.named_parameters():
+            nn.init.normal_(param, mean=1.0, std=1.0)
+
+    def test_chunk(self):
+        chunk_sizes = [16, 33, 64, 100]
+        B, N = 1, 99
+        m = torch.randn(size=(B, N, N, self.c_in))
+        mask = torch.randint(low=0, high=1, size=(B, N, N))
+
+        with torch.no_grad():
+            exp_output = self.layer(x=m, mask=mask)
+            for chunk_size in chunk_sizes:
+                with self.subTest(chunk_size=chunk_size):
+                    act_output = self.layer(x=m, mask=mask, chunk_size=chunk_size)
+                    assert torch.allclose(exp_output, act_output, atol=1e-8)
diff --git a/forks/boltz/tests/profiling.py b/forks/boltz/tests/profiling.py
new file mode 100644
index 00000000..bd083318
--- /dev/null
+++ b/forks/boltz/tests/profiling.py
@@ -0,0 +1,67 @@
+import torch
+import gc
+
+
+def clear_gradients(*args):
+    for arg in args:
+        if isinstance(arg, torch.Tensor) and arg.grad is not None:
+            arg.grad = None
+
+
+def clear_memory(device):
+    torch._C._cuda_clearCublasWorkspaces()
+    torch._dynamo.reset()
+    gc.collect()
+    torch.cuda.empty_cache()
+    torch.cuda.reset_peak_memory_stats(device)
+
+
+def peak_memory(f, *args, device):
+    for _ in range(3):
+        # Clean everything
+        clear_memory(device)
+        clear_gradients(*args)
+
+        # Run once
+        f(*args)
+
+        # Measure peak memory
+        torch.cuda.synchronize()
+        memory = torch.cuda.max_memory_allocated(device)
+
+    return memory
+
+
+def current_memory(device):
+    return torch.cuda.memory_allocated(device) / (1024**3)
+
+
+def memory_measure(f, device, num_iters=3):
+    # Clean everything
+    clear_memory(device)
+
+    # Run measurement
+    print("Current memory: ", current_memory(device))
+    memory = peak_memory(f, device=device)
+
+    print("Peak memory: ", memory / (1024**3))
+    return memory / (1024**3)
+
+
+def memory_measure_simple(f, device, *args, **kwargs):
+    # Clean everything
+    clear_memory(device)
+    clear_gradients(*args)
+
+    current = current_memory(device)
+
+    # Run once
+    out = f(*args, **kwargs)
+
+    # Measure peak memory
+    torch.cuda.synchronize()
+    memory = torch.cuda.max_memory_allocated(device)
+    memory = memory / (1024**3)
+    memory = memory - current
+
+    return out, memory
diff --git a/forks/boltz/tests/test_kernels.py b/forks/boltz/tests/test_kernels.py
new file mode 100644
index 00000000..b43c0a99
--- /dev/null
+++ b/forks/boltz/tests/test_kernels.py
@@ -0,0 +1,288 @@
+import os
+import time
+
+import pandas as pd
+import torch
+import triton
+from profiling import clear_memory, current_memory, memory_measure
+
+from boltz.model.layers.pairformer import PairformerLayer
+
+# Disable auto-tuning
+os.environ["CUEQ_DEFAULT_CONFIG"] = "1"
+os.environ["CUEQ_DISABLE_AOT_TUNING"] = "1"
+
+# Set hyperparameters
+C_S = 384
+C_Z = 128
+BATCH_SIZE = 1
+INFERENCE = False
+SEQ_LEN = [128, 256, 384, 512, 768]
+PRECISION = torch.bfloat16
+COMPILE = False
+device = "cuda:0"
+torch.set_grad_enabled(not INFERENCE)
+
+# Preload modules
+model = PairformerLayer(C_S, C_Z, v2=True)
+model.cuda()
+if COMPILE:
+    model = torch.compile(model, fullgraph=True, dynamic=False)
+
+if INFERENCE:
+    model.eval()
+
+
+def fwd(
+    model,
+    s,
+    z,
+    mask,
+    pair_mask,
+    use_cuequiv_mul=False,
+    use_cuequiv_attn=False,
+):
+    model(
+        s,
+        z,
+        mask,
+        pair_mask,
+        use_cuequiv_mul=use_cuequiv_mul,
+        use_cuequiv_attn=use_cuequiv_attn,
+    )
+
+
+def backward(
+    model,
+    s,
+    z,
+    mask,
+    pair_mask,
+    use_cuequiv_mul=False,
+    use_cuequiv_attn=False,
+):
+    s, z = model(
+        s,
+        z,
+        mask,
+        pair_mask,
+        use_cuequiv_mul=use_cuequiv_mul,
+        use_cuequiv_attn=use_cuequiv_attn,
+    )
+    (s.sum() + z.sum()).backward()
+
+
+def speed(func, its=10, warmup=10):
+    for _ in range(warmup):
+        func()
+    torch.cuda.synchronize()
+    start = time.time()
+    for _ in range(its):
+        func()
+    torch.cuda.synchronize()
+    time_a = time.time() - start
+    time_a /= its
+    return time_a
+
+
+# Full model
+@triton.testing.perf_report(
+    triton.testing.Benchmark(
+        x_names=["size"],
+        x_vals=SEQ_LEN,
+        line_arg="provider",  # Argument name whose value corresponds to a different line in the plot.
+        line_vals=[
+            "Default",
+            "TriAttn",
+            "Trimul",
+            "TriAttn+Trimul",
+        ],  # Possible values for `line_arg`.
+        line_names=[
+            "Default",
+            "TriAttn",
+            "Trimul",
+            "TriAttn+Trimul",
+        ],  # Label name for the lines.
+        plot_name="performance",  # Name for the plot. Used also as a file name for saving the plot.
+        args={},  # Values for function arguments not in `x_names` and `y_name`.
+    )
+)
+def benchmark(size, provider):
+    clear_memory(device)
+
+    # Now run the benchmark
+    s = torch.randn(
+        (BATCH_SIZE, size, C_S),
+        device=device,
+        dtype=PRECISION,
+        requires_grad=False,
+    )
+    z = torch.randn(
+        (BATCH_SIZE, size, size, C_Z),
+        device=device,
+        dtype=PRECISION,
+        requires_grad=False,
+    )
+    mask = torch.ones(
+        (BATCH_SIZE, size),
+        device=device,
+        dtype=PRECISION,
+        requires_grad=False,
+    ).float()
+    pair_mask = torch.ones(
+        (BATCH_SIZE, size, size),
+        device=device,
+        dtype=PRECISION,
+        requires_grad=False,
+    ).float()
+
+    with torch.autocast("cuda", dtype=PRECISION):
+        fn = fwd if INFERENCE else backward
+        if provider == "Default":
+            ms = speed(
+                lambda: fn(
+                    model,
+                    s,
+                    z,
+                    mask,
+                    pair_mask,
+                    use_cuequiv_mul=False,
+                    use_cuequiv_attn=False,
+                )
+            )
+        elif provider == "TriAttn":
+            ms = speed(
+                lambda: fn(
+                    model,
+                    s,
+                    z,
+                    mask,
+                    pair_mask,
+                    use_cuequiv_attn=True,
+                    use_cuequiv_mul=False,
+                )
+            )
+        elif provider == "Trimul":
+            ms = speed(
+                lambda: fn(
+                    model,
+                    s,
+                    z,
+                    mask,
+                    pair_mask,
+                    use_cuequiv_attn=False,
+                    use_cuequiv_mul=True,
+                )
+            )
+        elif provider == "TriAttn+Trimul":
+            ms = speed(
+                lambda: fn(
+                    model,
+                    s,
+                    z,
+                    mask,
+                    pair_mask,
+                    use_cuequiv_attn=True,
+                    use_cuequiv_mul=True,
+                )
+            )
+
+    # Compute throughput in sequences per second
+    return ms / BATCH_SIZE
+
+
+print("Speed")
+benchmark.run(print_data=True, show_plots=False)
+
+start_mem = current_memory(device)
+
+df = []
+for size in SEQ_LEN:
+    print(size)
+    s = torch.randn(
+        (BATCH_SIZE, size, C_S),
+        device=device,
+        dtype=PRECISION,
+        requires_grad=False,
+    )
+    z = torch.randn(
+        (BATCH_SIZE, size, size, C_Z),
+        device=device,
+        dtype=PRECISION,
+        requires_grad=False,
+    )
+    mask = torch.ones(
+        (BATCH_SIZE, size),
+        device=device,
+        dtype=PRECISION,
+        requires_grad=False,
+    ).float()
+    pair_mask = torch.ones(
+        (BATCH_SIZE, size, size),
+        device=device,
+        dtype=PRECISION,
+        requires_grad=False,
+    ).float()
+
+    with torch.autocast("cuda", dtype=PRECISION):
+        memory_default = memory_measure(
+            lambda: fwd(
+                model,
+                s,
+                z,
+                mask,
+                pair_mask,
+                use_cuequiv_mul=False,
+                use_cuequiv_attn=False,
+            ),
+            device=device,
+        )
+        memory_attn = memory_measure(
+            lambda: fwd(
+                model,
+                s,
+                z,
+                mask,
+                pair_mask,
+                use_cuequiv_mul=False,
+                use_cuequiv_attn=True,
+            ),
+            device=device,
+        )
+        memory_mul = memory_measure(
+            lambda: fwd(
+                model,
+                s,
+                z,
+                mask,
+                pair_mask,
+                use_cuequiv_mul=True,
+                use_cuequiv_attn=False,
+            ),
+            device=device,
+        )
+        memory_flash = memory_measure(
+            lambda: fwd(
+                model,
+                s,
+                z,
+                mask,
+                pair_mask,
+                use_cuequiv_mul=True,
+                use_cuequiv_attn=True,
+            ),
+            device=device,
+        )
+        df.append(
+            {
+                "size": size,
+                "Default": memory_default - start_mem,
+                "TriAttn": memory_attn - start_mem,
+                "Trimul": memory_mul - start_mem,
+                "TriAttn+Trimul": memory_flash - start_mem,
+            }
+        )
+
+df = pd.DataFrame(df)
+print("Memory")
+print(df)
diff --git a/forks/boltz/tests/test_regression.py b/forks/boltz/tests/test_regression.py
new file mode 100644
index 00000000..5478a47f
--- /dev/null
+++ b/forks/boltz/tests/test_regression.py
@@ -0,0 +1,113 @@
+import os
+import pickle
+from dataclasses import asdict
+import pprint
+
+import torch
+import torch.nn as nn
+
+import pytest
+import unittest
+
+from lightning_fabric import seed_everything
+
+from boltz.main import MODEL_URL
+from boltz.model.model import Boltz1
+
+import test_utils
+
+tests_dir = os.path.dirname(os.path.abspath(__file__))
+test_data_dir = os.path.join(tests_dir, "data")
+
+
+@pytest.mark.regression
+class RegressionTester(unittest.TestCase):
+    @classmethod
+    def setUpClass(cls):
+        device = torch.device("cuda" if torch.cuda.is_available() else "cpu")
+        cache = os.path.expanduser("~/.boltz")
+        checkpoint_url = MODEL_URL
+        model_name = checkpoint_url.split("/")[-1]
+        checkpoint = os.path.join(cache, model_name)
+        if not os.path.exists(checkpoint):
+            test_utils.download_file(checkpoint_url, checkpoint)
+
+        regression_feats_path = os.path.join(
+            test_data_dir, "ligand_regression_feats.pkl"
+        )
+        if not os.path.exists(regression_feats_path):
+            regression_feats_url = "https://www.dropbox.com/scl/fi/1avbcvoor5jcnvpt07tp6/ligand_regression_feats.pkl?rlkey=iwtm9gpxgrbp51jbizq937pqf&st=jnbky253&dl=1"
+            test_utils.download_file(regression_feats_url, regression_feats_path)
+
+        regression_feats = torch.load(regression_feats_path, map_location=device)
+        model_module: nn.Module = Boltz1.load_from_checkpoint(
+            checkpoint, map_location=device
+        )
+        model_module.to(device)
+        model_module.eval()
+
+        coords = regression_feats["feats"]["coords"]
+        # Coords should be rank 4
+        if len(coords.shape) == 3:
+            coords = coords.unsqueeze(0)
+        regression_feats["feats"]["coords"] = coords
+        for key, val in regression_feats["feats"].items():
+            if hasattr(val, "to"):
+                regression_feats["feats"][key] = val.to(device)
+
+        cls.model_module = model_module.to(device)
+        cls.regression_feats = regression_feats
+
+    def test_input_embedder(self):
+        exp_s_inputs = self.regression_feats["s_inputs"]
+        act_s_inputs = self.model_module.input_embedder(self.regression_feats["feats"])
+
+        assert torch.allclose(exp_s_inputs, act_s_inputs, atol=1e-5)
+
+    def test_rel_pos(self):
+        exp_rel_pos_encoding = self.regression_feats["relative_position_encoding"]
+        act_rel_pos_encoding = self.model_module.rel_pos(self.regression_feats["feats"])
+
+        assert torch.allclose(exp_rel_pos_encoding, act_rel_pos_encoding, atol=1e-5)
+
+    @pytest.mark.slow
+    def test_structure_output(self):
+        exp_structure_output = self.regression_feats["structure_output"]
+        s = self.regression_feats["s"]
+        z = self.regression_feats["z"]
+        s_inputs = self.regression_feats["s_inputs"]
+        feats = self.regression_feats["feats"]
+        relative_position_encoding = self.regression_feats["relative_position_encoding"]
+        multiplicity_diffusion_train = self.regression_feats[
+            "multiplicity_diffusion_train"
+        ]
+
+        self.model_module.structure_module.coordinate_augmentation = False
+        self.model_module.structure_module.sigma_data = 0.0
+
+        seed_everything(self.regression_feats["seed"])
+        act_structure_output = self.model_module.structure_module(
+            s_trunk=s,
+            z_trunk=z,
+            s_inputs=s_inputs,
+            feats=feats,
+            relative_position_encoding=relative_position_encoding,
+            multiplicity=multiplicity_diffusion_train,
+        )
+
+        act_keys = act_structure_output.keys()
+        exp_keys = exp_structure_output.keys()
+        assert act_keys == exp_keys
+
+        # Other keys have some randomness, so we will only check the keys that
+        # we can make deterministic with sigma_data = 0.0 (above).
+        check_keys = ["noised_atom_coords", "aligned_true_atom_coords"]
+        for key in check_keys:
+            exp_val = exp_structure_output[key]
+            act_val = act_structure_output[key]
+            assert exp_val.shape == act_val.shape, f"Shape mismatch in {key}"
+            assert torch.allclose(exp_val, act_val, atol=1e-4)
+
+
+if __name__ == "__main__":
+    unittest.main()
diff --git a/forks/boltz/tests/test_utils.py b/forks/boltz/tests/test_utils.py
new file mode 100644
index 00000000..ca677b36
--- /dev/null
+++ b/forks/boltz/tests/test_utils.py
@@ -0,0 +1,22 @@
+import os
+
+import requests
+
+
+def download_file(url, filepath, verbose=True):
+    if verbose:
+        print(f"Downloading {url} to {filepath}")
+    response = requests.get(url)
+
+    target_dir = os.path.dirname(filepath)
+    if target_dir and not os.path.exists(target_dir):
+        os.makedirs(target_dir)
+
+    # Check if the request was successful
+    if response.status_code == 200:
+        with open(filepath, "wb") as file:
+            file.write(response.content)
+    else:
+        print(f"Failed to download file. Status code: {response.status_code}")
+
+    return filepath
diff --git a/notebooks/astex_diverse_inference_results_plotting.ipynb b/notebooks/astex_diverse_inference_results_plotting.ipynb
index 97e8e601..4e296a83 100644
--- a/notebooks/astex_diverse_inference_results_plotting.ipynb
+++ b/notebooks/astex_diverse_inference_results_plotting.ipynb
@@ -68,6 +68,8 @@
     "    \"rfaa\",\n",
     "    \"chai-lab_ss\",\n",
     "    \"chai-lab\",\n",
+    "    \"boltz_ss\",\n",
+    "    \"boltz\",\n",
     "    \"alphafold3_ss\",\n",
     "    \"alphafold3\",\n",
     "]\n",
@@ -82,6 +84,7 @@
     "globals()[\"neuralplexer_output_dir\"] = os.path.join(\"..\", \"forks\", \"NeuralPLexer\", \"inference\")\n",
     "globals()[\"rfaa_output_dir\"] = os.path.join(\"..\", \"forks\", \"RoseTTAFold-All-Atom\", \"inference\")\n",
     "globals()[\"chai-lab_output_dir\"] = os.path.join(\"..\", \"forks\", \"chai-lab\", \"inference\")\n",
+    "globals()[\"boltz_output_dir\"] = os.path.join(\"..\", \"forks\", \"boltz\", \"inference\")\n",
     "globals()[\"alphafold3_output_dir\"] = os.path.join(\"..\", \"forks\", \"alphafold3\", \"inference\")\n",
     "for repeat_index in range(1, max_num_repeats_per_method + 1):\n",
     "    # PLIF metrics\n",
@@ -179,6 +182,30 @@
     "        \"bust_results.csv\",\n",
     "    )\n",
     "\n",
+    "    # Boltz (Single-Seq) results\n",
+    "    globals()[f\"boltz_ss_astex_bust_results_csv_filepath_{repeat_index}\"] = os.path.join(\n",
+    "        globals()[\"boltz_output_dir\"],\n",
+    "        f\"boltz_ss_astex_diverse_outputs_{repeat_index}\",\n",
+    "        \"bust_results.csv\",\n",
+    "    )\n",
+    "    globals()[f\"boltz_ss_astex_relaxed_bust_results_csv_filepath_{repeat_index}\"] = os.path.join(\n",
+    "        globals()[\"boltz_output_dir\"],\n",
+    "        f\"boltz_ss_astex_diverse_outputs_{repeat_index}_relaxed\",\n",
+    "        \"bust_results.csv\",\n",
+    "    )\n",
+    "\n",
+    "    # Boltz results\n",
+    "    globals()[f\"boltz_astex_bust_results_csv_filepath_{repeat_index}\"] = os.path.join(\n",
+    "        globals()[\"boltz_output_dir\"],\n",
+    "        f\"boltz_astex_diverse_outputs_{repeat_index}\",\n",
+    "        \"bust_results.csv\",\n",
+    "    )\n",
+    "    globals()[f\"boltz_astex_relaxed_bust_results_csv_filepath_{repeat_index}\"] = os.path.join(\n",
+    "        globals()[\"boltz_output_dir\"],\n",
+    "        f\"boltz_astex_diverse_outputs_{repeat_index}_relaxed\",\n",
+    "        \"bust_results.csv\",\n",
+    "    )\n",
+    "\n",
     "    # AlphaFold 3 (Single-Seq) results\n",
     "    globals()[f\"alphafold3_ss_astex_bust_results_csv_filepath_{repeat_index}\"] = os.path.join(\n",
     "        globals()[\"alphafold3_output_dir\"],\n",
@@ -214,6 +241,8 @@
     "    \"rfaa\": \"RFAA\",\n",
     "    \"chai-lab_ss\": \"Chai-1-Single-Seq\",\n",
     "    \"chai-lab\": \"Chai-1\",\n",
+    "    \"boltz_ss\": \"Boltz-1-Single-Seq\",\n",
+    "    \"boltz\": \"Boltz-1\",\n",
     "    \"alphafold3_ss\": \"AF3-Single-Seq\",\n",
     "    \"alphafold3\": \"AF3\",\n",
     "}\n",
@@ -226,6 +255,8 @@
     "    \"rfaa\": \"DL-based blind\",\n",
     "    \"chai-lab_ss\": \"DL-based blind\",\n",
     "    \"chai-lab\": \"DL-based blind\",\n",
+    "    \"boltz_ss\": \"DL-based blind\",\n",
+    "    \"boltz\": \"DL-based blind\",\n",
     "    \"alphafold3_ss\": \"DL-based blind\",\n",
     "    \"alphafold3\": \"DL-based blind\",\n",
     "}"
@@ -505,7 +536,7 @@
     "colors = [\"#AB8042\", \"#FB8072\", \"#BEBADA\", \"#FCCDE5\"]\n",
     "\n",
     "bar_width = 0.5\n",
-    "r1 = [item - 0.5 for item in range(2, 20, 2)]\n",
+    "r1 = [item - 0.5 for item in range(2, 24, 2)]\n",
     "r2 = [x + bar_width for x in r1]\n",
     "r3 = [x + bar_width for x in r2]\n",
     "\n",
@@ -883,7 +914,7 @@
     "\n",
     "# add labels, titles, ticks, etc.\n",
     "axis.set_ylabel(\"Percentage of predictions\")\n",
-    "axis.set_xlim(1, 19 + 0.1)\n",
+    "axis.set_xlim(1, 23 + 0.1)\n",
     "axis.set_ylim(0, 150)\n",
     "\n",
     "assert all(\n",
@@ -1018,7 +1049,7 @@
     "axis.grid(axis=\"y\", color=\"#EAEFF8\")\n",
     "axis.set_axisbelow(True)\n",
     "\n",
-    "axis.set_xticks([2, 2 + 1e-3, 4, 6, 8, 10, 11, 12, 14, 16, 18])\n",
+    "axis.set_xticks([2, 2 + 1e-3, 4, 6, 8, 10, 12, 13, 14, 16, 18, 20, 22])\n",
     "axis.set_xticks([1 + 0.1], minor=True)\n",
     "axis.set_xticklabels(\n",
     "    [\n",
@@ -1028,9 +1059,11 @@
     "        \"DynamicBind\",\n",
     "        \"NeuralPLexer\",\n",
     "        \"RFAA\",\n",
-    "        \"DL-based blind\",\n",
     "        \"Chai-1-Single-Seq\",\n",
+    "        \"DL-based blind\",\n",
     "        \"Chai-1\",\n",
+    "        \"Boltz-1-Single-Seq\",\n",
+    "        \"Boltz-1\",\n",
     "        \"AF3-Single-Seq\",\n",
     "        \"AF3\",\n",
     "    ]\n",
@@ -1044,7 +1077,7 @@
     "axis.tick_params(axis=\"y\", which=\"major\", left=\"off\", right=\"on\", color=\"#EAEFF8\")\n",
     "\n",
     "# vertical alignment of xtick labels\n",
-    "vert_alignments = [0.0, -0.1, 0.0, 0.0, 0.0, 0.0, -0.1, 0.0, 0.0, 0.0, 0.0]\n",
+    "vert_alignments = [0.0, -0.1, 0.0, 0.0, 0.0, 0.0, 0.0, -0.1, 0.0, 0.0, 0.0, 0.0, 0.0]\n",
     "for tick, y in zip(axis.get_xticklabels(), vert_alignments):\n",
     "    tick.set_y(y)\n",
     "\n",
diff --git a/notebooks/astex_diverse_method_interaction_analysis.png b/notebooks/astex_diverse_method_interaction_analysis.png
new file mode 100644
index 00000000..56b4fdb1
Binary files /dev/null and b/notebooks/astex_diverse_method_interaction_analysis.png differ
diff --git a/notebooks/astex_diverse_plif_emd_values.png b/notebooks/astex_diverse_plif_emd_values.png
new file mode 100644
index 00000000..e85f8125
Binary files /dev/null and b/notebooks/astex_diverse_plif_emd_values.png differ
diff --git a/notebooks/astex_diverse_plif_metrics.csv b/notebooks/astex_diverse_plif_metrics.csv
new file mode 100644
index 00000000..6a2fef35
--- /dev/null
+++ b/notebooks/astex_diverse_plif_metrics.csv
@@ -0,0 +1,936 @@
+,Category,Target,EMD,WM,Method_Histogram,Reference_Histogram
+0,P2Rank-Vina,2BM2_PM2,0.22727272727272724,0.9090909090909091,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}","{'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+1,P2Rank-Vina,1XOQ_ROF,,0.0,,
+2,P2Rank-Vina,1M2Z_DEX,,0.0,,
+3,P2Rank-Vina,1P62_GEO,0.5333333333333332,0.7866666666666667,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+4,P2Rank-Vina,1KE5_LS1,0.7647058823529411,0.6941176470588235,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+5,P2Rank-Vina,1TT1_KAI,0.375,0.85,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+6,P2Rank-Vina,1VCJ_IBA,0.875,0.65,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 5, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 4, 'UNL:ILE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+7,P2Rank-Vina,1HWI_115,0.52,0.792,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 3, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+8,P2Rank-Vina,1UML_FR4,0.21052631578947362,0.9157894736842106,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2}","{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+9,P2Rank-Vina,1JLA_TNK,0.26086956521739124,0.8956521739130435,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+10,P2Rank-Vina,1N46_PFA,0.6785714285714286,0.7285714285714285,"{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+11,P2Rank-Vina,1LRH_NLA,,0.0,,
+12,P2Rank-Vina,1KZK_JE2,,0.0,,
+13,P2Rank-Vina,1N2J_PAF,,0.0,,
+14,P2Rank-Vina,1MEH_MOA,0.6666666666666667,0.7333333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 7, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2}"
+15,P2Rank-Vina,2BSM_BSM,0.3181818181818181,0.8727272727272728,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+16,P2Rank-Vina,1V48_HA1,0.5714285714285714,0.7714285714285715,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+17,P2Rank-Vina,1L7F_BCZ,,0.0,,
+18,P2Rank-Vina,1JD0_AZM,0.10526315789473684,0.9578947368421052,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+19,P2Rank-Vina,1S19_MC9,0.17391304347826075,0.9304347826086957,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 6, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+20,P2Rank-Vina,1LPZ_CMB,0.2,0.92,"{'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+21,P2Rank-Vina,1X8X_TYR,0.5000000000000001,0.7999999999999999,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+22,P2Rank-Vina,1T46_STI,0.5714285714285713,0.7714285714285715,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 4}"
+23,P2Rank-Vina,1IG3_VIB,0.375,0.85,"{'UNL:GLN:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1}"
+24,P2Rank-Vina,1SQ5_PAU,0.16666666666666669,0.9333333333333333,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+25,P2Rank-Vina,1Q4G_BFL,,0.0,,
+26,P2Rank-Vina,1OYT_FSN,,0.0,,
+27,P2Rank-Vina,1UNL_RRC,0.380952380952381,0.8476190476190476,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+28,P2Rank-Vina,1U1C_BAU,0.44444444444444436,0.8222222222222222,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+29,P2Rank-Vina,1K3U_IAD,,0.0,,
+30,P2Rank-Vina,1G9V_RQ3,,0.0,,
+31,P2Rank-Vina,1YV3_BIT,,0.0,,
+32,P2Rank-Vina,1IA1_TQ3,,0.0,,
+33,P2Rank-Vina,1Q1G_MTI,,0.0,,
+34,P2Rank-Vina,1R1H_BIR,0.523809523809524,0.7904761904761904,"{'UNL:ASN:Hydrophobic': 3, 'UNL:ASN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+35,P2Rank-Vina,1YVF_PH7,,0.0,,
+36,P2Rank-Vina,1YQY_915,0.23076923076923078,0.9076923076923077,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+37,P2Rank-Vina,1HWW_SWA,0.26315789473684215,0.8947368421052632,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+38,P2Rank-Vina,1T40_ID5,,0.0,,
+39,P2Rank-Vina,1GKC_NFH,,0.0,,
+40,P2Rank-Vina,1N1M_A3M,,0.0,,
+41,P2Rank-Vina,1Z95_198,0.2631578947368421,0.8947368421052632,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 5, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+42,P2Rank-Vina,1HP0_AD3,0.5384615384615385,0.7846153846153846,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2}","{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+43,P2Rank-Vina,1OF1_SCT,0.380952380952381,0.8476190476190476,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+44,P2Rank-Vina,1SJ0_E4D,0.2962962962962962,0.8814814814814815,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 5, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+45,P2Rank-Vina,1U4D_DBQ,0.30769230769230765,0.8769230769230769,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+46,P2Rank-Vina,1Q41_IXM,0.1578947368421052,0.9368421052631579,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+47,P2Rank-Vina,1OWE_675,0.3571428571428572,0.8571428571428571,"{'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+48,P2Rank-Vina,1OQ5_CEL,0.29999999999999993,0.88,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+49,P2Rank-Vina,1SG0_STL,,0.0,,
+50,P2Rank-Vina,2BR1_PFP,0.1764705882352941,0.9294117647058824,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+51,P2Rank-Vina,1UOU_CMU,0.4444444444444444,0.8222222222222222,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+52,P2Rank-Vina,1TZ8_DES,,0.0,,
+53,P2Rank-Vina,1R9O_FLP,,0.0,,
+54,P2Rank-Vina,1P2Y_NCT,,0.0,,
+55,P2Rank-Vina,1V0P_PVB,0.21052631578947367,0.9157894736842105,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+56,P2Rank-Vina,1XOZ_CIA,0.3999999999999999,0.8400000000000001,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+57,P2Rank-Vina,1R55_097,,0.0,,
+58,P2Rank-Vina,1YWR_LI9,0.42857142857142866,0.8285714285714285,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+59,P2Rank-Vina,1HQ2_PH2,,0.0,,
+60,P2Rank-Vina,1MZC_BNE,,0.0,,
+61,P2Rank-Vina,1V4S_MRK,,0.0,,
+62,P2Rank-Vina,1NAV_IH5,0.0625,0.975,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+63,P2Rank-Vina,1JJE_BYS,,0.0,,
+64,P2Rank-Vina,1GM8_SOX,0.1875,0.925,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 2}"
+65,P2Rank-Vina,1J3J_CP6,,0.0,,
+66,P2Rank-Vina,1T9B_1CS,,0.0,,
+67,P2Rank-Vina,1PMN_984,,0.0,,
+68,P2Rank-Vina,1N2V_BDI,0.125,0.95,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+69,P2Rank-Vina,1GPK_HUP,0.5,0.8,"{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+70,P2Rank-Vina,1W1P_GIO,,0.0,,
+71,P2Rank-Vina,1OF6_DTY,,0.0,,
+72,P2Rank-Vina,1S3V_TQD,0.33333333333333337,0.8666666666666667,"{'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+73,P2Rank-Vina,1Y6B_AAX,0.5294117647058822,0.7882352941176471,"{'UNL:ALA:Hydrophobic': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+74,P2Rank-Vina,1L2S_STC,0.375,0.85,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 1}"
+75,P2Rank-Vina,1W2G_THM,0.5,0.8,"{'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}"
+76,P2Rank-Vina,1TOW_CRZ,0.16666666666666669,0.9333333333333333,"{'UNL:ALA:Hydrophobic': 3, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+77,P2Rank-Vina,1XM6_5RM,0.2222222222222223,0.9111111111111111,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+78,P2Rank-Vina,1YGC_905,0.42105263157894746,0.831578947368421,"{'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+79,P2Rank-Vina,1R58_AO5,0.09090909090909088,0.9636363636363636,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+80,P2Rank-Vina,1HNN_SKF,0.1875,0.925,"{'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:VdWContact': 1}"
+81,P2Rank-Vina,1HVY_D16,0.2962962962962963,0.8814814814814815,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:UMP:Hydrophobic': 1, 'UNL:UMP:VdWContact': 1}"
+82,P2Rank-Vina,1OPK_P16,0.65,0.74,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+83,P2Rank-Vina,1MMV_3AR,,0.0,,
+84,P2Rank-Vina,1SQN_NDR,0.1875,0.925,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+85,DiffDock-L,2BM2_PM2,0.29411764705882354,0.8823529411764706,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+86,DiffDock-L,1XOQ_ROF,0.35294117647058826,0.8588235294117648,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+87,DiffDock-L,1M2Z_DEX,0.26086956521739135,0.8956521739130434,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 4, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+88,DiffDock-L,1P62_GEO,0.35294117647058826,0.8588235294117648,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+89,DiffDock-L,1KE5_LS1,0.09999999999999999,0.96,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+90,DiffDock-L,1TT1_KAI,0.6666666666666666,0.7333333333333334,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+91,DiffDock-L,1VCJ_IBA,0.23529411764705885,0.9058823529411765,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 4, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 5, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 4, 'UNL:ILE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+92,DiffDock-L,1HWI_115,0.08333333333333337,0.9666666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 3, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+93,DiffDock-L,1UML_FR4,0.6315789473684211,0.7473684210526316,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 4, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+94,DiffDock-L,1JLA_TNK,0.368421052631579,0.8526315789473684,"{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 3, 'UNL:PRO:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+95,DiffDock-L,1N46_PFA,0.09523809523809518,0.9619047619047619,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+96,DiffDock-L,1LRH_NLA,0.06666666666666667,0.9733333333333334,"{'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1}","{'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1}"
+97,DiffDock-L,1KZK_JE2,0.8,0.6799999999999999,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 3, 'UNL:ASP:VdWContact': 4, 'UNL:GLY:HBDonor': 2, 'UNL:GLY:VdWContact': 4, 'UNL:ILE:Hydrophobic': 5, 'UNL:ILE:VdWContact': 4, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:Hydrophobic': 3, 'UNL:ASP:VdWContact': 4, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 6, 'UNL:LEU:Hydrophobic': 3, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4}"
+98,DiffDock-L,1N2J_PAF,0.22222222222222227,0.9111111111111111,"{'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+99,DiffDock-L,1MEH_MOA,0.4210526315789474,0.831578947368421,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2}"
+100,DiffDock-L,2BSM_BSM,0.04999999999999999,0.98,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+101,DiffDock-L,1V48_HA1,0.14999999999999997,0.9400000000000001,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+102,DiffDock-L,1L7F_BCZ,0.3125,0.875,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 6, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+103,DiffDock-L,1JD0_AZM,0.1,0.96,"{'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+104,DiffDock-L,1S19_MC9,0.0869565217391304,0.9652173913043478,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 6, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+105,DiffDock-L,1LPZ_CMB,0.052631578947368474,0.9789473684210526,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+106,DiffDock-L,1X8X_TYR,0.3333333333333333,0.8666666666666667,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+107,DiffDock-L,1T46_STI,0.2692307692307692,0.8923076923076924,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 4}"
+108,DiffDock-L,1IG3_VIB,0.3157894736842106,0.8736842105263157,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 4, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1}"
+109,DiffDock-L,1SQ5_PAU,0.2666666666666666,0.8933333333333333,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+110,DiffDock-L,1Q4G_BFL,,0.0,,
+111,DiffDock-L,1OYT_FSN,0.17647058823529413,0.9294117647058824,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+112,DiffDock-L,1UNL_RRC,0.10526315789473684,0.9578947368421052,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+113,DiffDock-L,1U1C_BAU,0.23529411764705882,0.9058823529411765,"{'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+114,DiffDock-L,1K3U_IAD,0.6818181818181818,0.7272727272727273,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 4, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+115,DiffDock-L,1G9V_RQ3,,0.0,,
+116,DiffDock-L,1YV3_BIT,,0.0,,
+117,DiffDock-L,1IA1_TQ3,0.47058823529411775,0.8117647058823529,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1}"
+118,DiffDock-L,1Q1G_MTI,0.0869565217391304,0.9652173913043478,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+119,DiffDock-L,1R1H_BIR,0.42105263157894746,0.831578947368421,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+120,DiffDock-L,1YVF_PH7,0.04166666666666663,0.9833333333333334,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+121,DiffDock-L,1YQY_915,0.23809523809523808,0.9047619047619048,"{'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+122,DiffDock-L,1HWW_SWA,0.07692307692307698,0.9692307692307692,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 3, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+123,DiffDock-L,1T40_ID5,0.7894736842105263,0.6842105263157895,"{'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+124,DiffDock-L,1GKC_NFH,,0.0,,
+125,DiffDock-L,1N1M_A3M,0.2,0.92,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 2}"
+126,DiffDock-L,1Z95_198,0.1875,0.925,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 4, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+127,DiffDock-L,1HP0_AD3,0.1818181818181818,0.9272727272727272,"{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+128,DiffDock-L,1OF1_SCT,0.052631578947368474,0.9789473684210526,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
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+132,DiffDock-L,1OWE_675,0.24999999999999992,0.9,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+133,DiffDock-L,1OQ5_CEL,0.22222222222222215,0.9111111111111111,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
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+136,DiffDock-L,1UOU_CMU,0.4000000000000001,0.84,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+137,DiffDock-L,1TZ8_DES,0.45454545454545453,0.8181818181818181,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 2}"
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+144,DiffDock-L,1HQ2_PH2,0.11764705882352942,0.9529411764705882,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
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+146,DiffDock-L,1V4S_MRK,0.22222222222222227,0.9111111111111111,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3}"
+147,DiffDock-L,1NAV_IH5,0.0625,0.975,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+148,DiffDock-L,1JJE_BYS,0.4210526315789474,0.831578947368421,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 3, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+149,DiffDock-L,1GM8_SOX,0.14285714285714282,0.9428571428571428,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 2}"
+150,DiffDock-L,1J3J_CP6,0.29411764705882354,0.8823529411764706,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}"
+151,DiffDock-L,1T9B_1CS,,0.0,,
+152,DiffDock-L,1PMN_984,,0.0,,
+153,DiffDock-L,1N2V_BDI,0.08333333333333326,0.9666666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+154,DiffDock-L,1GPK_HUP,0.29999999999999993,0.88,"{'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+155,DiffDock-L,1W1P_GIO,0.16666666666666657,0.9333333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+156,DiffDock-L,1OF6_DTY,,0.0,,
+157,DiffDock-L,1S3V_TQD,0.3571428571428572,0.8571428571428571,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+158,DiffDock-L,1Y6B_AAX,0.3529411764705882,0.8588235294117648,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+159,DiffDock-L,1L2S_STC,0.13333333333333336,0.9466666666666667,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 1}"
+160,DiffDock-L,1W2G_THM,0.2857142857142857,0.8857142857142857,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}"
+161,DiffDock-L,1TOW_CRZ,0.23529411764705885,0.9058823529411765,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+162,DiffDock-L,1XM6_5RM,0.2666666666666667,0.8933333333333333,"{'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+163,DiffDock-L,1YGC_905,0.17647058823529416,0.9294117647058824,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+164,DiffDock-L,1R58_AO5,0.05882352941176472,0.9764705882352941,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+165,DiffDock-L,1HNN_SKF,0.19999999999999996,0.92,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:VdWContact': 1}"
+166,DiffDock-L,1HVY_D16,0.5499999999999999,0.78,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:UMP:Hydrophobic': 1, 'UNL:UMP:VdWContact': 1}"
+167,DiffDock-L,1OPK_P16,0.19047619047619047,0.9238095238095239,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+168,DiffDock-L,1MMV_3AR,,0.0,,
+169,DiffDock-L,1SQN_NDR,0.25,0.9,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+170,DynamicBind,2BM2_PM2,,0.0,,
+171,DynamicBind,1XOQ_ROF,,0.0,,
+172,DynamicBind,1M2Z_DEX,0.2083333333333334,0.9166666666666666,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 4, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+173,DynamicBind,1P62_GEO,0.06666666666666665,0.9733333333333334,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+174,DynamicBind,1KE5_LS1,0.26315789473684204,0.8947368421052632,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+175,DynamicBind,1TT1_KAI,0.5,0.8,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+176,DynamicBind,1VCJ_IBA,,0.0,,
+177,DynamicBind,1HWI_115,0.25925925925925924,0.8962962962962963,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 3, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+178,DynamicBind,1UML_FR4,0.33333333333333337,0.8666666666666667,"{'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+179,DynamicBind,1JLA_TNK,0.05555555555555558,0.9777777777777777,"{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+180,DynamicBind,1N46_PFA,0.26086956521739135,0.8956521739130434,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+181,DynamicBind,1LRH_NLA,,0.0,,
+182,DynamicBind,1KZK_JE2,,0.0,,
+183,DynamicBind,1N2J_PAF,,0.0,,
+184,DynamicBind,1MEH_MOA,0.14285714285714288,0.9428571428571428,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2}"
+185,DynamicBind,2BSM_BSM,0.047619047619047616,0.9809523809523809,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+186,DynamicBind,1V48_HA1,0.1428571428571428,0.9428571428571428,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+187,DynamicBind,1L7F_BCZ,0.4444444444444445,0.8222222222222222,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 6, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+188,DynamicBind,1JD0_AZM,0.29999999999999993,0.88,"{'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+189,DynamicBind,1S19_MC9,,0.0,,
+190,DynamicBind,1LPZ_CMB,0.10526315789473684,0.9578947368421052,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+191,DynamicBind,1X8X_TYR,,0.0,,
+192,DynamicBind,1T46_STI,0.3214285714285714,0.8714285714285714,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:Hydrophobic': 2, 'UNL:CYS:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 4}"
+193,DynamicBind,1IG3_VIB,0.2,0.92,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1}"
+194,DynamicBind,1SQ5_PAU,,0.0,,
+195,DynamicBind,1Q4G_BFL,,0.0,,
+196,DynamicBind,1OYT_FSN,0.11764705882352942,0.9529411764705882,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+197,DynamicBind,1UNL_RRC,,0.0,,
+198,DynamicBind,1U1C_BAU,,0.0,,
+199,DynamicBind,1K3U_IAD,0.5,0.8,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 4, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+200,DynamicBind,1G9V_RQ3,0.5,0.8,"{'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 4, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 1}"
+201,DynamicBind,1YV3_BIT,,0.0,,
+202,DynamicBind,1IA1_TQ3,0.4285714285714286,0.8285714285714285,"{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1}"
+203,DynamicBind,1Q1G_MTI,0.13636363636363638,0.9454545454545454,"{'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+204,DynamicBind,1R1H_BIR,0.35000000000000003,0.86,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+205,DynamicBind,1YVF_PH7,,0.0,,
+206,DynamicBind,1YQY_915,,0.0,,
+207,DynamicBind,1HWW_SWA,0.14285714285714282,0.9428571428571428,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 4, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+208,DynamicBind,1T40_ID5,0.3999999999999999,0.8400000000000001,"{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 4, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+209,DynamicBind,1GKC_NFH,0.29166666666666674,0.8833333333333333,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+210,DynamicBind,1N1M_A3M,,0.0,,
+211,DynamicBind,1Z95_198,,0.0,,
+212,DynamicBind,1HP0_AD3,0.21428571428571433,0.9142857142857143,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+213,DynamicBind,1OF1_SCT,0.22222222222222227,0.9111111111111111,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+214,DynamicBind,1SJ0_E4D,,0.0,,
+215,DynamicBind,1U4D_DBQ,0.39999999999999997,0.8400000000000001,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+216,DynamicBind,1Q41_IXM,0.11111111111111102,0.9555555555555556,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+217,DynamicBind,1OWE_675,0.0,1.0,"{'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+218,DynamicBind,1OQ5_CEL,0.28571428571428564,0.8857142857142858,"{'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+219,DynamicBind,1SG0_STL,,0.0,,
+220,DynamicBind,2BR1_PFP,,0.0,,
+221,DynamicBind,1UOU_CMU,0.5714285714285714,0.7714285714285715,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+222,DynamicBind,1TZ8_DES,,0.0,,
+223,DynamicBind,1R9O_FLP,,0.0,,
+224,DynamicBind,1P2Y_NCT,,0.0,,
+225,DynamicBind,1V0P_PVB,,0.0,,
+226,DynamicBind,1XOZ_CIA,,0.0,,
+227,DynamicBind,1R55_097,0.4375,0.825,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 4, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBDonor': 2, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+228,DynamicBind,1YWR_LI9,,0.0,,
+229,DynamicBind,1HQ2_PH2,0.2222222222222222,0.9111111111111111,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+230,DynamicBind,1MZC_BNE,0.7142857142857143,0.7142857142857143,"{'UNL:ALA:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 5, 'UNL:TYR:VdWContact': 4}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+231,DynamicBind,1V4S_MRK,,0.0,,
+232,DynamicBind,1NAV_IH5,0.0625,0.975,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+233,DynamicBind,1JJE_BYS,0.13636363636363635,0.9454545454545454,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 3, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+234,DynamicBind,1GM8_SOX,0.31578947368421056,0.8736842105263158,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 2}"
+235,DynamicBind,1J3J_CP6,,0.0,,
+236,DynamicBind,1T9B_1CS,,0.0,,
+237,DynamicBind,1PMN_984,0.411764705882353,0.8352941176470587,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+238,DynamicBind,1N2V_BDI,0.23076923076923078,0.9076923076923077,"{'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+239,DynamicBind,1GPK_HUP,0.19999999999999996,0.92,"{'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+240,DynamicBind,1W1P_GIO,,0.0,,
+241,DynamicBind,1OF6_DTY,,0.0,,
+242,DynamicBind,1S3V_TQD,,0.0,,
+243,DynamicBind,1Y6B_AAX,0.2500000000000001,0.8999999999999999,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+244,DynamicBind,1L2S_STC,0.1875,0.925,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 1}"
+245,DynamicBind,1W2G_THM,,0.0,,
+246,DynamicBind,1TOW_CRZ,0.11764705882352941,0.9529411764705882,"{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+247,DynamicBind,1XM6_5RM,,0.0,,
+248,DynamicBind,1YGC_905,0.15789473684210525,0.9368421052631579,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 3, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+249,DynamicBind,1R58_AO5,,0.0,,
+250,DynamicBind,1HNN_SKF,,0.0,,
+251,DynamicBind,1HVY_D16,0.7142857142857142,0.7142857142857143,"{'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:UMP:Hydrophobic': 1, 'UNL:UMP:VdWContact': 1}"
+252,DynamicBind,1OPK_P16,,0.0,,
+253,DynamicBind,1MMV_3AR,0.4642857142857143,0.8142857142857143,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+254,DynamicBind,1SQN_NDR,0.17647058823529413,0.9294117647058824,"{'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+255,NeuralPLexer,2BM2_PM2,0.6875,0.725,"{'UNL:ALA:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLN:Hydrophobic': 3, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2}","{'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+256,NeuralPLexer,1XOQ_ROF,0.35714285714285704,0.8571428571428572,"{'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+257,NeuralPLexer,1M2Z_DEX,0.5652173913043478,0.7739130434782608,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 4, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+258,NeuralPLexer,1P62_GEO,0.3333333333333333,0.8666666666666667,"{'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+259,NeuralPLexer,1KE5_LS1,0.36842105263157887,0.8526315789473684,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+260,NeuralPLexer,1TT1_KAI,0.4210526315789474,0.831578947368421,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+261,NeuralPLexer,1VCJ_IBA,0.2777777777777777,0.888888888888889,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 5, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 5, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 4, 'UNL:ILE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+262,NeuralPLexer,1HWI_115,0.4074074074074074,0.837037037037037,"{'UNL:ALA:Hydrophobic': 4, 'UNL:ALA:VdWContact': 3, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 3, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+263,NeuralPLexer,1UML_FR4,0.26666666666666666,0.8933333333333333,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 4, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+264,NeuralPLexer,1JLA_TNK,0.2500000000000001,0.8999999999999999,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+265,NeuralPLexer,1N46_PFA,0.4782608695652174,0.808695652173913,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+266,NeuralPLexer,1LRH_NLA,0.33333333333333337,0.8666666666666667,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1}"
+267,NeuralPLexer,1KZK_JE2,0.7857142857142857,0.6857142857142857,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 4, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:Hydrophobic': 3, 'UNL:ASP:VdWContact': 4, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 6, 'UNL:LEU:Hydrophobic': 3, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4}"
+268,NeuralPLexer,1N2J_PAF,0.5000000000000001,0.7999999999999999,"{'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+269,NeuralPLexer,1MEH_MOA,0.4210526315789474,0.831578947368421,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2}"
+270,NeuralPLexer,2BSM_BSM,0.08695652173913046,0.9652173913043478,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+271,NeuralPLexer,1V48_HA1,0.09090909090909097,0.9636363636363636,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+272,NeuralPLexer,1L7F_BCZ,0.44444444444444436,0.8222222222222222,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+273,NeuralPLexer,1JD0_AZM,0.4545454545454545,0.8181818181818182,"{'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+274,NeuralPLexer,1S19_MC9,0.26086956521739113,0.8956521739130435,"{'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 6, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+275,NeuralPLexer,1LPZ_CMB,0.35,0.86,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:Hydrophobic': 2, 'UNL:CYS:VdWContact': 2, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 3, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+276,NeuralPLexer,1X8X_TYR,0.49999999999999994,0.8,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+277,NeuralPLexer,1T46_STI,0.2962962962962963,0.8814814814814815,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 2, 'UNL:CYS:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 4}"
+278,NeuralPLexer,1IG3_VIB,0.2857142857142858,0.8857142857142857,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1}"
+279,NeuralPLexer,1SQ5_PAU,0.10000000000000003,0.96,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+280,NeuralPLexer,1Q4G_BFL,0.11764705882352944,0.9529411764705882,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
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+284,NeuralPLexer,1K3U_IAD,0.4193548387096773,0.832258064516129,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 4, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+285,NeuralPLexer,1G9V_RQ3,0.25000000000000006,0.9,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 1}"
+286,NeuralPLexer,1YV3_BIT,0.6086956521739131,0.7565217391304347,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+287,NeuralPLexer,1IA1_TQ3,0.38461538461538464,0.8461538461538461,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1}"
+288,NeuralPLexer,1Q1G_MTI,0.3333333333333333,0.8666666666666667,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 3}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+289,NeuralPLexer,1R1H_BIR,0.45000000000000007,0.82,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+290,NeuralPLexer,1YVF_PH7,0.30434782608695643,0.8782608695652174,"{'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+291,NeuralPLexer,1YQY_915,0.09090909090909088,0.9636363636363636,"{'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+292,NeuralPLexer,1HWW_SWA,0.1538461538461538,0.9384615384615385,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 4, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+293,NeuralPLexer,1T40_ID5,0.4,0.84,"{'UNL:CYS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+294,NeuralPLexer,1GKC_NFH,0.31818181818181823,0.8727272727272727,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+295,NeuralPLexer,1N1M_A3M,0.3125,0.875,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 2}"
+296,NeuralPLexer,1Z95_198,0.7333333333333334,0.7066666666666667,"{'UNL:ASN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 4, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+297,NeuralPLexer,1HP0_AD3,0.07142857142857142,0.9714285714285714,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2}","{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+298,NeuralPLexer,1OF1_SCT,0.368421052631579,0.8526315789473684,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
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+300,NeuralPLexer,1U4D_DBQ,0.6000000000000001,0.76,"{'UNL:ALA:Hydrophobic': 3, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBDonor': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 3}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+301,NeuralPLexer,1Q41_IXM,0.21052631578947373,0.9157894736842105,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+302,NeuralPLexer,1OWE_675,0.25,0.9,"{'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+303,NeuralPLexer,1OQ5_CEL,0.21052631578947373,0.9157894736842105,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+304,NeuralPLexer,1SG0_STL,0.6666666666666667,0.7333333333333333,"{'UNL:GLY:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+305,NeuralPLexer,2BR1_PFP,0.4375,0.825,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 3, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+306,NeuralPLexer,1UOU_CMU,0.5625,0.775,"{'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+307,NeuralPLexer,1TZ8_DES,1.3333333333333333,0.4666666666666667,"{'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 5}","{'UNL:ALA:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 2}"
+308,NeuralPLexer,1R9O_FLP,0.2631578947368422,0.8947368421052632,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+309,NeuralPLexer,1P2Y_NCT,0.08333333333333326,0.9666666666666667,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+310,NeuralPLexer,1V0P_PVB,0.16666666666666674,0.9333333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+311,NeuralPLexer,1XOZ_CIA,0.11764705882352933,0.9529411764705883,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+312,NeuralPLexer,1R55_097,0.4375,0.825,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBDonor': 2, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+313,NeuralPLexer,1YWR_LI9,0.55,0.78,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+314,NeuralPLexer,1HQ2_PH2,0.23529411764705882,0.9058823529411765,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+315,NeuralPLexer,1MZC_BNE,0.2857142857142856,0.8857142857142858,"{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 3, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
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+321,NeuralPLexer,1T9B_1CS,0.4375,0.825,"{'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+322,NeuralPLexer,1PMN_984,0.33333333333333326,0.8666666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
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+324,NeuralPLexer,1GPK_HUP,0.5555555555555556,0.7777777777777778,"{'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+325,NeuralPLexer,1W1P_GIO,0.8333333333333333,0.6666666666666667,"{'UNL:GLU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+326,NeuralPLexer,1OF6_DTY,,0.0,,
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+328,NeuralPLexer,1Y6B_AAX,0.09090909090909088,0.9636363636363636,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 2, 'UNL:CYS:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
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+332,NeuralPLexer,1XM6_5RM,0.5625,0.775,"{'UNL:ASN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
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+338,NeuralPLexer,1MMV_3AR,0.5,0.8,"{'UNL:GLU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
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+379,RFAA,1GKC_NFH,0.35000000000000003,0.86,"{'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 4, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+380,RFAA,1N1M_A3M,,0.0,,
+381,RFAA,1Z95_198,0.375,0.85,"{'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 4, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+382,RFAA,1HP0_AD3,,0.0,,
+383,RFAA,1OF1_SCT,0.45,0.8200000000000001,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
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+387,RFAA,1OWE_675,0.23076923076923078,0.9076923076923077,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+388,RFAA,1OQ5_CEL,0.3888888888888889,0.8444444444444444,"{'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+389,RFAA,1SG0_STL,0.39999999999999997,0.8400000000000001,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+390,RFAA,2BR1_PFP,0.0625,0.975,"{'UNL:ALA:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+391,RFAA,1UOU_CMU,0.7333333333333334,0.7066666666666667,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 4, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+392,RFAA,1TZ8_DES,0.6666666666666666,0.7333333333333334,"{'UNL:ALA:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 3, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 2}"
+393,RFAA,1R9O_FLP,0.4736842105263159,0.8105263157894737,"{'UNL:ALA:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+394,RFAA,1P2Y_NCT,0.4545454545454545,0.8181818181818182,"{'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+395,RFAA,1V0P_PVB,,0.0,,
+396,RFAA,1XOZ_CIA,0.47058823529411764,0.8117647058823529,"{'UNL:ALA:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+397,RFAA,1R55_097,0.5294117647058824,0.788235294117647,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 4, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBDonor': 2, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+398,RFAA,1YWR_LI9,0.7142857142857143,0.7142857142857143,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+399,RFAA,1HQ2_PH2,0.05555555555555555,0.9777777777777777,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+400,RFAA,1MZC_BNE,,0.0,,
+401,RFAA,1V4S_MRK,0.32,0.872,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3}"
+402,RFAA,1NAV_IH5,0.5294117647058822,0.7882352941176471,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+403,RFAA,1JJE_BYS,,0.0,,
+404,RFAA,1GM8_SOX,,0.0,,
+405,RFAA,1J3J_CP6,,0.0,,
+406,RFAA,1T9B_1CS,,0.0,,
+407,RFAA,1PMN_984,0.375,0.85,"{'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 3, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+408,RFAA,1N2V_BDI,0.23076923076923073,0.9076923076923077,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+409,RFAA,1GPK_HUP,0.23076923076923073,0.9076923076923077,"{'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+410,RFAA,1W1P_GIO,,0.0,,
+411,RFAA,1OF6_DTY,,0.0,,
+412,RFAA,1S3V_TQD,0.14285714285714293,0.9428571428571428,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+413,RFAA,1Y6B_AAX,0.35294117647058826,0.8588235294117648,"{'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+414,RFAA,1L2S_STC,,0.0,,
+415,RFAA,1W2G_THM,0.14285714285714296,0.9428571428571428,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}"
+416,RFAA,1TOW_CRZ,,0.0,,
+417,RFAA,1XM6_5RM,,0.0,,
+418,RFAA,1YGC_905,0.14999999999999997,0.9400000000000001,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBDonor': 2, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+419,RFAA,1R58_AO5,0.47058823529411764,0.8117647058823529,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 4, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+420,RFAA,1HNN_SKF,0.5333333333333333,0.7866666666666666,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 5, 'UNL:TYR:VdWContact': 4, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:VdWContact': 1}"
+421,RFAA,1HVY_D16,,0.0,,
+422,RFAA,1OPK_P16,0.22727272727272735,0.9090909090909091,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+423,RFAA,1MMV_3AR,,0.0,,
+424,RFAA,1SQN_NDR,,0.0,,
+425,Chai-1-Single-Seq,2BM2_PM2,0.19999999999999998,0.92,"{'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+426,Chai-1-Single-Seq,1XOQ_ROF,0.21428571428571425,0.9142857142857143,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+427,Chai-1-Single-Seq,1M2Z_DEX,0.12499999999999997,0.95,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+428,Chai-1-Single-Seq,1P62_GEO,0.3125,0.875,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+429,Chai-1-Single-Seq,1KE5_LS1,0.20000000000000004,0.9199999999999999,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+430,Chai-1-Single-Seq,1TT1_KAI,0.125,0.95,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+431,Chai-1-Single-Seq,1VCJ_IBA,0.5555555555555556,0.7777777777777778,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 5, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 4, 'UNL:ILE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+432,Chai-1-Single-Seq,1HWI_115,,0.0,,
+433,Chai-1-Single-Seq,1UML_FR4,0.23076923076923067,0.9076923076923077,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2}","{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+434,Chai-1-Single-Seq,1JLA_TNK,0.3,0.88,"{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+435,Chai-1-Single-Seq,1N46_PFA,0.3809523809523809,0.8476190476190477,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+436,Chai-1-Single-Seq,1LRH_NLA,0.26315789473684215,0.8947368421052632,"{'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1}"
+437,Chai-1-Single-Seq,1KZK_JE2,0.6428571428571428,0.7428571428571429,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 4, 'UNL:ASP:VdWContact': 5, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 4, 'UNL:ILE:Hydrophobic': 6, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 3}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:Hydrophobic': 3, 'UNL:ASP:VdWContact': 4, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 6, 'UNL:LEU:Hydrophobic': 3, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4}"
+438,Chai-1-Single-Seq,1N2J_PAF,0.0,1.0,"{'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+439,Chai-1-Single-Seq,1MEH_MOA,,0.0,,
+440,Chai-1-Single-Seq,2BSM_BSM,0.09523809523809529,0.9619047619047619,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+441,Chai-1-Single-Seq,1V48_HA1,0.1,0.96,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+442,Chai-1-Single-Seq,1L7F_BCZ,0.23529411764705876,0.9058823529411765,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+443,Chai-1-Single-Seq,1JD0_AZM,0.3,0.88,"{'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+444,Chai-1-Single-Seq,1S19_MC9,0.19999999999999996,0.92,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 4, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 6, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+445,Chai-1-Single-Seq,1LPZ_CMB,0.22727272727272724,0.9090909090909091,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+446,Chai-1-Single-Seq,1X8X_TYR,0.16666666666666657,0.9333333333333333,"{'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+447,Chai-1-Single-Seq,1T46_STI,0.4285714285714286,0.8285714285714285,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 4}"
+448,Chai-1-Single-Seq,1IG3_VIB,0.2857142857142857,0.8857142857142857,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1}"
+449,Chai-1-Single-Seq,1SQ5_PAU,0.375,0.85,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+450,Chai-1-Single-Seq,1Q4G_BFL,0.4444444444444444,0.8222222222222222,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+451,Chai-1-Single-Seq,1OYT_FSN,0.26315789473684215,0.8947368421052632,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+452,Chai-1-Single-Seq,1UNL_RRC,0.368421052631579,0.8526315789473684,"{'UNL:ALA:Hydrophobic': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+453,Chai-1-Single-Seq,1U1C_BAU,0.2777777777777778,0.8888888888888888,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+454,Chai-1-Single-Seq,1K3U_IAD,0.09523809523809518,0.9619047619047619,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 4, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 4, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+455,Chai-1-Single-Seq,1G9V_RQ3,0.5,0.8,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:VdWContact': 2}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 1}"
+456,Chai-1-Single-Seq,1YV3_BIT,0.5416666666666666,0.7833333333333333,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+457,Chai-1-Single-Seq,1IA1_TQ3,0.2,0.92,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1}"
+458,Chai-1-Single-Seq,1Q1G_MTI,,0.0,,
+459,Chai-1-Single-Seq,1R1H_BIR,0.34999999999999987,0.8600000000000001,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 4, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+460,Chai-1-Single-Seq,1YVF_PH7,0.20833333333333326,0.9166666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+461,Chai-1-Single-Seq,1YQY_915,0.09999999999999998,0.96,"{'UNL:GLU:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+462,Chai-1-Single-Seq,1HWW_SWA,,0.0,,
+463,Chai-1-Single-Seq,1T40_ID5,0.33333333333333337,0.8666666666666667,"{'UNL:CYS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+464,Chai-1-Single-Seq,1GKC_NFH,0.21052631578947367,0.9157894736842105,"{'UNL:ALA:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+465,Chai-1-Single-Seq,1N1M_A3M,,0.0,,
+466,Chai-1-Single-Seq,1Z95_198,0.1333333333333333,0.9466666666666667,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 4, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+467,Chai-1-Single-Seq,1HP0_AD3,0.0,1.0,"{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+468,Chai-1-Single-Seq,1OF1_SCT,0.050000000000000044,0.98,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+469,Chai-1-Single-Seq,1SJ0_E4D,0.04347826086956519,0.9826086956521739,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+470,Chai-1-Single-Seq,1U4D_DBQ,0.2857142857142858,0.8857142857142857,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+471,Chai-1-Single-Seq,1Q41_IXM,0.11764705882352942,0.9529411764705882,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+472,Chai-1-Single-Seq,1OWE_675,0.19999999999999998,0.92,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+473,Chai-1-Single-Seq,1OQ5_CEL,0.14285714285714285,0.9428571428571428,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+474,Chai-1-Single-Seq,1SG0_STL,0.5,0.8,"{'UNL:ASN:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+475,Chai-1-Single-Seq,2BR1_PFP,0.06666666666666665,0.9733333333333334,"{'UNL:ALA:Hydrophobic': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+476,Chai-1-Single-Seq,1UOU_CMU,0.15789473684210525,0.9368421052631579,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+477,Chai-1-Single-Seq,1TZ8_DES,0.2727272727272726,0.890909090909091,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 3, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 2}"
+478,Chai-1-Single-Seq,1R9O_FLP,0.22222222222222215,0.9111111111111111,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+479,Chai-1-Single-Seq,1P2Y_NCT,0.16666666666666663,0.9333333333333333,"{'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+480,Chai-1-Single-Seq,1V0P_PVB,0.2777777777777778,0.8888888888888888,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+481,Chai-1-Single-Seq,1XOZ_CIA,0.0625,0.975,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+482,Chai-1-Single-Seq,1R55_097,0.06666666666666665,0.9733333333333334,"{'UNL:ALA:HBDonor': 2, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBDonor': 2, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+483,Chai-1-Single-Seq,1YWR_LI9,0.045454545454545456,0.9818181818181818,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+484,Chai-1-Single-Seq,1HQ2_PH2,0.0,1.0,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+485,Chai-1-Single-Seq,1MZC_BNE,0.2857142857142857,0.8857142857142857,"{'UNL:ASP:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+486,Chai-1-Single-Seq,1V4S_MRK,0.20833333333333326,0.9166666666666667,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3}"
+487,Chai-1-Single-Seq,1NAV_IH5,0.2500000000000001,0.8999999999999999,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+488,Chai-1-Single-Seq,1JJE_BYS,0.1578947368421053,0.9368421052631579,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 3, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+489,Chai-1-Single-Seq,1GM8_SOX,0.21428571428571433,0.9142857142857143,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 4, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 2}"
+490,Chai-1-Single-Seq,1J3J_CP6,0.23529411764705882,0.9058823529411765,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}"
+491,Chai-1-Single-Seq,1T9B_1CS,0.23529411764705882,0.9058823529411765,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+492,Chai-1-Single-Seq,1PMN_984,0.4705882352941177,0.8117647058823529,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+493,Chai-1-Single-Seq,1N2V_BDI,0.26666666666666666,0.8933333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+494,Chai-1-Single-Seq,1GPK_HUP,0.4444444444444444,0.8222222222222222,"{'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2}","{'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+495,Chai-1-Single-Seq,1W1P_GIO,1.0,0.6,"{'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+496,Chai-1-Single-Seq,1OF6_DTY,,0.0,,
+497,Chai-1-Single-Seq,1S3V_TQD,0.4375,0.825,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+498,Chai-1-Single-Seq,1Y6B_AAX,0.1428571428571428,0.9428571428571428,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 2, 'UNL:CYS:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+499,Chai-1-Single-Seq,1L2S_STC,0.26666666666666666,0.8933333333333333,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 1}"
+500,Chai-1-Single-Seq,1W2G_THM,0.0,1.0,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}"
+501,Chai-1-Single-Seq,1TOW_CRZ,0.1333333333333333,0.9466666666666667,"{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+502,Chai-1-Single-Seq,1XM6_5RM,0.25,0.9,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+503,Chai-1-Single-Seq,1YGC_905,0.1875,0.925,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+504,Chai-1-Single-Seq,1R58_AO5,0.1666666666666667,0.9333333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+505,Chai-1-Single-Seq,1HNN_SKF,0.4166666666666667,0.8333333333333333,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:VdWContact': 1}"
+506,Chai-1-Single-Seq,1HVY_D16,0.1538461538461539,0.9384615384615385,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:UMP:Hydrophobic': 1, 'UNL:UMP:VdWContact': 1}"
+507,Chai-1-Single-Seq,1OPK_P16,,0.0,,
+508,Chai-1-Single-Seq,1MMV_3AR,0.2631578947368421,0.8947368421052632,"{'UNL:ALA:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+509,Chai-1-Single-Seq,1SQN_NDR,0.1875,0.925,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+510,Chai-1,2BM2_PM2,0.29411764705882354,0.8823529411764706,"{'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+511,Chai-1,1XOQ_ROF,0.20000000000000007,0.9199999999999999,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+512,Chai-1,1M2Z_DEX,0.2857142857142857,0.8857142857142857,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+513,Chai-1,1P62_GEO,0.23529411764705882,0.9058823529411765,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+514,Chai-1,1KE5_LS1,0.11111111111111113,0.9555555555555555,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+515,Chai-1,1TT1_KAI,0.17647058823529413,0.9294117647058824,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+516,Chai-1,1VCJ_IBA,0.11764705882352944,0.9529411764705882,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 5, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 4, 'UNL:ILE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+517,Chai-1,1HWI_115,0.1739130434782609,0.9304347826086956,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 3, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+518,Chai-1,1UML_FR4,0.28571428571428575,0.8857142857142857,"{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+519,Chai-1,1JLA_TNK,0.0714285714285714,0.9714285714285714,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+520,Chai-1,1N46_PFA,0.33333333333333326,0.8666666666666667,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+521,Chai-1,1LRH_NLA,0.8666666666666667,0.6533333333333333,"{'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1}"
+522,Chai-1,1KZK_JE2,0.3846153846153847,0.8461538461538461,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 4, 'UNL:ASP:VdWContact': 4, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 4, 'UNL:ILE:Hydrophobic': 6, 'UNL:LEU:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:Hydrophobic': 3, 'UNL:ASP:VdWContact': 4, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 6, 'UNL:LEU:Hydrophobic': 3, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4}"
+523,Chai-1,1N2J_PAF,0.3846153846153846,0.8461538461538461,"{'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+524,Chai-1,1MEH_MOA,0.18181818181818174,0.9272727272727272,"{'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2}"
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+526,Chai-1,1V48_HA1,0.10526315789473684,0.9578947368421052,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
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+528,Chai-1,1JD0_AZM,0.09090909090909091,0.9636363636363636,"{'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+529,Chai-1,1S19_MC9,0.3333333333333334,0.8666666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 6, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+530,Chai-1,1LPZ_CMB,0.10526315789473689,0.9578947368421052,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+531,Chai-1,1X8X_TYR,0.09090909090909083,0.9636363636363636,"{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+532,Chai-1,1T46_STI,0.4285714285714286,0.8285714285714285,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 4}"
+533,Chai-1,1IG3_VIB,0.23076923076923073,0.9076923076923077,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1}"
+534,Chai-1,1SQ5_PAU,0.29411764705882354,0.8823529411764706,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+535,Chai-1,1Q4G_BFL,0.2666666666666668,0.8933333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+536,Chai-1,1OYT_FSN,0.10526315789473684,0.9578947368421052,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+537,Chai-1,1UNL_RRC,0.09999999999999998,0.96,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+538,Chai-1,1U1C_BAU,0.3125,0.875,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+539,Chai-1,1K3U_IAD,0.15151515151515155,0.9393939393939393,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 4, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 4, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+540,Chai-1,1G9V_RQ3,0.1333333333333333,0.9466666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 1}"
+541,Chai-1,1YV3_BIT,,0.0,,
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+543,Chai-1,1Q1G_MTI,0.05555555555555555,0.9777777777777777,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
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+545,Chai-1,1YVF_PH7,0.11111111111111116,0.9555555555555555,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+546,Chai-1,1YQY_915,0.1578947368421053,0.9368421052631579,"{'UNL:GLU:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+547,Chai-1,1HWW_SWA,0.2727272727272728,0.8909090909090909,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 4, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+548,Chai-1,1T40_ID5,0.33333333333333337,0.8666666666666667,"{'UNL:CYS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+549,Chai-1,1GKC_NFH,0.21052631578947362,0.9157894736842106,"{'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+550,Chai-1,1N1M_A3M,,0.0,,
+551,Chai-1,1Z95_198,0.06666666666666667,0.9733333333333334,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+552,Chai-1,1HP0_AD3,0.23076923076923078,0.9076923076923077,"{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+553,Chai-1,1OF1_SCT,0.23529411764705876,0.9058823529411765,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+554,Chai-1,1SJ0_E4D,0.1200000000000001,0.952,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 9, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+555,Chai-1,1U4D_DBQ,0.07692307692307698,0.9692307692307692,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+556,Chai-1,1Q41_IXM,0.06666666666666667,0.9733333333333334,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+557,Chai-1,1OWE_675,0.3,0.88,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+558,Chai-1,1OQ5_CEL,0.09999999999999992,0.9600000000000001,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+559,Chai-1,1SG0_STL,0.375,0.85,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+560,Chai-1,2BR1_PFP,0.13333333333333336,0.9466666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+561,Chai-1,1UOU_CMU,0.0,1.0,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+562,Chai-1,1TZ8_DES,0.29999999999999993,0.88,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 3, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 2}"
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+566,Chai-1,1XOZ_CIA,0.125,0.95,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
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+569,Chai-1,1HQ2_PH2,0.11764705882352942,0.9529411764705882,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+570,Chai-1,1MZC_BNE,0.1538461538461539,0.9384615384615385,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+571,Chai-1,1V4S_MRK,0.04761904761904767,0.9809523809523809,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3}"
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+573,Chai-1,1JJE_BYS,0.26315789473684215,0.8947368421052632,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 3, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+574,Chai-1,1GM8_SOX,0.44444444444444453,0.8222222222222222,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 5, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 2}"
+575,Chai-1,1J3J_CP6,0.2857142857142857,0.8857142857142857,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}"
+576,Chai-1,1T9B_1CS,0.13333333333333333,0.9466666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+577,Chai-1,1PMN_984,0.3125,0.875,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+578,Chai-1,1N2V_BDI,0.15384615384615385,0.9384615384615385,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+579,Chai-1,1GPK_HUP,0.5,0.8,"{'UNL:GLY:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+580,Chai-1,1W1P_GIO,0.5999999999999999,0.76,"{'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+581,Chai-1,1OF6_DTY,,0.0,,
+582,Chai-1,1S3V_TQD,0.30769230769230776,0.8769230769230769,"{'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1}","{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+583,Chai-1,1Y6B_AAX,0.0,1.0,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+584,Chai-1,1L2S_STC,0.2,0.92,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 1}"
+585,Chai-1,1W2G_THM,0.1538461538461539,0.9384615384615385,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}"
+586,Chai-1,1TOW_CRZ,0.19999999999999996,0.92,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+587,Chai-1,1XM6_5RM,0.21428571428571425,0.9142857142857143,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+588,Chai-1,1YGC_905,0.17647058823529405,0.9294117647058824,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+589,Chai-1,1R58_AO5,0.23529411764705888,0.9058823529411765,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+590,Chai-1,1HNN_SKF,0.3846153846153846,0.8461538461538461,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}","{'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:VdWContact': 1}"
+591,Chai-1,1HVY_D16,0.22727272727272732,0.9090909090909091,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:UMP:Hydrophobic': 1, 'UNL:UMP:VdWContact': 1}"
+592,Chai-1,1OPK_P16,0.16666666666666666,0.9333333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+593,Chai-1,1MMV_3AR,0.0,1.0,"{'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+594,Chai-1,1SQN_NDR,0.1333333333333333,0.9466666666666667,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+595,Boltz-1-Single-Seq,2BM2_PM2,,0.0,,
+596,Boltz-1-Single-Seq,1XOQ_ROF,,0.0,,
+597,Boltz-1-Single-Seq,1M2Z_DEX,0.17391304347826086,0.9304347826086956,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 4, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+598,Boltz-1-Single-Seq,1P62_GEO,0.29411764705882354,0.8823529411764706,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+599,Boltz-1-Single-Seq,1KE5_LS1,0.0,1.0,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+600,Boltz-1-Single-Seq,1TT1_KAI,0.11111111111111102,0.9555555555555556,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+601,Boltz-1-Single-Seq,1VCJ_IBA,0.3125,0.875,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 4, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 4, 'UNL:ILE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 5, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 4, 'UNL:ILE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+602,Boltz-1-Single-Seq,1HWI_115,,0.0,,
+603,Boltz-1-Single-Seq,1UML_FR4,0.21428571428571422,0.9142857142857144,"{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+604,Boltz-1-Single-Seq,1JLA_TNK,0.26315789473684204,0.8947368421052632,"{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+605,Boltz-1-Single-Seq,1N46_PFA,0.18181818181818182,0.9272727272727272,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+606,Boltz-1-Single-Seq,1LRH_NLA,,0.0,,
+607,Boltz-1-Single-Seq,1KZK_JE2,0.6153846153846154,0.7538461538461538,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 4, 'UNL:ASP:VdWContact': 4, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 5, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:Hydrophobic': 3, 'UNL:ASP:VdWContact': 4, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 6, 'UNL:LEU:Hydrophobic': 3, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4}"
+608,Boltz-1-Single-Seq,1N2J_PAF,0.1666666666666667,0.9333333333333333,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+609,Boltz-1-Single-Seq,1MEH_MOA,0.24999999999999994,0.9,"{'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2}"
+610,Boltz-1-Single-Seq,2BSM_BSM,0.047619047619047616,0.9809523809523809,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+611,Boltz-1-Single-Seq,1V48_HA1,0.047619047619047616,0.9809523809523809,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+612,Boltz-1-Single-Seq,1L7F_BCZ,0.17647058823529416,0.9294117647058824,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+613,Boltz-1-Single-Seq,1JD0_AZM,0.2000000000000001,0.9199999999999999,"{'UNL:HIS:HBDonor': 2, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+614,Boltz-1-Single-Seq,1S19_MC9,0.2857142857142857,0.8857142857142857,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 4, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 6, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+615,Boltz-1-Single-Seq,1LPZ_CMB,,0.0,,
+616,Boltz-1-Single-Seq,1X8X_TYR,0.16666666666666657,0.9333333333333333,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+617,Boltz-1-Single-Seq,1T46_STI,0.08333333333333337,0.9666666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 3, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 4}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 4}"
+618,Boltz-1-Single-Seq,1IG3_VIB,0.1538461538461538,0.9384615384615385,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1}"
+619,Boltz-1-Single-Seq,1SQ5_PAU,,0.0,,
+620,Boltz-1-Single-Seq,1Q4G_BFL,,0.0,,
+621,Boltz-1-Single-Seq,1OYT_FSN,0.1666666666666666,0.9333333333333333,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+622,Boltz-1-Single-Seq,1UNL_RRC,,0.0,,
+623,Boltz-1-Single-Seq,1U1C_BAU,,0.0,,
+624,Boltz-1-Single-Seq,1K3U_IAD,0.4,0.84,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 4, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+625,Boltz-1-Single-Seq,1G9V_RQ3,,0.0,,
+626,Boltz-1-Single-Seq,1YV3_BIT,0.30000000000000004,0.88,"{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+627,Boltz-1-Single-Seq,1IA1_TQ3,0.07142857142857142,0.9714285714285714,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1}"
+628,Boltz-1-Single-Seq,1Q1G_MTI,,0.0,,
+629,Boltz-1-Single-Seq,1R1H_BIR,0.1578947368421053,0.9368421052631579,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+630,Boltz-1-Single-Seq,1YVF_PH7,0.18181818181818182,0.9272727272727272,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+631,Boltz-1-Single-Seq,1YQY_915,0.09090909090909091,0.9636363636363636,"{'UNL:GLU:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+632,Boltz-1-Single-Seq,1HWW_SWA,0.16666666666666669,0.9333333333333333,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 3, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+633,Boltz-1-Single-Seq,1T40_ID5,0.38888888888888895,0.8444444444444444,"{'UNL:CYS:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+634,Boltz-1-Single-Seq,1GKC_NFH,,0.0,,
+635,Boltz-1-Single-Seq,1N1M_A3M,,0.0,,
+636,Boltz-1-Single-Seq,1Z95_198,0.16666666666666669,0.9333333333333333,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+637,Boltz-1-Single-Seq,1HP0_AD3,0.0,1.0,"{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+638,Boltz-1-Single-Seq,1OF1_SCT,0.10000000000000006,0.96,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+639,Boltz-1-Single-Seq,1SJ0_E4D,0.12499999999999994,0.9500000000000001,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+640,Boltz-1-Single-Seq,1U4D_DBQ,0.08333333333333326,0.9666666666666667,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+641,Boltz-1-Single-Seq,1Q41_IXM,0.11764705882352944,0.9529411764705882,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+642,Boltz-1-Single-Seq,1OWE_675,0.39999999999999997,0.8400000000000001,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+643,Boltz-1-Single-Seq,1OQ5_CEL,0.09523809523809518,0.9619047619047619,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+644,Boltz-1-Single-Seq,1SG0_STL,0.0,1.0,"{'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+645,Boltz-1-Single-Seq,2BR1_PFP,0.15384615384615385,0.9384615384615385,"{'UNL:ALA:Hydrophobic': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+646,Boltz-1-Single-Seq,1UOU_CMU,0.3571428571428571,0.8571428571428572,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+647,Boltz-1-Single-Seq,1TZ8_DES,0.30000000000000004,0.88,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 2}"
+648,Boltz-1-Single-Seq,1R9O_FLP,,0.0,,
+649,Boltz-1-Single-Seq,1P2Y_NCT,,0.0,,
+650,Boltz-1-Single-Seq,1V0P_PVB,0.44999999999999996,0.8200000000000001,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+651,Boltz-1-Single-Seq,1XOZ_CIA,0.1875,0.925,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+652,Boltz-1-Single-Seq,1R55_097,0.19999999999999996,0.92,"{'UNL:ALA:HBDonor': 2, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBDonor': 2, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+653,Boltz-1-Single-Seq,1YWR_LI9,0.19047619047619047,0.9238095238095239,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+654,Boltz-1-Single-Seq,1HQ2_PH2,0.0,1.0,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+655,Boltz-1-Single-Seq,1MZC_BNE,,0.0,,
+656,Boltz-1-Single-Seq,1V4S_MRK,0.1578947368421052,0.9368421052631579,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3}"
+657,Boltz-1-Single-Seq,1NAV_IH5,0.3000000000000001,0.88,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+658,Boltz-1-Single-Seq,1JJE_BYS,0.5294117647058824,0.788235294117647,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 3, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+659,Boltz-1-Single-Seq,1GM8_SOX,,0.0,,
+660,Boltz-1-Single-Seq,1J3J_CP6,,0.0,,
+661,Boltz-1-Single-Seq,1T9B_1CS,,0.0,,
+662,Boltz-1-Single-Seq,1PMN_984,0.4444444444444445,0.8222222222222222,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+663,Boltz-1-Single-Seq,1N2V_BDI,0.2857142857142857,0.8857142857142857,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+664,Boltz-1-Single-Seq,1GPK_HUP,0.4166666666666667,0.8333333333333333,"{'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+665,Boltz-1-Single-Seq,1W1P_GIO,,0.0,,
+666,Boltz-1-Single-Seq,1OF6_DTY,,0.0,,
+667,Boltz-1-Single-Seq,1S3V_TQD,0.4285714285714286,0.8285714285714285,"{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+668,Boltz-1-Single-Seq,1Y6B_AAX,0.22222222222222227,0.9111111111111111,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+669,Boltz-1-Single-Seq,1L2S_STC,0.16666666666666669,0.9333333333333333,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 1}"
+670,Boltz-1-Single-Seq,1W2G_THM,0.07692307692307693,0.9692307692307692,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}"
+671,Boltz-1-Single-Seq,1TOW_CRZ,0.17647058823529413,0.9294117647058824,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+672,Boltz-1-Single-Seq,1XM6_5RM,0.35294117647058815,0.8588235294117648,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+673,Boltz-1-Single-Seq,1YGC_905,,0.0,,
+674,Boltz-1-Single-Seq,1R58_AO5,0.26666666666666666,0.8933333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 4, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+675,Boltz-1-Single-Seq,1HNN_SKF,0.0,1.0,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:VdWContact': 1}"
+676,Boltz-1-Single-Seq,1HVY_D16,,0.0,,
+677,Boltz-1-Single-Seq,1OPK_P16,0.28571428571428575,0.8857142857142857,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+678,Boltz-1-Single-Seq,1MMV_3AR,,0.0,,
+679,Boltz-1-Single-Seq,1SQN_NDR,0.25,0.9,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+680,Boltz-1,2BM2_PM2,,0.0,,
+681,Boltz-1,1XOQ_ROF,,0.0,,
+682,Boltz-1,1M2Z_DEX,0.1739130434782608,0.9304347826086957,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+683,Boltz-1,1P62_GEO,0.33333333333333326,0.8666666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+684,Boltz-1,1KE5_LS1,0.05555555555555558,0.9777777777777777,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+685,Boltz-1,1TT1_KAI,0.15789473684210525,0.9368421052631579,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+686,Boltz-1,1VCJ_IBA,0.15789473684210537,0.9368421052631578,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 4, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 4, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 5, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 4, 'UNL:ILE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+687,Boltz-1,1HWI_115,,0.0,,
+688,Boltz-1,1UML_FR4,0.26666666666666666,0.8933333333333333,"{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}","{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+689,Boltz-1,1JLA_TNK,0.3684210526315789,0.8526315789473684,"{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+690,Boltz-1,1N46_PFA,0.28571428571428564,0.8857142857142858,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+691,Boltz-1,1LRH_NLA,,0.0,,
+692,Boltz-1,1KZK_JE2,0.49999999999999994,0.8,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 4, 'UNL:ASP:VdWContact': 4, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 6, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 3, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:Hydrophobic': 3, 'UNL:ASP:VdWContact': 4, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 6, 'UNL:LEU:Hydrophobic': 3, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4}"
+693,Boltz-1,1N2J_PAF,0.18181818181818177,0.9272727272727272,"{'UNL:GLN:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+694,Boltz-1,1MEH_MOA,0.07692307692307698,0.9692307692307692,"{'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2}"
+695,Boltz-1,2BSM_BSM,0.09999999999999994,0.9600000000000001,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+696,Boltz-1,1V48_HA1,0.04761904761904767,0.9809523809523809,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+697,Boltz-1,1L7F_BCZ,0.13333333333333341,0.9466666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 5, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+698,Boltz-1,1JD0_AZM,0.2000000000000001,0.9199999999999999,"{'UNL:HIS:HBDonor': 2, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+699,Boltz-1,1S19_MC9,0.2380952380952382,0.9047619047619048,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 6, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+700,Boltz-1,1LPZ_CMB,,0.0,,
+701,Boltz-1,1X8X_TYR,0.0,1.0,"{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+702,Boltz-1,1T46_STI,0.12500000000000003,0.95,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 4}"
+703,Boltz-1,1IG3_VIB,0.1538461538461538,0.9384615384615385,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1}"
+704,Boltz-1,1SQ5_PAU,,0.0,,
+705,Boltz-1,1Q4G_BFL,,0.0,,
+706,Boltz-1,1OYT_FSN,0.2631578947368421,0.8947368421052632,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+707,Boltz-1,1UNL_RRC,,0.0,,
+708,Boltz-1,1U1C_BAU,,0.0,,
+709,Boltz-1,1K3U_IAD,0.23809523809523814,0.9047619047619048,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 4, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+710,Boltz-1,1G9V_RQ3,,0.0,,
+711,Boltz-1,1YV3_BIT,0.1904761904761904,0.9238095238095239,"{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+712,Boltz-1,1IA1_TQ3,0.07142857142857142,0.9714285714285714,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1}"
+713,Boltz-1,1Q1G_MTI,,0.0,,
+714,Boltz-1,1R1H_BIR,0.15000000000000002,0.94,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+715,Boltz-1,1YVF_PH7,0.17391304347826086,0.9304347826086956,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+716,Boltz-1,1YQY_915,0.21739130434782608,0.9130434782608696,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+717,Boltz-1,1HWW_SWA,0.15384615384615385,0.9384615384615385,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 4, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+718,Boltz-1,1T40_ID5,0.2631578947368421,0.8947368421052632,"{'UNL:CYS:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+719,Boltz-1,1GKC_NFH,,0.0,,
+720,Boltz-1,1N1M_A3M,,0.0,,
+721,Boltz-1,1Z95_198,0.11764705882352942,0.9529411764705882,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+722,Boltz-1,1HP0_AD3,0.09090909090909091,0.9636363636363636,"{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+723,Boltz-1,1OF1_SCT,0.2222222222222223,0.9111111111111111,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+724,Boltz-1,1SJ0_E4D,0.12000000000000008,0.952,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 9, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+725,Boltz-1,1U4D_DBQ,0.08333333333333326,0.9666666666666667,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+726,Boltz-1,1Q41_IXM,0.0625,0.975,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+727,Boltz-1,1OWE_675,0.30000000000000004,0.88,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+728,Boltz-1,1OQ5_CEL,0.14999999999999997,0.9400000000000001,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+729,Boltz-1,1SG0_STL,0.4444444444444445,0.8222222222222222,"{'UNL:GLN:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+730,Boltz-1,2BR1_PFP,0.07692307692307693,0.9692307692307692,"{'UNL:ALA:Hydrophobic': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+731,Boltz-1,1UOU_CMU,0.3571428571428571,0.8571428571428572,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+732,Boltz-1,1TZ8_DES,0.24999999999999992,0.9,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 2}"
+733,Boltz-1,1R9O_FLP,,0.0,,
+734,Boltz-1,1P2Y_NCT,,0.0,,
+735,Boltz-1,1V0P_PVB,0.3157894736842105,0.8736842105263158,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+736,Boltz-1,1XOZ_CIA,0.0625,0.975,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+737,Boltz-1,1R55_097,0.1333333333333333,0.9466666666666667,"{'UNL:ALA:HBDonor': 2, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBDonor': 2, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+738,Boltz-1,1YWR_LI9,0.09523809523809523,0.9619047619047619,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+739,Boltz-1,1HQ2_PH2,0.0,1.0,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+740,Boltz-1,1MZC_BNE,,0.0,,
+741,Boltz-1,1V4S_MRK,0.05000000000000002,0.98,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3}"
+742,Boltz-1,1NAV_IH5,0.15789473684210525,0.9368421052631579,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+743,Boltz-1,1JJE_BYS,0.5000000000000001,0.7999999999999999,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 3}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 3, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+744,Boltz-1,1GM8_SOX,,0.0,,
+745,Boltz-1,1J3J_CP6,,0.0,,
+746,Boltz-1,1T9B_1CS,,0.0,,
+747,Boltz-1,1PMN_984,0.375,0.85,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+748,Boltz-1,1N2V_BDI,0.21428571428571427,0.9142857142857143,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+749,Boltz-1,1GPK_HUP,0.36363636363636354,0.8545454545454546,"{'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+750,Boltz-1,1W1P_GIO,,0.0,,
+751,Boltz-1,1OF6_DTY,,0.0,,
+752,Boltz-1,1S3V_TQD,0.2857142857142858,0.8857142857142857,"{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+753,Boltz-1,1Y6B_AAX,0.2941176470588236,0.8823529411764706,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 2, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+754,Boltz-1,1L2S_STC,0.125,0.95,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 1}"
+755,Boltz-1,1W2G_THM,0.14285714285714285,0.9428571428571428,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}"
+756,Boltz-1,1TOW_CRZ,0.23529411764705885,0.9058823529411765,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+757,Boltz-1,1XM6_5RM,0.21428571428571422,0.9142857142857144,"{'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+758,Boltz-1,1YGC_905,,0.0,,
+759,Boltz-1,1R58_AO5,0.17647058823529405,0.9294117647058824,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 4, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+760,Boltz-1,1HNN_SKF,0.07142857142857142,0.9714285714285714,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:VdWContact': 1}"
+761,Boltz-1,1HVY_D16,,0.0,,
+762,Boltz-1,1OPK_P16,0.38095238095238093,0.8476190476190476,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+763,Boltz-1,1MMV_3AR,,0.0,,
+764,Boltz-1,1SQN_NDR,0.125,0.95,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+765,AF3-Single-Seq,2BM2_PM2,0.4583333333333335,0.8166666666666667,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 4}","{'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+766,AF3-Single-Seq,1XOQ_ROF,,0.0,,
+767,AF3-Single-Seq,1M2Z_DEX,0.8260869565217392,0.6695652173913043,"{'UNL:GLU:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+768,AF3-Single-Seq,1P62_GEO,0.27777777777777785,0.8888888888888888,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+769,AF3-Single-Seq,1KE5_LS1,0.7619047619047619,0.6952380952380952,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+770,AF3-Single-Seq,1TT1_KAI,0.8235294117647058,0.6705882352941177,"{'UNL:ARG:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+771,AF3-Single-Seq,1VCJ_IBA,0.3333333333333334,0.8666666666666667,"{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 5, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 4, 'UNL:ILE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+772,AF3-Single-Seq,1HWI_115,0.6,0.76,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 3, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+773,AF3-Single-Seq,1UML_FR4,0.4583333333333335,0.8166666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+774,AF3-Single-Seq,1JLA_TNK,0.12,0.952,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+775,AF3-Single-Seq,1N46_PFA,1.4090909090909092,0.4363636363636363,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:MET:Hydrophobic': 8, 'UNL:MET:VdWContact': 6, 'UNL:SER:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+776,AF3-Single-Seq,1LRH_NLA,,0.0,,
+777,AF3-Single-Seq,1KZK_JE2,0.44999999999999996,0.8200000000000001,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:ILE:Hydrophobic': 6, 'UNL:ILE:VdWContact': 5, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:Hydrophobic': 3, 'UNL:ASP:VdWContact': 4, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 6, 'UNL:LEU:Hydrophobic': 3, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4}"
+778,AF3-Single-Seq,1N2J_PAF,0.75,0.7,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+779,AF3-Single-Seq,1MEH_MOA,0.125,0.95,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2}"
+780,AF3-Single-Seq,2BSM_BSM,0.44,0.8240000000000001,"{'UNL:ASN:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 4, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+781,AF3-Single-Seq,1V48_HA1,0.32,0.872,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+782,AF3-Single-Seq,1L7F_BCZ,0.625,0.75,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+783,AF3-Single-Seq,1JD0_AZM,1.0,0.6,"{'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 4}","{'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+784,AF3-Single-Seq,1S19_MC9,0.2592592592592594,0.8962962962962963,"{'UNL:ASP:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 6, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+785,AF3-Single-Seq,1LPZ_CMB,0.3571428571428571,0.8571428571428572,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+786,AF3-Single-Seq,1X8X_TYR,0.5625,0.775,"{'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 4, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+787,AF3-Single-Seq,1T46_STI,0.36666666666666664,0.8533333333333333,"{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 4}"
+788,AF3-Single-Seq,1IG3_VIB,0.4705882352941177,0.8117647058823529,"{'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1}"
+789,AF3-Single-Seq,1SQ5_PAU,0.7142857142857143,0.7142857142857143,"{'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+790,AF3-Single-Seq,1Q4G_BFL,1.5000000000000002,0.3999999999999999,{},"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+791,AF3-Single-Seq,1OYT_FSN,0.23076923076923078,0.9076923076923077,"{'UNL:ALA:Hydrophobic': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+792,AF3-Single-Seq,1UNL_RRC,0.44,0.8240000000000001,"{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 3, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+793,AF3-Single-Seq,1U1C_BAU,0.6842105263157894,0.7263157894736842,"{'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+794,AF3-Single-Seq,1K3U_IAD,0.4615384615384616,0.8153846153846154,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 4, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+795,AF3-Single-Seq,1G9V_RQ3,0.24999999999999994,0.9,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 1}"
+796,AF3-Single-Seq,1YV3_BIT,,0.0,,
+797,AF3-Single-Seq,1IA1_TQ3,0.31578947368421056,0.8736842105263158,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1}"
+798,AF3-Single-Seq,1Q1G_MTI,0.75,0.7,"{'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LIG:HBDonor': 1, 'UNL:LIG:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+799,AF3-Single-Seq,1R1H_BIR,0.1785714285714286,0.9285714285714286,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+800,AF3-Single-Seq,1YVF_PH7,0.34482758620689646,0.8620689655172414,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+801,AF3-Single-Seq,1YQY_915,0.4210526315789473,0.8315789473684211,"{'UNL:GLU:VdWContact': 4, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+802,AF3-Single-Seq,1HWW_SWA,0.5625,0.775,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+803,AF3-Single-Seq,1T40_ID5,0.16000000000000014,0.9359999999999999,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+804,AF3-Single-Seq,1GKC_NFH,0.8571428571428571,0.6571428571428571,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3}","{'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+805,AF3-Single-Seq,1N1M_A3M,1.7,0.32000000000000006,{},"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 2}"
+806,AF3-Single-Seq,1Z95_198,0.45000000000000007,0.82,"{'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+807,AF3-Single-Seq,1HP0_AD3,0.5384615384615385,0.7846153846153846,"{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+808,AF3-Single-Seq,1OF1_SCT,0.8500000000000001,0.6599999999999999,"{'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+809,AF3-Single-Seq,1SJ0_E4D,0.4814814814814818,0.8074074074074074,"{'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+810,AF3-Single-Seq,1U4D_DBQ,0.23529411764705882,0.9058823529411765,"{'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:TRP:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+811,AF3-Single-Seq,1Q41_IXM,0.6470588235294118,0.7411764705882353,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+812,AF3-Single-Seq,1OWE_675,0.5,0.8,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+813,AF3-Single-Seq,1OQ5_CEL,0.48,0.808,"{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 3, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+814,AF3-Single-Seq,1SG0_STL,0.4444444444444444,0.8222222222222222,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+815,AF3-Single-Seq,2BR1_PFP,0.34615384615384615,0.8615384615384616,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+816,AF3-Single-Seq,1UOU_CMU,0.3684210526315789,0.8526315789473684,"{'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+817,AF3-Single-Seq,1TZ8_DES,1.2000000000000002,0.5199999999999999,"{'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 4, 'UNL:THR:Hydrophobic': 4, 'UNL:THR:VdWContact': 4}","{'UNL:ALA:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 2}"
+818,AF3-Single-Seq,1R9O_FLP,0.12499999999999989,0.9500000000000001,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+819,AF3-Single-Seq,1P2Y_NCT,0.05882352941176472,0.9764705882352941,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+820,AF3-Single-Seq,1V0P_PVB,0.48148148148148145,0.8074074074074074,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+821,AF3-Single-Seq,1XOZ_CIA,0.35,0.86,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+822,AF3-Single-Seq,1R55_097,0.3684210526315789,0.8526315789473684,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBDonor': 2, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+823,AF3-Single-Seq,1YWR_LI9,0.5555555555555555,0.7777777777777778,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+824,AF3-Single-Seq,1HQ2_PH2,0.14999999999999997,0.9400000000000001,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+825,AF3-Single-Seq,1MZC_BNE,0.6923076923076923,0.7230769230769231,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 3, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 4, 'UNL:TYR:VdWContact': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+826,AF3-Single-Seq,1V4S_MRK,0.09999999999999998,0.96,"{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3}"
+827,AF3-Single-Seq,1NAV_IH5,0.30434782608695665,0.8782608695652173,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+828,AF3-Single-Seq,1JJE_BYS,0.16666666666666663,0.9333333333333333,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 3, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+829,AF3-Single-Seq,1GM8_SOX,0.3478260869565218,0.8608695652173912,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 2}"
+830,AF3-Single-Seq,1J3J_CP6,0.10000000000000003,0.96,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}"
+831,AF3-Single-Seq,1T9B_1CS,0.3333333333333333,0.8666666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+832,AF3-Single-Seq,1PMN_984,0.42105263157894735,0.8315789473684211,"{'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+833,AF3-Single-Seq,1N2V_BDI,0.39999999999999997,0.8400000000000001,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+834,AF3-Single-Seq,1GPK_HUP,0.4666666666666667,0.8133333333333334,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+835,AF3-Single-Seq,1W1P_GIO,1.0833333333333333,0.5666666666666667,{'UNL:TRP:VdWContact': 1},"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+836,AF3-Single-Seq,1OF6_DTY,,0.0,,
+837,AF3-Single-Seq,1S3V_TQD,0.35294117647058826,0.8588235294117648,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+838,AF3-Single-Seq,1Y6B_AAX,0.7142857142857144,0.7142857142857142,"{'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+839,AF3-Single-Seq,1L2S_STC,0.16666666666666669,0.9333333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 1}"
+840,AF3-Single-Seq,1W2G_THM,0.3888888888888889,0.8444444444444444,"{'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}"
+841,AF3-Single-Seq,1TOW_CRZ,0.1875,0.925,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+842,AF3-Single-Seq,1XM6_5RM,0.16666666666666669,0.9333333333333333,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+843,AF3-Single-Seq,1YGC_905,0.1538461538461538,0.9384615384615385,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+844,AF3-Single-Seq,1R58_AO5,0.1739130434782608,0.9304347826086957,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+845,AF3-Single-Seq,1HNN_SKF,0.42857142857142855,0.8285714285714285,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:VdWContact': 1}"
+846,AF3-Single-Seq,1HVY_D16,0.23333333333333334,0.9066666666666666,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:UMP:Hydrophobic': 1, 'UNL:UMP:VdWContact': 1}"
+847,AF3-Single-Seq,1OPK_P16,0.16666666666666669,0.9333333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+848,AF3-Single-Seq,1MMV_3AR,0.6875,0.725,"{'UNL:ILE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+849,AF3-Single-Seq,1SQN_NDR,0.49999999999999994,0.8,"{'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+850,AF3,2BM2_PM2,0.15384615384615385,0.9384615384615385,"{'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+851,AF3,1XOQ_ROF,,0.0,,
+852,AF3,1M2Z_DEX,0.22727272727272735,0.9090909090909091,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 4, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+853,AF3,1P62_GEO,0.2,0.92,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
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+857,AF3,1HWI_115,0.08333333333333334,0.9666666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 3, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 3, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
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+859,AF3,1JLA_TNK,0.1666666666666667,0.9333333333333333,"{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+860,AF3,1N46_PFA,0.23809523809523803,0.9047619047619048,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:THR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
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+862,AF3,1KZK_JE2,0.5384615384615385,0.7846153846153846,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 4, 'UNL:ASP:VdWContact': 4, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 5, 'UNL:ILE:Hydrophobic': 6, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:Hydrophobic': 3, 'UNL:ASP:VdWContact': 4, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 6, 'UNL:LEU:Hydrophobic': 3, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4}"
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+864,AF3,1MEH_MOA,0.18181818181818185,0.9272727272727272,"{'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2}"
+865,AF3,2BSM_BSM,0.15789473684210525,0.9368421052631579,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+866,AF3,1V48_HA1,0.04545454545454547,0.9818181818181818,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+867,AF3,1L7F_BCZ,0.1428571428571428,0.9428571428571428,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+868,AF3,1JD0_AZM,0.30000000000000004,0.88,"{'UNL:HIS:HBDonor': 2, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
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+910,AF3,1MZC_BNE,0.06666666666666668,0.9733333333333334,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+911,AF3,1V4S_MRK,0.05000000000000002,0.98,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3}"
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+916,AF3,1T9B_1CS,0.1875,0.925,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+917,AF3,1PMN_984,0.4375,0.825,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+918,AF3,1N2V_BDI,0.07692307692307693,0.9692307692307692,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+919,AF3,1GPK_HUP,0.3333333333333332,0.8666666666666667,"{'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2}","{'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+920,AF3,1W1P_GIO,1.0833333333333333,0.5666666666666667,{'UNL:PHE:VdWContact': 1},"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
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+922,AF3,1S3V_TQD,0.39999999999999997,0.8400000000000001,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+923,AF3,1Y6B_AAX,0.11764705882352942,0.9529411764705882,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+924,AF3,1L2S_STC,0.06666666666666667,0.9733333333333334,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 1}"
+925,AF3,1W2G_THM,0.21428571428571425,0.9142857142857143,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}"
+926,AF3,1TOW_CRZ,0.2,0.92,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+927,AF3,1XM6_5RM,0.13333333333333341,0.9466666666666667,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+928,AF3,1YGC_905,0.1666666666666667,0.9333333333333333,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+929,AF3,1R58_AO5,0.2777777777777778,0.8888888888888888,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 4, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+930,AF3,1HNN_SKF,0.1538461538461539,0.9384615384615385,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:VdWContact': 1}"
+931,AF3,1HVY_D16,0.3809523809523809,0.8476190476190477,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:UMP:Hydrophobic': 1, 'UNL:UMP:VdWContact': 1}"
+932,AF3,1OPK_P16,0.26315789473684215,0.8947368421052632,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+933,AF3,1MMV_3AR,0.11764705882352942,0.9529411764705882,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+934,AF3,1SQN_NDR,0.1875,0.925,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
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diff --git a/notebooks/astex_diverse_structured_plif_metrics.csv b/notebooks/astex_diverse_structured_plif_metrics.csv
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@@ -0,0 +1,584 @@
+,Category,Target,Structured_EMD,Unstructured_EMD,Method_Histogram,Reference_Histogram
+0,P2Rank-Vina,2BM2_PM2,0.0,0.25,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}","{'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+1,P2Rank-Vina,1VCJ_IBA,1.0,0.8666666666666666,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 5, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 4, 'UNL:ILE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+2,P2Rank-Vina,1HWI_115,0.0,0.6190476190476192,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 3, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+3,P2Rank-Vina,1UML_FR4,0.6666666666666667,0.25,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2}","{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+4,P2Rank-Vina,1MEH_MOA,0.5,0.857142857142857,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 7, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2}"
+5,P2Rank-Vina,2BSM_BSM,0.5,0.2777777777777777,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+6,P2Rank-Vina,1V48_HA1,0.7142857142857142,0.5,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+7,P2Rank-Vina,1JD0_AZM,0.16666666666666663,0.07692307692307687,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+8,P2Rank-Vina,1S19_MC9,0.5,0.3157894736842107,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 6, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+9,P2Rank-Vina,1LPZ_CMB,0.0,0.23529411764705885,"{'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+10,P2Rank-Vina,1X8X_TYR,0.75,0.6000000000000001,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+11,P2Rank-Vina,1T46_STI,0.19999999999999996,0.6521739130434784,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 4}"
+12,P2Rank-Vina,1IG3_VIB,0.0,0.5,"{'UNL:GLN:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1}"
+13,P2Rank-Vina,1SQ5_PAU,0.25,0.14285714285714296,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+14,P2Rank-Vina,1U1C_BAU,0.75,0.3571428571428572,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+15,P2Rank-Vina,1YQY_915,0.125,0.27777777777777773,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+16,P2Rank-Vina,1HWW_SWA,0.0,0.33333333333333326,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+17,P2Rank-Vina,1Z95_198,0.3333333333333333,0.25,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 5, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+18,P2Rank-Vina,1HP0_AD3,0.5,0.5454545454545454,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2}","{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+19,P2Rank-Vina,1OF1_SCT,0.6000000000000001,0.3125,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+20,P2Rank-Vina,1SJ0_E4D,0.0,0.36363636363636365,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 5, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+21,P2Rank-Vina,1Q41_IXM,0.5,0.06666666666666665,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+22,P2Rank-Vina,1OQ5_CEL,0.0,0.375,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+23,P2Rank-Vina,1UOU_CMU,0.19999999999999996,0.5384615384615384,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+24,P2Rank-Vina,1XOZ_CIA,0.0,0.4444444444444444,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+25,P2Rank-Vina,1YWR_LI9,0.5,0.42105263157894746,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+26,P2Rank-Vina,1NAV_IH5,0.5,0.14285714285714282,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+27,P2Rank-Vina,1S3V_TQD,0.0,0.4285714285714286,"{'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+28,P2Rank-Vina,1L2S_STC,0.5,0.33333333333333326,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 1}"
+29,P2Rank-Vina,1W2G_THM,0.0,0.6666666666666667,"{'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}"
+30,P2Rank-Vina,1XM6_5RM,0.0,0.23529411764705885,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+31,P2Rank-Vina,1YGC_905,0.5,0.3999999999999999,"{'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+32,P2Rank-Vina,1R58_AO5,0.25,0.16666666666666657,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+33,DiffDock-L,2BM2_PM2,0.0,0.3333333333333333,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+34,DiffDock-L,1XOQ_ROF,0.0,0.375,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+35,DiffDock-L,1M2Z_DEX,0.39999999999999997,0.22222222222222215,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 4, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+36,DiffDock-L,1P62_GEO,0.2,0.41666666666666674,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+37,DiffDock-L,1KE5_LS1,0.25,0.1875,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+38,DiffDock-L,1TT1_KAI,0.6,0.7,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+39,DiffDock-L,1VCJ_IBA,0.0,0.25,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 4, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 5, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 4, 'UNL:ILE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+40,DiffDock-L,1HWI_115,0.3333333333333333,0.14285714285714285,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 3, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+41,DiffDock-L,1UML_FR4,0.0,0.6666666666666666,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 4, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+42,DiffDock-L,1JLA_TNK,0.0,0.3888888888888889,"{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 3, 'UNL:PRO:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+43,DiffDock-L,1N46_PFA,0.39999999999999997,0.0,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+44,DiffDock-L,1KZK_JE2,1.0,0.7692307692307692,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 3, 'UNL:ASP:VdWContact': 4, 'UNL:GLY:HBDonor': 2, 'UNL:GLY:VdWContact': 4, 'UNL:ILE:Hydrophobic': 5, 'UNL:ILE:VdWContact': 4, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:Hydrophobic': 3, 'UNL:ASP:VdWContact': 4, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 6, 'UNL:LEU:Hydrophobic': 3, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4}"
+45,DiffDock-L,1N2J_PAF,0.0,0.25,"{'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+46,DiffDock-L,1MEH_MOA,0.19999999999999996,0.6428571428571428,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2}"
+47,DiffDock-L,2BSM_BSM,0.3333333333333333,0.0,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+48,DiffDock-L,1V48_HA1,0.0,0.21428571428571422,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+49,DiffDock-L,1L7F_BCZ,1.0,0.41666666666666663,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 6, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+50,DiffDock-L,1JD0_AZM,0.33333333333333337,0.28571428571428564,"{'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+51,DiffDock-L,1S19_MC9,0.25,0.15789473684210537,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 6, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+52,DiffDock-L,1LPZ_CMB,0.5,0.11764705882352944,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+53,DiffDock-L,1X8X_TYR,1.0,0.2000000000000001,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+54,DiffDock-L,1T46_STI,0.6666666666666666,0.21739130434782616,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 4}"
+55,DiffDock-L,1IG3_VIB,0.19999999999999996,0.3571428571428571,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 4, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1}"
+56,DiffDock-L,1SQ5_PAU,0.5,0.18181818181818174,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+57,DiffDock-L,1OYT_FSN,0.3333333333333333,0.14285714285714282,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+58,DiffDock-L,1UNL_RRC,0.6666666666666666,0.25,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+59,DiffDock-L,1U1C_BAU,0.25,0.23076923076923078,"{'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+60,DiffDock-L,1K3U_IAD,0.75,0.6428571428571428,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 4, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+61,DiffDock-L,1Q1G_MTI,0.0,0.11111111111111102,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+62,DiffDock-L,1R1H_BIR,0.5,0.39999999999999997,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+63,DiffDock-L,1YVF_PH7,0.0,0.04347826086956519,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+64,DiffDock-L,1YQY_915,0.33333333333333337,0.33333333333333337,"{'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+65,DiffDock-L,1HWW_SWA,0.3333333333333333,0.19999999999999998,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 3, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+66,DiffDock-L,1N1M_A3M,0.0,0.25,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 2}"
+67,DiffDock-L,1Z95_198,0.5,0.28571428571428586,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 4, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+68,DiffDock-L,1HP0_AD3,0.0,0.19999999999999998,"{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+69,DiffDock-L,1OF1_SCT,0.2,0.14285714285714282,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+70,DiffDock-L,1SJ0_E4D,0.6666666666666666,0.3636363636363636,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 9, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+71,DiffDock-L,1U4D_DBQ,0.0,0.19999999999999998,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+72,DiffDock-L,1Q41_IXM,0.0,0.13333333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+73,DiffDock-L,1OWE_675,0.3333333333333333,0.22222222222222215,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+74,DiffDock-L,1OQ5_CEL,0.0,0.2666666666666666,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+75,DiffDock-L,2BR1_PFP,0.0,0.49999999999999994,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+76,DiffDock-L,1UOU_CMU,0.3333333333333333,0.4166666666666667,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+77,DiffDock-L,1V0P_PVB,0.0,0.5,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+78,DiffDock-L,1XOZ_CIA,0.0,0.1333333333333333,"{'UNL:ALA:Hydrophobic': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+79,DiffDock-L,1R55_097,0.2,0.19999999999999998,"{'UNL:ALA:HBDonor': 2, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBDonor': 2, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+80,DiffDock-L,1YWR_LI9,0.5,0.2777777777777778,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+81,DiffDock-L,1HQ2_PH2,0.16666666666666666,0.09090909090909091,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+82,DiffDock-L,1V4S_MRK,0.6000000000000001,0.13636363636363635,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3}"
+83,DiffDock-L,1NAV_IH5,0.0,0.0714285714285714,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+84,DiffDock-L,1JJE_BYS,0.5,0.39999999999999997,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 3, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+85,DiffDock-L,1J3J_CP6,0.0,0.3333333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}"
+86,DiffDock-L,1N2V_BDI,0.3333333333333333,0.22222222222222215,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+87,DiffDock-L,1W1P_GIO,0.0,0.18181818181818174,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+88,DiffDock-L,1S3V_TQD,0.0,0.41666666666666663,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+89,DiffDock-L,1Y6B_AAX,0.6666666666666666,0.2857142857142857,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+90,DiffDock-L,1L2S_STC,0.25,0.09090909090909091,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 1}"
+91,DiffDock-L,1W2G_THM,0.5,0.4,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}"
+92,DiffDock-L,1TOW_CRZ,0.3333333333333333,0.21428571428571422,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+93,DiffDock-L,1XM6_5RM,0.0,0.2857142857142857,"{'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+94,DiffDock-L,1YGC_905,0.3333333333333333,0.1428571428571428,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+95,DiffDock-L,1R58_AO5,0.0,0.07692307692307693,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+96,DiffDock-L,1HNN_SKF,0.0,0.23076923076923078,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:VdWContact': 1}"
+97,DiffDock-L,1OPK_P16,0.0,0.21052631578947367,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+98,DiffDock-L,1SQN_NDR,0.5,0.21428571428571422,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+99,DynamicBind,1M2Z_DEX,0.16666666666666663,0.2222222222222223,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 4, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+100,DynamicBind,1P62_GEO,0.75,0.1818181818181818,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+101,DynamicBind,1KE5_LS1,0.5,0.20000000000000007,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+102,DynamicBind,1UML_FR4,0.0,0.3529411764705882,"{'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+103,DynamicBind,1JLA_TNK,0.0,0.05882352941176472,"{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+104,DynamicBind,1N46_PFA,0.7999999999999999,0.11111111111111116,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+105,DynamicBind,1MEH_MOA,0.25,0.30000000000000004,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2}"
+106,DynamicBind,1V48_HA1,0.6666666666666666,0.2,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+107,DynamicBind,1L7F_BCZ,1.0,0.5714285714285714,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 6, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+108,DynamicBind,1JD0_AZM,0.33333333333333337,0.28571428571428575,"{'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+109,DynamicBind,1LPZ_CMB,0.5,0.17647058823529416,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+110,DynamicBind,1OYT_FSN,0.0,0.14285714285714282,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+111,DynamicBind,1K3U_IAD,0.875,0.3333333333333332,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 4, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+112,DynamicBind,1IA1_TQ3,0.5,0.4166666666666667,"{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1}"
+113,DynamicBind,1Q1G_MTI,0.3333333333333333,0.21052631578947367,"{'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+114,DynamicBind,1R1H_BIR,0.2,0.4,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+115,DynamicBind,1HWW_SWA,0.0,0.19999999999999998,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 4, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+116,DynamicBind,1GKC_NFH,0.33333333333333337,0.5,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+117,DynamicBind,1HP0_AD3,0.6666666666666667,0.09090909090909083,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+118,DynamicBind,1OF1_SCT,0.5,0.14285714285714282,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+119,DynamicBind,1U4D_DBQ,0.0,0.5,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+120,DynamicBind,1Q41_IXM,0.3333333333333333,0.19999999999999998,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+121,DynamicBind,1OWE_675,0.0,0.0,"{'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+122,DynamicBind,1OQ5_CEL,0.25,0.2941176470588236,"{'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+123,DynamicBind,1UOU_CMU,0.3333333333333333,0.6363636363636364,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+124,DynamicBind,1R55_097,0.5,0.39999999999999997,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 4, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBDonor': 2, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+125,DynamicBind,1HQ2_PH2,0.6666666666666666,0.0,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+126,DynamicBind,1MZC_BNE,0.3333333333333333,0.8181818181818181,"{'UNL:ALA:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 5, 'UNL:TYR:VdWContact': 4}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+127,DynamicBind,1NAV_IH5,0.0,0.07142857142857142,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+128,DynamicBind,1JJE_BYS,0.25,0.22222222222222218,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 3, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+129,DynamicBind,1PMN_984,0.0,0.4666666666666666,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+130,DynamicBind,1N2V_BDI,0.6666666666666667,0.09999999999999998,"{'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+131,DynamicBind,1Y6B_AAX,0.3333333333333333,0.3529411764705882,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+132,DynamicBind,1L2S_STC,0.5,0.08333333333333337,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 1}"
+133,DynamicBind,1TOW_CRZ,0.3333333333333333,0.0714285714285714,"{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+134,DynamicBind,1YGC_905,0.0,0.1875,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 3, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+135,DynamicBind,1MMV_3AR,0.6666666666666667,0.52,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+136,NeuralPLexer,1KE5_LS1,0.5,0.33333333333333337,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+137,NeuralPLexer,1VCJ_IBA,1.5,0.125,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 5, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 5, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 4, 'UNL:ILE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+138,NeuralPLexer,1HWI_115,0.3333333333333333,0.41666666666666663,"{'UNL:ALA:Hydrophobic': 4, 'UNL:ALA:VdWContact': 3, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 3, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+139,NeuralPLexer,1UML_FR4,1.0,0.35714285714285704,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 4, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+140,NeuralPLexer,1JLA_TNK,0.0,0.26923076923076916,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+141,NeuralPLexer,1N46_PFA,1.0,0.33333333333333337,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+142,NeuralPLexer,1N2J_PAF,0.5,0.5,"{'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+143,NeuralPLexer,1MEH_MOA,0.16666666666666669,0.5384615384615383,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2}"
+144,NeuralPLexer,1V48_HA1,0.6666666666666666,0.25,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+145,NeuralPLexer,1L7F_BCZ,0.9999999999999998,0.23076923076923073,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+146,NeuralPLexer,1JD0_AZM,0.75,0.2857142857142857,"{'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+147,NeuralPLexer,1S19_MC9,0.5,0.21052631578947378,"{'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 6, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+148,NeuralPLexer,1X8X_TYR,0.3333333333333333,0.5555555555555556,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+149,NeuralPLexer,1T46_STI,0.5,0.2608695652173913,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 2, 'UNL:CYS:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 4}"
+150,NeuralPLexer,1IG3_VIB,0.5,0.24999999999999994,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1}"
+151,NeuralPLexer,1SQ5_PAU,0.0,0.14285714285714285,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+152,NeuralPLexer,1OYT_FSN,0.25,0.23076923076923067,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+153,NeuralPLexer,1UNL_RRC,0.5,0.611111111111111,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+154,NeuralPLexer,1U1C_BAU,0.6000000000000001,0.23076923076923078,"{'UNL:ARG:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+155,NeuralPLexer,1K3U_IAD,0.875,0.5217391304347825,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 4, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+156,NeuralPLexer,1IA1_TQ3,0.5,0.36363636363636354,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1}"
+157,NeuralPLexer,1R1H_BIR,0.6000000000000001,0.4000000000000001,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+158,NeuralPLexer,1YQY_915,0.4,0.23529411764705882,"{'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+159,NeuralPLexer,1HWW_SWA,0.25,0.3333333333333334,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 4, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+160,NeuralPLexer,1T40_ID5,0.6000000000000001,0.3333333333333333,"{'UNL:CYS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+161,NeuralPLexer,1GKC_NFH,0.8,0.4117647058823529,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+162,NeuralPLexer,1N1M_A3M,0.6666666666666667,0.38461538461538475,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 2}"
+163,NeuralPLexer,1HP0_AD3,1.0,0.18181818181818182,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2}","{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+164,NeuralPLexer,1U4D_DBQ,0.3999999999999999,0.7000000000000001,"{'UNL:ALA:Hydrophobic': 3, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBDonor': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 3}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+165,NeuralPLexer,1OWE_675,0.0,0.33333333333333326,"{'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+166,NeuralPLexer,2BR1_PFP,0.0,0.46666666666666673,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 3, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+167,NeuralPLexer,1UOU_CMU,0.6666666666666666,0.5384615384615385,"{'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+168,NeuralPLexer,1TZ8_DES,1.0,1.4285714285714284,"{'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 5}","{'UNL:ALA:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 2}"
+169,NeuralPLexer,1R55_097,0.6,0.36363636363636376,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBDonor': 2, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+170,NeuralPLexer,1YWR_LI9,0.5,0.5555555555555556,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+171,NeuralPLexer,1HQ2_PH2,0.6666666666666666,0.0,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+172,NeuralPLexer,1MZC_BNE,0.0,0.3529411764705882,"{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 3, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+173,NeuralPLexer,1V4S_MRK,0.6000000000000001,0.11111111111111116,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3}"
+174,NeuralPLexer,1N2V_BDI,0.6666666666666666,0.3,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+175,NeuralPLexer,1S3V_TQD,0.0,0.16666666666666657,"{'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+176,NeuralPLexer,1Y6B_AAX,0.25,0.16666666666666669,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 2, 'UNL:CYS:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+177,NeuralPLexer,1L2S_STC,0.6000000000000001,0.23076923076923073,"{'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 1}"
+178,NeuralPLexer,1W2G_THM,0.3333333333333333,0.25,"{'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}"
+179,NeuralPLexer,1TOW_CRZ,0.3333333333333333,0.33333333333333337,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+180,NeuralPLexer,1YGC_905,0.0,0.2222222222222223,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 4, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+181,NeuralPLexer,1R58_AO5,0.3333333333333333,0.27272727272727276,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+182,NeuralPLexer,1OPK_P16,0.5,0.1578947368421052,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+183,RFAA,1P62_GEO,0.75,0.3076923076923077,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+184,RFAA,1KE5_LS1,0.5,0.7692307692307693,"{'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+185,RFAA,1TT1_KAI,0.8333333333333334,0.19999999999999996,"{'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+186,RFAA,1VCJ_IBA,1.0,0.8666666666666666,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 5, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 4, 'UNL:ILE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+187,RFAA,1KZK_JE2,0.3333333333333333,0.7692307692307692,"{'UNL:ALA:VdWContact': 2, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLY:VdWContact': 5, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:PRO:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:Hydrophobic': 3, 'UNL:ASP:VdWContact': 4, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 6, 'UNL:LEU:Hydrophobic': 3, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4}"
+188,RFAA,1V48_HA1,0.8333333333333334,0.28571428571428575,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+189,RFAA,1L7F_BCZ,0.5999999999999999,0.28571428571428575,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+190,RFAA,1S19_MC9,0.3999999999999999,0.6666666666666667,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 6, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+191,RFAA,1LPZ_CMB,0.5,0.27777777777777785,"{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+192,RFAA,1X8X_TYR,0.5,0.5000000000000001,"{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+193,RFAA,1T46_STI,0.25,0.6521739130434784,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 4}"
+194,RFAA,1IG3_VIB,0.0,0.33333333333333326,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1}"
+195,RFAA,1K3U_IAD,0.8571428571428572,0.6,"{'UNL:ALA:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 4, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+196,RFAA,1R1H_BIR,0.75,0.20000000000000007,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+197,RFAA,1YVF_PH7,0.0,0.21739130434782605,"{'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+198,RFAA,1T40_ID5,0.6000000000000001,0.25,"{'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+199,RFAA,1GKC_NFH,0.4,0.3333333333333333,"{'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 4, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+200,RFAA,1OF1_SCT,0.6000000000000001,0.4000000000000001,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+201,RFAA,1OWE_675,0.0,0.29999999999999993,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+202,RFAA,1SG0_STL,0.3333333333333333,0.5833333333333334,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+203,RFAA,2BR1_PFP,0.0,0.06666666666666665,"{'UNL:ALA:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+204,RFAA,1UOU_CMU,0.5,0.8181818181818182,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 4, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+205,RFAA,1R55_097,0.16666666666666663,0.7272727272727273,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 4, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBDonor': 2, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+206,RFAA,1YWR_LI9,0.5,0.7368421052631581,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+207,RFAA,1HQ2_PH2,0.3333333333333333,0.08333333333333333,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+208,RFAA,1V4S_MRK,0.3333333333333333,0.3157894736842105,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3}"
+209,RFAA,1PMN_984,0.5,0.5,"{'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 3, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+210,RFAA,1N2V_BDI,0.0,0.33333333333333337,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+211,RFAA,1S3V_TQD,0.0,0.16666666666666657,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+212,RFAA,1Y6B_AAX,0.3333333333333333,0.3571428571428571,"{'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+213,RFAA,1W2G_THM,0.39999999999999997,0.1875,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}"
+214,RFAA,1YGC_905,0.6666666666666667,0.17647058823529416,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBDonor': 2, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+215,RFAA,1R58_AO5,0.39999999999999997,0.6666666666666667,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 4, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+216,RFAA,1HNN_SKF,0.0,0.5714285714285714,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 5, 'UNL:TYR:VdWContact': 4, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:VdWContact': 1}"
+217,RFAA,1OPK_P16,0.0,0.24999999999999994,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+218,Chai-1-Single-Seq,2BM2_PM2,0.0,0.21428571428571436,"{'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+219,Chai-1-Single-Seq,1XOQ_ROF,0.0,0.23076923076923084,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+220,Chai-1-Single-Seq,1M2Z_DEX,0.39999999999999997,0.052631578947368474,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+221,Chai-1-Single-Seq,1P62_GEO,0.2,0.36363636363636365,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+222,Chai-1-Single-Seq,1KE5_LS1,0.0,0.25,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+223,Chai-1-Single-Seq,1TT1_KAI,0.16666666666666666,0.09999999999999998,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+224,Chai-1-Single-Seq,1UML_FR4,1.0,0.3333333333333333,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2}","{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+225,Chai-1-Single-Seq,1JLA_TNK,0.0,0.33333333333333337,"{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+226,Chai-1-Single-Seq,1N46_PFA,0.7999999999999999,0.25,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+227,Chai-1-Single-Seq,1LRH_NLA,0.0,0.2941176470588236,"{'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1}"
+228,Chai-1-Single-Seq,1KZK_JE2,0.5,0.6666666666666665,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 4, 'UNL:ASP:VdWContact': 5, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 4, 'UNL:ILE:Hydrophobic': 6, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 3}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:Hydrophobic': 3, 'UNL:ASP:VdWContact': 4, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 6, 'UNL:LEU:Hydrophobic': 3, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4}"
+229,Chai-1-Single-Seq,1N2J_PAF,0.0,0.0,"{'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+230,Chai-1-Single-Seq,2BSM_BSM,0.0,0.11111111111111102,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+231,Chai-1-Single-Seq,1V48_HA1,0.3333333333333333,0.0,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+232,Chai-1-Single-Seq,1L7F_BCZ,1.25,0.23076923076923084,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+233,Chai-1-Single-Seq,1JD0_AZM,0.6666666666666667,0.14285714285714285,"{'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+234,Chai-1-Single-Seq,1S19_MC9,0.3333333333333333,0.2941176470588236,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 4, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 6, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+235,Chai-1-Single-Seq,1LPZ_CMB,0.0,0.26315789473684215,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+236,Chai-1-Single-Seq,1X8X_TYR,0.6666666666666667,0.22222222222222215,"{'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+237,Chai-1-Single-Seq,1T46_STI,0.25,0.45833333333333337,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 4}"
+238,Chai-1-Single-Seq,1IG3_VIB,0.0,0.33333333333333337,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1}"
+239,Chai-1-Single-Seq,1SQ5_PAU,0.25,0.41666666666666663,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+240,Chai-1-Single-Seq,1Q4G_BFL,0.3333333333333333,0.6000000000000001,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+241,Chai-1-Single-Seq,1OYT_FSN,0.0,0.3125,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+242,Chai-1-Single-Seq,1UNL_RRC,0.3333333333333333,0.375,"{'UNL:ALA:Hydrophobic': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+243,Chai-1-Single-Seq,1U1C_BAU,0.25,0.42857142857142855,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+244,Chai-1-Single-Seq,1K3U_IAD,0.2857142857142857,0.14285714285714282,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 4, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 4, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+245,Chai-1-Single-Seq,1IA1_TQ3,0.0,0.23076923076923078,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1}"
+246,Chai-1-Single-Seq,1R1H_BIR,0.0,0.4375,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 4, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+247,Chai-1-Single-Seq,1YQY_915,0.0,0.1428571428571429,"{'UNL:GLU:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+248,Chai-1-Single-Seq,1T40_ID5,0.5,0.28571428571428575,"{'UNL:CYS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+249,Chai-1-Single-Seq,1GKC_NFH,0.2,0.21428571428571427,"{'UNL:ALA:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+250,Chai-1-Single-Seq,1Z95_198,0.0,0.14285714285714293,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 4, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+251,Chai-1-Single-Seq,1HP0_AD3,0.5,0.09090909090909088,"{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+252,Chai-1-Single-Seq,1OF1_SCT,0.2,0.13333333333333333,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+253,Chai-1-Single-Seq,1SJ0_E4D,0.25,0.10526315789473689,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+254,Chai-1-Single-Seq,1U4D_DBQ,0.0,0.36363636363636354,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+255,Chai-1-Single-Seq,1Q41_IXM,0.0,0.14285714285714285,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+256,Chai-1-Single-Seq,1OWE_675,0.0,0.25,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+257,Chai-1-Single-Seq,1OQ5_CEL,0.0,0.16666666666666674,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+258,Chai-1-Single-Seq,2BR1_PFP,0.0,0.0714285714285714,"{'UNL:ALA:Hydrophobic': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+259,Chai-1-Single-Seq,1UOU_CMU,0.0,0.2,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+260,Chai-1-Single-Seq,1R9O_FLP,0.5,0.3125,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+261,Chai-1-Single-Seq,1V0P_PVB,0.0,0.3125,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+262,Chai-1-Single-Seq,1XOZ_CIA,0.0,0.06666666666666667,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+263,Chai-1-Single-Seq,1R55_097,0.0,0.09999999999999998,"{'UNL:ALA:HBDonor': 2, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBDonor': 2, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+264,Chai-1-Single-Seq,1YWR_LI9,0.3333333333333333,0.0,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+265,Chai-1-Single-Seq,1HQ2_PH2,0.0,0.0,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+266,Chai-1-Single-Seq,1V4S_MRK,0.3333333333333333,0.2777777777777778,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3}"
+267,Chai-1-Single-Seq,1NAV_IH5,0.5,0.1875,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+268,Chai-1-Single-Seq,1JJE_BYS,0.6666666666666666,0.0625,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 3, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+269,Chai-1-Single-Seq,1J3J_CP6,0.0,0.26666666666666666,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}"
+270,Chai-1-Single-Seq,1T9B_1CS,0.0,0.25,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+271,Chai-1-Single-Seq,1PMN_984,0.5,0.4666666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+272,Chai-1-Single-Seq,1N2V_BDI,0.0,0.3333333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+273,Chai-1-Single-Seq,1S3V_TQD,0.3333333333333333,0.4615384615384616,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+274,Chai-1-Single-Seq,1Y6B_AAX,0.0,0.17647058823529416,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 2, 'UNL:CYS:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+275,Chai-1-Single-Seq,1L2S_STC,0.0,0.36363636363636354,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 1}"
+276,Chai-1-Single-Seq,1W2G_THM,0.0,0.0,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}"
+277,Chai-1-Single-Seq,1TOW_CRZ,0.5,0.07692307692307687,"{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+278,Chai-1-Single-Seq,1XM6_5RM,0.5,0.21428571428571422,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+279,Chai-1-Single-Seq,1YGC_905,0.3333333333333333,0.1538461538461538,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+280,Chai-1-Single-Seq,1R58_AO5,0.0,0.21428571428571422,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+281,Chai-1-Single-Seq,1HNN_SKF,0.0,0.4545454545454546,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:VdWContact': 1}"
+282,Chai-1-Single-Seq,1SQN_NDR,0.5,0.2857142857142857,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+283,Chai-1,2BM2_PM2,0.5,0.26666666666666666,"{'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+284,Chai-1,1XOQ_ROF,0.0,0.21428571428571433,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+285,Chai-1,1M2Z_DEX,0.75,0.17647058823529413,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+286,Chai-1,1P62_GEO,0.2,0.25,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+287,Chai-1,1KE5_LS1,0.0,0.14285714285714293,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+288,Chai-1,1TT1_KAI,0.16666666666666666,0.18181818181818174,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+289,Chai-1,1VCJ_IBA,0.5,0.19999999999999996,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 5, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 4, 'UNL:ILE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+290,Chai-1,1HWI_115,0.5,0.31578947368421056,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 3, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+291,Chai-1,1UML_FR4,0.0,0.3076923076923078,"{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+292,Chai-1,1JLA_TNK,0.3333333333333333,0.040000000000000036,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+293,Chai-1,1N46_PFA,0.4,0.3125,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+294,Chai-1,1KZK_JE2,0.5,0.36363636363636365,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 4, 'UNL:ASP:VdWContact': 4, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 4, 'UNL:ILE:Hydrophobic': 6, 'UNL:LEU:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:Hydrophobic': 3, 'UNL:ASP:VdWContact': 4, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 6, 'UNL:LEU:Hydrophobic': 3, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4}"
+295,Chai-1,1N2J_PAF,0.6666666666666667,0.49999999999999994,"{'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+296,Chai-1,1MEH_MOA,0.3333333333333333,0.375,"{'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2}"
+297,Chai-1,2BSM_BSM,0.0,0.1111111111111111,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+298,Chai-1,1V48_HA1,0.16666666666666666,0.07692307692307693,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+299,Chai-1,1L7F_BCZ,0.25,0.4,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 5, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+300,Chai-1,1JD0_AZM,0.33333333333333337,0.25,"{'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+301,Chai-1,1S19_MC9,0.25,0.3529411764705882,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 6, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+302,Chai-1,1LPZ_CMB,0.5,0.17647058823529416,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+303,Chai-1,1X8X_TYR,0.5,0.2222222222222221,"{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+304,Chai-1,1T46_STI,0.25,0.45833333333333337,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 4}"
+305,Chai-1,1IG3_VIB,0.0,0.27272727272727276,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1}"
+306,Chai-1,1Q4G_BFL,0.3333333333333333,0.41666666666666674,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+307,Chai-1,1OYT_FSN,0.3333333333333333,0.1875,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+308,Chai-1,1UNL_RRC,0.3333333333333333,0.17647058823529416,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+309,Chai-1,1U1C_BAU,0.25,0.33333333333333326,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+310,Chai-1,1K3U_IAD,0.08333333333333337,0.19047619047619058,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 4, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 4, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+311,Chai-1,1IA1_TQ3,0.0,0.09090909090909091,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1}"
+312,Chai-1,1Q1G_MTI,0.0,0.06666666666666667,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+313,Chai-1,1R1H_BIR,0.25,0.13333333333333341,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+314,Chai-1,1YVF_PH7,0.3333333333333333,0.08333333333333331,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+315,Chai-1,1YQY_915,0.4,0.0714285714285714,"{'UNL:GLU:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+316,Chai-1,1HWW_SWA,1.0,0.11111111111111116,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 4, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+317,Chai-1,1T40_ID5,0.5,0.28571428571428575,"{'UNL:CYS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+318,Chai-1,1GKC_NFH,0.39999999999999997,0.14285714285714285,"{'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+319,Chai-1,1Z95_198,0.0,0.07142857142857142,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+320,Chai-1,1HP0_AD3,0.6666666666666666,0.29999999999999993,"{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+321,Chai-1,1OF1_SCT,0.5,0.15384615384615374,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+322,Chai-1,1SJ0_E4D,0.25,0.19047619047619052,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 9, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+323,Chai-1,1U4D_DBQ,0.3333333333333333,0.19999999999999998,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+324,Chai-1,1Q41_IXM,0.0,0.08333333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+325,Chai-1,1OWE_675,0.0,0.375,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+326,Chai-1,1OQ5_CEL,0.0,0.11764705882352944,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+327,Chai-1,1SG0_STL,0.5,0.33333333333333337,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+328,Chai-1,2BR1_PFP,0.0,0.14285714285714285,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+329,Chai-1,1UOU_CMU,0.3333333333333333,0.08333333333333333,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+330,Chai-1,1TZ8_DES,0.5,0.5,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 3, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 2}"
+331,Chai-1,1R9O_FLP,0.5,0.33333333333333337,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+332,Chai-1,1V0P_PVB,0.5,0.6666666666666666,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+333,Chai-1,1XOZ_CIA,0.0,0.13333333333333336,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+334,Chai-1,1R55_097,0.0,0.20000000000000007,"{'UNL:ALA:HBDonor': 2, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBDonor': 2, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+335,Chai-1,1YWR_LI9,0.0,0.05263157894736836,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+336,Chai-1,1HQ2_PH2,0.16666666666666666,0.09090909090909091,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+337,Chai-1,1MZC_BNE,0.5,0.09090909090909083,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+338,Chai-1,1V4S_MRK,0.25,0.1176470588235293,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3}"
+339,Chai-1,1NAV_IH5,0.3333333333333333,0.28571428571428575,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+340,Chai-1,1JJE_BYS,0.25,0.26666666666666666,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 3, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+341,Chai-1,1J3J_CP6,0.5,0.24999999999999994,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}"
+342,Chai-1,1T9B_1CS,0.0,0.14285714285714293,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+343,Chai-1,1PMN_984,0.5,0.2857142857142857,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+344,Chai-1,1N2V_BDI,0.0,0.2,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+345,Chai-1,1S3V_TQD,0.0,0.3636363636363636,"{'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1}","{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+346,Chai-1,1Y6B_AAX,0.0,0.0,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+347,Chai-1,1L2S_STC,0.0,0.2727272727272727,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 1}"
+348,Chai-1,1W2G_THM,0.3333333333333333,0.09999999999999998,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}"
+349,Chai-1,1TOW_CRZ,0.0,0.23076923076923067,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+350,Chai-1,1XM6_5RM,0.0,0.23076923076923084,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+351,Chai-1,1YGC_905,0.3333333333333333,0.2857142857142857,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+352,Chai-1,1R58_AO5,0.0,0.28571428571428564,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+353,Chai-1,1OPK_P16,0.0,0.1875,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+354,Chai-1,1MMV_3AR,0.3333333333333333,0.07692307692307693,"{'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+355,Chai-1,1SQN_NDR,0.0,0.1428571428571429,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+356,Boltz-1-Single-Seq,1M2Z_DEX,0.0,0.2222222222222222,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 4, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+357,Boltz-1-Single-Seq,1P62_GEO,0.0,0.3846153846153846,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+358,Boltz-1-Single-Seq,1KE5_LS1,0.25,0.07142857142857142,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+359,Boltz-1-Single-Seq,1TT1_KAI,0.0,0.16666666666666657,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+360,Boltz-1-Single-Seq,1VCJ_IBA,1.0,0.3571428571428571,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 4, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 4, 'UNL:ILE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 5, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 4, 'UNL:ILE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+361,Boltz-1-Single-Seq,1UML_FR4,0.0,0.23076923076923078,"{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+362,Boltz-1-Single-Seq,1JLA_TNK,0.0,0.27777777777777785,"{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+363,Boltz-1-Single-Seq,1N46_PFA,0.39999999999999997,0.11764705882352942,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+364,Boltz-1-Single-Seq,1KZK_JE2,0.5,0.6363636363636364,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 4, 'UNL:ASP:VdWContact': 4, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 5, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:Hydrophobic': 3, 'UNL:ASP:VdWContact': 4, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 6, 'UNL:LEU:Hydrophobic': 3, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4}"
+365,Boltz-1-Single-Seq,1N2J_PAF,1.0,0.0,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+366,Boltz-1-Single-Seq,1MEH_MOA,0.6666666666666666,0.11111111111111105,"{'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2}"
+367,Boltz-1-Single-Seq,2BSM_BSM,0.0,0.05555555555555555,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+368,Boltz-1-Single-Seq,1V48_HA1,0.0,0.06666666666666668,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+369,Boltz-1-Single-Seq,1L7F_BCZ,0.19999999999999996,0.16666666666666666,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+370,Boltz-1-Single-Seq,1JD0_AZM,0.0,0.28571428571428564,"{'UNL:HIS:HBDonor': 2, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+371,Boltz-1-Single-Seq,1S19_MC9,0.25,0.2941176470588236,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 4, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 6, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+372,Boltz-1-Single-Seq,1X8X_TYR,1.0,0.11111111111111105,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+373,Boltz-1-Single-Seq,1T46_STI,0.0,0.09999999999999998,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 3, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 4}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 4}"
+374,Boltz-1-Single-Seq,1IG3_VIB,0.0,0.18181818181818185,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1}"
+375,Boltz-1-Single-Seq,1OYT_FSN,0.0,0.2000000000000001,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+376,Boltz-1-Single-Seq,1K3U_IAD,0.7142857142857144,0.23076923076923073,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 4, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+377,Boltz-1-Single-Seq,1YV3_BIT,0.6666666666666666,0.23529411764705876,"{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+378,Boltz-1-Single-Seq,1IA1_TQ3,0.0,0.08333333333333334,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1}"
+379,Boltz-1-Single-Seq,1R1H_BIR,0.2,0.2857142857142856,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+380,Boltz-1-Single-Seq,1YVF_PH7,0.0,0.19047619047619052,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+381,Boltz-1-Single-Seq,1YQY_915,0.0,0.125,"{'UNL:GLU:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+382,Boltz-1-Single-Seq,1HWW_SWA,0.3333333333333333,0.11111111111111116,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 3, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+383,Boltz-1-Single-Seq,1T40_ID5,0.25,0.4285714285714286,"{'UNL:CYS:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+384,Boltz-1-Single-Seq,1Z95_198,0.6666666666666666,0.06666666666666665,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+385,Boltz-1-Single-Seq,1HP0_AD3,0.0,0.0,"{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+386,Boltz-1-Single-Seq,1OF1_SCT,0.0,0.14285714285714282,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+387,Boltz-1-Single-Seq,1SJ0_E4D,0.25,0.10000000000000009,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+388,Boltz-1-Single-Seq,1U4D_DBQ,0.3333333333333333,0.22222222222222215,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+389,Boltz-1-Single-Seq,1Q41_IXM,0.0,0.14285714285714282,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+390,Boltz-1-Single-Seq,1OWE_675,0.0,0.5,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+391,Boltz-1-Single-Seq,1OQ5_CEL,0.25,0.17647058823529416,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+392,Boltz-1-Single-Seq,1SG0_STL,0.5,0.14285714285714285,"{'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+393,Boltz-1-Single-Seq,2BR1_PFP,0.0,0.16666666666666669,"{'UNL:ALA:Hydrophobic': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+394,Boltz-1-Single-Seq,1UOU_CMU,0.3333333333333333,0.3636363636363637,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+395,Boltz-1-Single-Seq,1V0P_PVB,0.0,0.49999999999999994,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+396,Boltz-1-Single-Seq,1XOZ_CIA,0.0,0.19999999999999996,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+397,Boltz-1-Single-Seq,1R55_097,0.0,0.30000000000000004,"{'UNL:ALA:HBDonor': 2, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBDonor': 2, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+398,Boltz-1-Single-Seq,1YWR_LI9,0.0,0.21052631578947367,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+399,Boltz-1-Single-Seq,1HQ2_PH2,0.0,0.0,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+400,Boltz-1-Single-Seq,1V4S_MRK,0.25,0.13333333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3}"
+401,Boltz-1-Single-Seq,1NAV_IH5,0.6,0.19999999999999996,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+402,Boltz-1-Single-Seq,1JJE_BYS,0.6666666666666666,0.49999999999999994,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 3, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+403,Boltz-1-Single-Seq,1PMN_984,0.5,0.4375,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+404,Boltz-1-Single-Seq,1N2V_BDI,0.0,0.36363636363636365,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+405,Boltz-1-Single-Seq,1S3V_TQD,0.3333333333333333,0.4545454545454545,"{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+406,Boltz-1-Single-Seq,1Y6B_AAX,0.0,0.2666666666666666,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+407,Boltz-1-Single-Seq,1L2S_STC,0.5,0.07142857142857151,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 1}"
+408,Boltz-1-Single-Seq,1W2G_THM,0.3333333333333333,0.0,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}"
+409,Boltz-1-Single-Seq,1TOW_CRZ,0.5,0.1333333333333333,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+410,Boltz-1-Single-Seq,1XM6_5RM,0.5,0.3333333333333333,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+411,Boltz-1-Single-Seq,1R58_AO5,0.3333333333333333,0.4166666666666668,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 4, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+412,Boltz-1-Single-Seq,1HNN_SKF,0.5,0.08333333333333333,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:VdWContact': 1}"
+413,Boltz-1-Single-Seq,1OPK_P16,0.0,0.31578947368421056,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+414,Boltz-1-Single-Seq,1SQN_NDR,0.5,0.21428571428571422,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+415,Boltz-1,1M2Z_DEX,0.2,0.1666666666666666,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+416,Boltz-1,1P62_GEO,0.2,0.3846153846153846,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+417,Boltz-1,1KE5_LS1,0.25,0.14285714285714293,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+418,Boltz-1,1TT1_KAI,0.16666666666666666,0.15384615384615385,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+419,Boltz-1,1VCJ_IBA,1.0,0.05882352941176472,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 4, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 4, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 5, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 4, 'UNL:ILE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+420,Boltz-1,1UML_FR4,0.0,0.28571428571428564,"{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}","{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+421,Boltz-1,1JLA_TNK,0.0,0.38888888888888884,"{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+422,Boltz-1,1N46_PFA,0.4,0.25,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+423,Boltz-1,1KZK_JE2,0.5,0.5,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 4, 'UNL:ASP:VdWContact': 4, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 6, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 3, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:Hydrophobic': 3, 'UNL:ASP:VdWContact': 4, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 6, 'UNL:LEU:Hydrophobic': 3, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4}"
+424,Boltz-1,1MEH_MOA,0.6666666666666666,0.3,"{'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2}"
+425,Boltz-1,2BSM_BSM,0.0,0.11764705882352942,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+426,Boltz-1,1V48_HA1,0.33333333333333326,0.06666666666666668,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+427,Boltz-1,1L7F_BCZ,0.25,0.2727272727272728,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 5, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+428,Boltz-1,1JD0_AZM,0.0,0.28571428571428564,"{'UNL:HIS:HBDonor': 2, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+429,Boltz-1,1S19_MC9,0.25,0.23529411764705888,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 6, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+430,Boltz-1,1X8X_TYR,0.5,0.11111111111111105,"{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+431,Boltz-1,1T46_STI,0.0,0.14285714285714285,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 4}"
+432,Boltz-1,1IG3_VIB,0.0,0.18181818181818185,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1}"
+433,Boltz-1,1OYT_FSN,0.0,0.3125,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+434,Boltz-1,1K3U_IAD,0.42857142857142855,0.2857142857142857,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 4, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+435,Boltz-1,1YV3_BIT,0.3333333333333333,0.27777777777777785,"{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+436,Boltz-1,1IA1_TQ3,0.0,0.08333333333333334,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1}"
+437,Boltz-1,1R1H_BIR,0.25,0.25,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+438,Boltz-1,1YVF_PH7,0.0,0.18181818181818177,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+439,Boltz-1,1YQY_915,0.16666666666666666,0.23529411764705882,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+440,Boltz-1,1HWW_SWA,0.25,0.11111111111111116,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 4, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+441,Boltz-1,1T40_ID5,0.0,0.3571428571428572,"{'UNL:CYS:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+442,Boltz-1,1Z95_198,0.6666666666666666,0.14285714285714293,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+443,Boltz-1,1HP0_AD3,0.0,0.1,"{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+444,Boltz-1,1OF1_SCT,0.2,0.23076923076923073,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+445,Boltz-1,1SJ0_E4D,0.25,0.19047619047619058,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 9, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+446,Boltz-1,1U4D_DBQ,0.3333333333333333,0.22222222222222215,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+447,Boltz-1,1Q41_IXM,0.0,0.07692307692307687,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+448,Boltz-1,1OWE_675,0.0,0.375,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+449,Boltz-1,1OQ5_CEL,0.0,0.17647058823529416,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+450,Boltz-1,2BR1_PFP,0.0,0.08333333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+451,Boltz-1,1UOU_CMU,0.3333333333333333,0.3636363636363637,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+452,Boltz-1,1V0P_PVB,0.0,0.35294117647058826,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+453,Boltz-1,1XOZ_CIA,0.0,0.06666666666666665,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+454,Boltz-1,1R55_097,0.0,0.19999999999999996,"{'UNL:ALA:HBDonor': 2, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBDonor': 2, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+455,Boltz-1,1YWR_LI9,0.0,0.10526315789473684,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+456,Boltz-1,1HQ2_PH2,0.0,0.0,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+457,Boltz-1,1V4S_MRK,0.25,0.0,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3}"
+458,Boltz-1,1NAV_IH5,0.5,0.19999999999999998,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+459,Boltz-1,1JJE_BYS,0.6666666666666666,0.46666666666666673,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 3}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 3, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+460,Boltz-1,1PMN_984,0.5,0.3571428571428571,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+461,Boltz-1,1N2V_BDI,0.0,0.2727272727272727,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+462,Boltz-1,1S3V_TQD,0.3333333333333333,0.2727272727272726,"{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+463,Boltz-1,1Y6B_AAX,0.0,0.3571428571428573,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 2, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+464,Boltz-1,1L2S_STC,0.75,0.25,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 1}"
+465,Boltz-1,1W2G_THM,0.5,0.0,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}"
+466,Boltz-1,1TOW_CRZ,0.5,0.20000000000000007,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+467,Boltz-1,1XM6_5RM,0.0,0.23076923076923078,"{'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+468,Boltz-1,1R58_AO5,0.5,0.23076923076923067,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 4, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+469,Boltz-1,1HNN_SKF,0.0,0.07692307692307693,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:VdWContact': 1}"
+470,Boltz-1,1OPK_P16,0.0,0.42105263157894735,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+471,Boltz-1,1SQN_NDR,0.5,0.0714285714285714,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+472,AF3-Single-Seq,2BM2_PM2,0.0,0.5000000000000001,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 4}","{'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+473,AF3-Single-Seq,1P62_GEO,0.75,0.14285714285714285,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+474,AF3-Single-Seq,1TT1_KAI,0.8333333333333334,0.8181818181818181,"{'UNL:ARG:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+475,AF3-Single-Seq,1VCJ_IBA,0.6666666666666666,0.5000000000000001,"{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 5, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 4, 'UNL:ILE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+476,AF3-Single-Seq,1UML_FR4,0.3333333333333333,0.47619047619047605,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+477,AF3-Single-Seq,1KZK_JE2,0.0,0.5000000000000001,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:ILE:Hydrophobic': 6, 'UNL:ILE:VdWContact': 5, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:Hydrophobic': 3, 'UNL:ASP:VdWContact': 4, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 6, 'UNL:LEU:Hydrophobic': 3, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4}"
+478,AF3-Single-Seq,1MEH_MOA,0.19999999999999996,0.09090909090909088,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2}"
+479,AF3-Single-Seq,2BSM_BSM,0.5,0.4285714285714286,"{'UNL:ASN:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 4, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+480,AF3-Single-Seq,1V48_HA1,0.375,0.2941176470588236,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+481,AF3-Single-Seq,1L7F_BCZ,1.25,0.41666666666666663,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+482,AF3-Single-Seq,1JD0_AZM,0.75,1.1428571428571428,"{'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 4}","{'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+483,AF3-Single-Seq,1X8X_TYR,1.0,0.46153846153846156,"{'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 4, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+484,AF3-Single-Seq,1UNL_RRC,0.0,0.5789473684210527,"{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 3, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+485,AF3-Single-Seq,1K3U_IAD,1.0,0.6666666666666665,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 4, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+486,AF3-Single-Seq,1Q1G_MTI,0.5,0.8125,"{'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LIG:HBDonor': 1, 'UNL:LIG:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+487,AF3-Single-Seq,1R1H_BIR,0.75,0.16666666666666669,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+488,AF3-Single-Seq,1YVF_PH7,0.3333333333333333,0.34615384615384615,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+489,AF3-Single-Seq,1YQY_915,0.6,0.35714285714285715,"{'UNL:GLU:VdWContact': 4, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+490,AF3-Single-Seq,1HWW_SWA,0.3333333333333333,0.6153846153846153,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+491,AF3-Single-Seq,1T40_ID5,0.75,0.33333333333333337,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+492,AF3-Single-Seq,1HP0_AD3,0.5,0.5454545454545454,"{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+493,AF3-Single-Seq,1U4D_DBQ,0.5,0.1538461538461538,"{'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:TRP:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+494,AF3-Single-Seq,1OWE_675,0.0,0.5833333333333334,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+495,AF3-Single-Seq,1SG0_STL,0.3333333333333333,0.6000000000000001,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+496,AF3-Single-Seq,1UOU_CMU,0.5,0.3333333333333334,"{'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+497,AF3-Single-Seq,1R9O_FLP,0.3333333333333333,0.09523809523809534,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+498,AF3-Single-Seq,1V0P_PVB,0.0,0.5652173913043479,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+499,AF3-Single-Seq,1XOZ_CIA,0.0,0.38888888888888884,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+500,AF3-Single-Seq,1R55_097,0.6666666666666666,0.23076923076923073,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBDonor': 2, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+501,AF3-Single-Seq,1HQ2_PH2,0.8333333333333334,0.14285714285714285,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+502,AF3-Single-Seq,1V4S_MRK,0.14285714285714285,0.08695652173913038,"{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3}"
+503,AF3-Single-Seq,1NAV_IH5,0.0,0.3684210526315789,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+504,AF3-Single-Seq,1JJE_BYS,0.5,0.10000000000000003,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 3, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+505,AF3-Single-Seq,1J3J_CP6,0.6666666666666667,0.11764705882352944,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}"
+506,AF3-Single-Seq,1N2V_BDI,0.19999999999999996,0.5499999999999999,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+507,AF3-Single-Seq,1L2S_STC,0.3333333333333333,0.33333333333333326,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 1}"
+508,AF3-Single-Seq,1TOW_CRZ,0.0,0.21428571428571422,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+509,AF3-Single-Seq,1R58_AO5,0.19999999999999996,0.27777777777777785,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+510,AF3-Single-Seq,1MMV_3AR,0.3333333333333333,0.7692307692307692,"{'UNL:ILE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+511,AF3-Single-Seq,1SQN_NDR,0.5,0.49999999999999994,"{'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+512,AF3,2BM2_PM2,0.0,0.16666666666666663,"{'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+513,AF3,1M2Z_DEX,0.25,0.2222222222222222,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 4, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+514,AF3,1P62_GEO,0.0,0.2727272727272727,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+515,AF3,1KE5_LS1,0.25,0.07142857142857142,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+516,AF3,1TT1_KAI,0.16666666666666666,0.16666666666666657,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
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+522,AF3,1KZK_JE2,0.5,0.5454545454545454,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 4, 'UNL:ASP:VdWContact': 4, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 5, 'UNL:ILE:Hydrophobic': 6, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:Hydrophobic': 3, 'UNL:ASP:VdWContact': 4, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 6, 'UNL:LEU:Hydrophobic': 3, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4}"
+523,AF3,1N2J_PAF,0.0,0.22222222222222215,"{'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+524,AF3,1MEH_MOA,0.0,0.25,"{'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2}"
+525,AF3,2BSM_BSM,0.0,0.1875,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+526,AF3,1V48_HA1,0.3333333333333333,0.1875,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+527,AF3,1L7F_BCZ,0.0,0.20000000000000007,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
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+575,AF3,1TOW_CRZ,0.5,0.1538461538461538,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
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+577,AF3,1YGC_905,0.25,0.1428571428571429,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+578,AF3,1R58_AO5,0.25,0.28571428571428564,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 4, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+579,AF3,1HNN_SKF,0.0,0.16666666666666657,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:VdWContact': 1}"
+580,AF3,1OPK_P16,0.0,0.29411764705882343,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+581,AF3,1MMV_3AR,0.3333333333333333,0.07142857142857142,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+582,AF3,1SQN_NDR,0.5,0.14285714285714282,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
diff --git a/notebooks/astex_diverse_structured_vs_unstructured_emd_values.png b/notebooks/astex_diverse_structured_vs_unstructured_emd_values.png
new file mode 100644
index 00000000..54dcb747
Binary files /dev/null and b/notebooks/astex_diverse_structured_vs_unstructured_emd_values.png differ
diff --git a/notebooks/astex_method_interaction_analysis_plotting.ipynb b/notebooks/astex_method_interaction_analysis_plotting.ipynb
index 8fe5d64f..8b9c1fd5 100644
--- a/notebooks/astex_method_interaction_analysis_plotting.ipynb
+++ b/notebooks/astex_method_interaction_analysis_plotting.ipynb
@@ -88,6 +88,8 @@
     "    \"rfaa\",\n",
     "    \"chai-lab_ss\",\n",
     "    \"chai-lab\",\n",
+    "    \"boltz_ss\",\n",
+    "    \"boltz\",\n",
     "    \"alphafold3_ss\",\n",
     "    \"alphafold3\",\n",
     "]\n",
@@ -102,7 +104,7 @@
     ")\n",
     "assert os.path.exists(\n",
     "    ad_set_dir\n",
-    "), \"Please download the Astex Diverse set from `https://zenodo.org/records/14629652` before proceeding.\"\n",
+    "), \"Please download the Astex Diverse set from `https://zenodo.org/records/16791095` before proceeding.\"\n",
     "\n",
     "# Mappings\n",
     "method_mapping = {\n",
@@ -113,6 +115,8 @@
     "    \"rfaa\": \"RFAA\",\n",
     "    \"chai-lab_ss\": \"Chai-1-Single-Seq\",\n",
     "    \"chai-lab\": \"Chai-1\",\n",
+    "    \"boltz_ss\": \"Boltz-1-Single-Seq\",\n",
+    "    \"boltz\": \"Boltz-1\",\n",
     "    \"alphafold3_ss\": \"AF3-Single-Seq\",\n",
     "    \"alphafold3\": \"AF3\",\n",
     "}\n",
diff --git a/notebooks/astex_method_interaction_analysis_plotting.py b/notebooks/astex_method_interaction_analysis_plotting.py
index 6e600ada..842b876d 100644
--- a/notebooks/astex_method_interaction_analysis_plotting.py
+++ b/notebooks/astex_method_interaction_analysis_plotting.py
@@ -53,6 +53,8 @@
     "rfaa",
     "chai-lab_ss",
     "chai-lab",
+    "boltz_ss",
+    "boltz",
     "alphafold3_ss",
     "alphafold3",
 ]
@@ -67,7 +69,7 @@
 )
 assert os.path.exists(
     ad_set_dir
-), "Please download the Astex Diverse set from `https://zenodo.org/records/14629652` before proceeding."
+), "Please download the Astex Diverse set from `https://zenodo.org/records/16791095` before proceeding."
 
 # Mappings
 method_mapping = {
@@ -78,6 +80,8 @@
     "rfaa": "RFAA",
     "chai-lab_ss": "Chai-1-Single-Seq",
     "chai-lab": "Chai-1",
+    "boltz_ss": "Boltz-1-Single-Seq",
+    "boltz": "Boltz-1",
     "alphafold3_ss": "AF3-Single-Seq",
     "alphafold3": "AF3",
 }
diff --git a/notebooks/biosynthetic_protein_pdb_report.csv b/notebooks/biosynthetic_protein_pdb_report.csv
new file mode 100644
index 00000000..28c8998e
--- /dev/null
+++ b/notebooks/biosynthetic_protein_pdb_report.csv
@@ -0,0 +1,1620 @@
+Entry ID,Deposition Date,Refinement Resolution (Å),Unnamed: 3
+1FC5,2000-07-17,2.2,
+1HO1,2000-12-08,2.0,
+1HO4,2000-12-08,2.3,
+1I24,2001-02-05,1.2,
+1I2B,2001-02-07,1.75,
+1I2C,2001-02-07,1.6,
+1IXN,2002-06-28,2.3,
+1IXO,2002-06-28,2.3,
+1IXP,2002-06-28,2.3,
+1IXQ,2002-06-28,2.3,
+1IZ6,2002-09-25,2.0,
+1JY8,2001-09-11,2.5,
+1L5A,2002-03-06,2.55,
+1M5W,2002-07-10,1.96,
+1MKZ,2002-08-29,1.6,
+1MWR,2002-10-01,2.45,
+1MWS,2002-10-01,2.0,
+1MWT,2002-10-01,2.45,
+1MWU,2002-10-01,2.6,
+1N0E,2002-10-13,2.7,
+1N0F,2002-10-13,2.8,
+1N0G,2002-10-13,2.8,
+1N9W,2002-11-26,2.3,
+1NCE,2002-12-05,2.4,
+1NP6,2003-01-17,1.9,
+1NQ4,2003-01-21,,
+1NWV,2003-02-07,,
+1O13,2002-10-15,1.83,
+1OR5,2003-03-11,,
+1OTV,2003-03-23,2.1,
+1OTW,2003-03-23,2.3,
+1P9N,2003-05-12,2.8,
+1PN6,2003-06-12,10.8,
+1Q15,2003-07-18,2.3,
+1Q19,2003-07-18,2.4,
+1QZD,2003-09-16,10.0,
+1R2K,2003-09-28,2.1,
+1RDU,2003-11-06,,
+1RP0,2003-12-02,1.6,
+1RZ4,2003-12-23,2.1,
+1S7J,2004-01-29,2.3,
+1SQI,2004-03-18,2.15,
+1SR8,2004-03-22,1.9,
+1TO9,2004-06-14,2.4,
+1TUO,2004-06-25,1.7,
+1TXK,2004-07-05,2.5,
+1TYG,2004-07-07,3.15,
+1U0M,2004-07-13,2.22,
+1UC8,2003-04-09,2.0,
+1UC9,2003-04-09,2.38,
+1UWD,2004-02-03,,
+1VK8,2004-05-05,1.8,
+1VKM,2004-06-09,1.9,
+1VKU,2004-06-18,2.0,
+1VLI,2004-07-27,2.38,
+1VQQ,2004-12-17,1.8,
+1VRM,2005-03-10,1.58,
+1WI8,2004-05-28,,
+1WV2,2004-12-10,2.9,
+1WZU,2005-03-09,2.0,
+1X8D,2004-08-18,1.8,
+1XM3,2004-10-01,1.8,
+1XUA,2004-10-26,1.9,
+1XUB,2004-10-26,1.3,
+1XUU,2004-10-26,1.9,
+1XUZ,2004-10-26,2.2,
+1Y2Y,2004-11-23,,
+1Y5E,2004-12-02,1.9,
+1Z6H,2005-03-22,,
+1ZNN,2005-05-11,2.2,
+2A7K,2005-07-05,2.24,
+2A81,2005-07-07,3.15,
+2APG,2005-08-16,1.9,
+2AQJ,2005-08-18,1.8,
+2AR8,2005-08-19,2.2,
+2ARD,2005-08-19,2.6,
+2AVA,2005-08-29,,
+2B1F,2005-09-15,1.5,
+2B22,2005-09-16,2.0,
+2B8F,2005-10-06,,
+2B8G,2005-10-06,,
+2D3W,2005-10-03,2.5,
+2E8B,2007-01-19,1.61,
+2EDG,2007-02-14,,
+2EEY,2007-02-19,1.94,
+2EKN,2007-03-23,2.05,
+2F1R,2005-11-15,2.1,
+2F98,2005-12-05,2.1,
+2F99,2005-12-05,1.9,
+2FAC,2005-12-07,1.76,
+2FAD,2005-12-07,1.6,
+2FAE,2005-12-07,1.55,
+2FCT,2005-12-12,1.6,
+2FCU,2005-12-12,1.6,
+2FCV,2005-12-12,1.8,
+2FUP,2006-01-27,1.48,
+2FVA,2006-01-30,,
+2FVE,2006-01-30,,
+2FVF,2006-01-30,,
+2G02,2006-02-10,2.5,
+2G0D,2006-02-12,2.21,
+2G4R,2006-02-22,1.92,
+2G5F,2006-02-22,1.8,
+2GRV,2006-04-25,2.4,
+2H3G,2006-05-22,2.0,
+2HES,2006-06-22,1.7,
+2HTM,2006-07-26,2.3,
+2HXV,2006-08-04,1.8,
+2HY6,2006-08-04,1.25,
+2IDE,2006-09-15,1.9,
+2IIH,2006-09-28,1.75,
+2IPZ,2006-10-12,1.35,
+2JDJ,2007-01-10,2.0,
+2JUG,2007-08-24,,
+2K5P,2008-06-30,,
+2KG6,2009-03-06,,
+2KG8,2009-03-06,,
+2KG9,2009-03-07,,
+2KGA,2009-03-07,,
+2KGC,2009-03-08,,
+2KGD,2009-03-08,,
+2KGE,2009-03-08,,
+2KHR,2009-04-10,,
+2L22,2010-08-10,,
+2LEK,2011-06-16,,
+2LRJ,2012-04-03,,
+2M5O,2013-03-01,,
+2MR7,2014-07-02,,
+2MR8,2014-07-02,,
+2MVU,2014-10-15,,
+2MVV,2014-10-15,,
+2N50,2015-07-02,,
+2NQK,2006-10-31,2.9,
+2NQM,2006-10-31,3.0,
+2NQN,2006-10-31,2.2,
+2NQQ,2006-10-31,2.4,
+2NQR,2006-10-31,2.2,
+2NQS,2006-10-31,2.5,
+2NQU,2006-10-31,2.7,
+2NQV,2006-10-31,2.82,
+2NRN,2006-11-02,1.4,
+2NRO,2006-11-02,2.5,
+2NRP,2006-11-02,3.0,
+2NRS,2006-11-02,2.8,
+2O66,2006-12-06,1.9,
+2O67,2006-12-06,2.5,
+2OHD,2007-01-10,2.2,
+2P38,2007-03-08,1.8,
+2P7R,2007-03-20,,
+2PRV,2007-05-04,1.3,
+2PX0,2007-05-14,3.0,
+2PX3,2007-05-14,3.2,
+2PYX,2007-05-16,1.5,
+2Q6I,2007-06-05,2.6,
+2Q6K,2007-06-05,1.55,
+2Q6L,2007-06-05,2.72,
+2Q6O,2007-06-05,2.0,
+2QD2,2007-06-20,2.2,
+2QGM,2007-06-29,1.7,
+2QGO,2007-06-29,2.04,
+2RAD,2007-09-14,2.75,
+2RER,2007-09-26,1.9,
+2RES,2007-09-26,2.2,
+2REZ,2007-09-27,1.95,
+2V7I,2007-07-30,1.75,
+2V7J,2007-07-30,2.0,
+2V7K,2007-07-30,1.7,
+2V7L,2007-07-30,2.4,
+2V7M,2007-07-30,2.0,
+2W6K,2008-12-18,1.7,
+2W6L,2008-12-18,1.89,
+2WFB,2009-04-03,2.0,
+2WMC,2009-06-30,2.2,
+2X0O,2009-12-16,2.4,
+2X0P,2009-12-16,2.1,
+2X0Q,2009-12-16,1.96,
+2X2B,2010-01-12,2.69,
+2X66,2010-02-15,2.09,
+2X67,2010-02-15,2.16,
+2X68,2010-02-15,2.13,
+2X6Q,2010-02-19,2.2,
+2XA1,2010-03-26,2.47,
+2XA2,2010-03-26,2.5,
+2XA9,2010-03-30,2.5,
+2XEM,2010-05-17,2.1,
+2Y4X,2011-01-11,1.7,
+2Y4Y,2011-01-11,1.7,
+2Z2L,2007-05-23,2.85,
+2Z2M,2007-05-23,2.6,
+2Z7E,2007-08-20,2.3,
+2ZC3,2007-11-02,2.5,
+2ZC4,2007-11-02,2.8,
+2ZC5,2007-11-02,3.0,
+2ZC6,2007-11-02,2.7,
+3A3U,2009-06-20,1.65,
+3A8E,2009-10-05,3.0,
+3AJ1,2010-05-20,2.5,
+3AJ2,2010-05-20,2.7,
+3B4O,2007-10-24,1.9,
+3B4P,2007-10-24,1.7,
+3B55,2007-10-25,2.3,
+3B8M,2007-11-01,2.7,
+3B8N,2007-11-01,3.1,
+3B8O,2007-11-01,2.4,
+3BMZ,2007-12-13,1.21,
+3BTN,2007-12-30,2.05,
+3BY5,2008-01-15,2.52,
+3C12,2008-01-22,2.51,
+3CE7,2008-02-28,1.64,
+3CKM,2008-03-16,1.35,
+3CNM,2008-03-26,1.65,
+3CNY,2008-03-26,1.85,
+3CWI,2008-04-21,1.9,
+3DWU,2008-07-23,12.6,
+3DZB,2008-07-29,2.46,
+3DZL,2008-07-30,1.75,
+3EDN,2008-09-03,1.5,
+3EPM,2008-09-29,2.793,
+3EPN,2008-09-29,2.11,
+3EPO,2008-09-29,2.1,
+3EQU,2008-10-01,2.4,
+3EQV,2008-10-01,2.4,
+3EX9,2008-10-16,2.2,
+3EZ9,2008-10-22,2.8,
+3EZF,2008-10-22,2.8,
+3FF0,2008-12-01,1.9,
+3FFE,2008-12-03,2.25,
+3FJS,2008-12-15,1.9,
+3FM0,2008-12-19,1.7,
+3FPZ,2009-01-06,1.82,
+3G2B,2009-01-31,1.66,
+3G3O,2009-02-02,2.1,
+3G3Q,2009-02-02,2.64,
+3G3R,2009-02-02,2.0,
+3G3T,2009-02-02,1.85,
+3G3U,2009-02-02,2.07,
+3G7D,2009-02-09,1.8,
+3G8R,2009-02-12,2.49,
+3GBF,2009-02-19,1.92,
+3GJA,2009-03-08,2.2,
+3GJB,2009-03-08,2.2,
+3GLV,2009-03-12,1.99,
+3GZ7,2009-04-06,2.15,
+3GZL,2009-04-07,2.55,
+3GZM,2009-04-07,1.8,
+3H50,2009-04-21,1.6,
+3H7J,2009-04-27,1.87,
+3H7Y,2009-04-28,2.22,
+3H9A,2009-04-30,2.04,
+3HGU,2009-05-14,1.95,
+3HGV,2009-05-14,2.3,
+3HRQ,2009-06-09,1.8,
+3IAV,2009-07-14,1.75,
+3IB9,2009-07-15,2.0,
+3IBB,2009-07-15,3.5,
+3IEB,2009-07-22,2.1,
+3IX1,2009-09-03,2.4,
+3JQJ,2009-09-07,1.9,
+3JQK,2009-09-07,1.75,
+3JQM,2009-09-07,2.5,
+3JR2,2009-09-08,1.8,
+3JSK,2009-09-10,2.7,
+3JUM,2009-09-15,1.45,
+3JUN,2009-09-15,1.8,
+3JUO,2009-09-15,2.2,
+3JUP,2009-09-15,1.9,
+3JUQ,2009-09-15,1.75,
+3JXP,2009-09-21,2.2,
+3K9G,2009-10-15,2.25,
+3K9H,2009-10-15,2.25,
+3KY8,2009-12-04,2.12,
+3L2K,2009-12-15,2.8,
+3L3B,2009-12-16,1.9,
+3LNV,2010-02-03,2.0,
+3LUU,2010-02-18,1.93,
+3LX3,2010-02-24,1.55,
+3LZC,2010-03-01,2.261,
+3LZD,2010-03-01,2.1,
+3LZE,2010-03-01,1.9,
+3M0N,2010-03-03,1.9,
+3MSQ,2010-04-29,2.85,
+3NGW,2010-06-13,2.31,
+3NNF,2010-06-23,2.201,
+3NNJ,2010-06-23,2.601,
+3NNL,2010-06-23,2.883,
+3NNM,2010-06-23,2.69,
+3O05,2010-07-19,2.2,
+3O06,2010-07-19,2.35,
+3O07,2010-07-19,1.8,
+3O31,2010-07-23,1.7,
+3OI9,2010-08-18,1.95,
+3PL0,2010-11-12,1.91,
+3PZY,2010-12-14,1.8,
+3RFQ,2011-04-06,2.25,
+3T4F,2011-07-25,1.68,
+3TCR,2011-08-09,2.3,
+3TFZ,2011-08-16,2.39,
+3TL1,2011-08-29,1.8,
+3TO3,2011-09-03,2.382,
+3U29,2011-10-02,2.0,
+3WBI,2013-05-20,2.35,
+3WBJ,2013-05-20,2.495,
+3WBK,2013-05-20,3.3,
+3WVQ,2014-06-04,1.955,
+3WVR,2014-06-04,2.175,
+4CT8,2014-03-12,2.16,
+4CT9,2014-03-12,2.14,
+4CTA,2014-03-12,2.21,
+4DUN,2012-02-22,1.76,
+4EXQ,2012-04-30,1.65,
+4FDF,2012-05-28,2.202,
+4FKZ,2012-06-14,1.69,
+4HVM,2012-11-06,2.704,
+4I7U,2012-11-30,1.55,
+4I7V,2012-12-01,1.45,
+4I7W,2012-12-01,1.3,
+4J7G,2013-02-13,1.7,
+4J7H,2013-02-13,1.69,
+4JN3,2013-03-14,1.69,
+4JN5,2013-03-14,2.44,
+4K25,2013-04-08,2.88,
+4K51,2013-04-12,2.65,
+4NAG,2013-10-22,0.81,
+4OYH,2014-02-12,2.409,
+4P2S,2014-03-03,1.94,
+4PNE,2014-05-23,1.5,
+4PYD,2014-03-26,3.186,
+4R0R,2014-08-01,2.15,
+4RHP,2014-10-02,2.393,
+4TWG,2014-06-30,1.85,
+4UUW,2014-07-31,1.98,
+4UUX,2014-07-31,1.99,
+4W4R,2014-08-15,1.92,
+4W4S,2014-08-15,2.0,
+4WD9,2014-09-08,2.9,
+4WJS,2014-10-01,1.8,
+4WJU,2014-10-01,2.8,
+4Y0W,2015-02-06,2.5,
+4Y4L,2015-02-10,2.0,
+4Y4M,2015-02-10,2.71,
+4Y4N,2015-02-10,2.1,
+4YX6,2015-03-22,1.86,
+4ZXH,2015-05-20,2.7,
+4ZXI,2015-05-20,2.9,
+5BY8,2015-06-10,1.515,
+5C05,2015-06-12,1.65,
+5D84,2015-08-15,1.45,
+5D85,2015-08-15,1.92,
+5D86,2015-08-15,1.5,
+5D87,2015-08-15,1.5,
+5D9R,2015-08-18,2.052,
+5EJD,2015-11-01,2.49,
+5EMG,2015-11-06,1.06,
+5EQ7,2015-11-12,1.19,
+5EQ8,2015-11-12,1.3,
+5EQ9,2015-11-12,1.36,
+5EQA,2015-11-12,1.32,
+5GUC,2016-08-28,1.8,
+5GUE,2016-08-28,1.8,
+5GUK,2016-08-29,2.0,
+5GUL,2016-08-29,1.73,
+5H5O,2016-11-08,2.122,
+5H72,2016-11-16,2.4,
+5HTL,2016-01-27,1.371,
+5I2T,2016-02-09,2.543,
+5I47,2016-02-11,2.35,
+5K2M,2016-05-19,2.18,
+5K2Z,2016-05-19,1.8,
+5K3V,2016-05-20,1.9,
+5KCN,2016-06-06,1.965,
+5KSH,2016-07-08,2.4,
+5MWQ,2017-01-19,,
+5NWS,2017-05-08,2.227,
+5O7O,2017-06-09,2.11,
+5O8P,2017-06-14,2.75,
+5O8R,2017-06-14,2.8,
+5ONC,2017-08-03,2.19,
+5OO4,2017-08-05,1.6,
+5OO5,2017-08-05,1.78,
+5OO8,2017-08-06,1.78,
+5OO9,2017-08-06,1.59,
+5OOA,2017-08-06,1.6,
+5T3D,2016-08-25,2.8,
+5T6O,2016-09-01,1.8,
+5T7Z,2016-09-06,2.03,
+5T81,2016-09-06,2.604,
+5VAT,2017-03-27,2.6,
+5VBG,2017-03-29,2.8,
+5W8A,2017-06-21,2.0,
+5W8C,2017-06-21,1.85,
+5W8D,2017-06-21,2.0,
+5W8E,2017-06-21,1.8,
+5W8G,2017-06-21,2.0,
+5W98,2017-06-22,1.23,
+5W99,2017-06-22,1.59,
+5WA3,2017-06-24,2.8,
+5WA4,2017-06-24,2.646,
+5WMM,2017-07-30,2.9,
+5XAV,2017-03-15,1.479,
+5XBJ,2017-03-19,2.448,
+5XT5,2017-06-17,2.34,
+5XT6,2017-06-17,3.5,
+5XW2,2017-06-29,1.298,
+5XW7,2017-06-29,3.272,
+5Y08,2017-07-15,,
+5Y9I,2017-08-25,1.901,
+5Y9X,2017-08-29,1.39,
+5Y9Y,2017-08-29,1.599,
+5YDA,2017-09-12,2.353,
+5YGJ,2017-09-23,2.648,
+5YGK,2017-09-23,2.047,
+5YKA,2017-10-12,1.448,
+5YRP,2017-11-09,2.99,
+5YVZ,2017-11-28,1.6,
+5YW0,2017-11-28,1.49,
+5Z36,2018-01-05,,
+5Z3R,2018-01-08,2.42,
+5Z4E,2018-01-11,,
+5Z4F,2018-01-11,,
+5ZS9,2018-04-28,2.8,
+5ZSK,2018-04-28,3.24,
+5ZSO,2018-04-29,2.7,
+5ZSP,2018-04-29,2.57,
+5ZSQ,2018-04-29,3.211,
+5ZSR,2018-04-29,2.61,
+5ZSS,2018-04-29,3.17,
+5ZST,2018-04-29,3.1,
+5ZT7,2018-05-02,2.94,
+5ZT8,2018-05-02,2.0,
+5ZT9,2018-05-02,2.8,
+5ZTA,2018-05-02,3.07,
+5ZW0,2018-05-14,2.54,
+5ZW2,2018-05-14,1.803,
+5ZW7,2018-05-14,1.3,
+5ZW8,2018-05-14,1.689,
+6A2E,2018-06-11,1.939,
+6A4X,2018-06-21,1.63,
+6A4Z,2018-06-21,1.7,
+6A52,2018-06-21,2.0,
+6A5F,2018-06-23,2.05,
+6A5G,2018-06-23,2.3,
+6A5H,2018-06-23,1.618,
+6A6F,2018-06-27,2.1,
+6AD3,2018-07-30,1.79,
+6AF6,2018-08-08,1.62,
+6AGL,2018-08-13,2.5,
+6AGM,2018-08-13,2.0,
+6AM7,2017-08-09,1.47,
+6AM8,2017-08-09,1.83,
+6AMC,2017-08-09,1.93,
+6AMH,2017-08-09,1.63,
+6AMI,2017-08-09,1.97,
+6AWL,2017-09-05,2.0,
+6BF8,2017-10-26,4.2,
+6BVU,2017-12-13,,
+6BVW,2017-12-14,,
+6BVX,2017-12-14,,
+6BVY,2017-12-14,,
+6BWC,2017-12-14,2.7,
+6BXK,2017-12-18,2.347,
+6BXL,2017-12-18,2.301,
+6BXM,2017-12-18,2.252,
+6BXN,2017-12-18,2.079,
+6BXO,2017-12-18,1.655,
+6C0G,2017-12-31,2.145,
+6C0H,2017-12-31,1.9,
+6C0Y,2018-01-03,1.66,
+6C3A,2018-01-09,1.53,
+6C3B,2018-01-09,1.51,
+6C3C,2018-01-09,1.5,
+6C3D,2018-01-09,1.55,
+6CGO,2018-02-20,2.0,
+6CI7,2018-02-23,2.3,
+6CIB,2018-02-23,2.05,
+6CIV,2018-02-25,,
+6CIX,2018-02-25,,
+6CLW,2018-03-02,2.74,
+6CLX,2018-03-02,2.73,
+6CP3,2018-03-13,3.8,
+6CP5,2018-03-13,4.2,
+6CP6,2018-03-13,3.6,
+6CP7,2018-03-13,4.1,
+6CY8,2018-04-05,2.729,
+6D34,2018-04-14,2.1,
+6D8I,2018-04-26,1.65,
+6D8J,2018-04-26,1.63,
+6DCJ,2018-05-07,1.35,
+6DG6,2018-05-16,1.999,
+6DR3,2018-06-11,2.101,
+6DYM,2018-07-02,2.02,
+6DYN,2018-07-02,2.102,
+6DYO,2018-07-02,2.84,
+6DYR,2018-07-02,2.45,
+6DYS,2018-07-02,2.3,
+6E6U,2018-07-25,1.55,
+6E6Y,2018-07-25,1.6,
+6EC7,2018-08-07,2.15,
+6EC8,2018-08-07,2.148,
+6ESD,2017-10-20,2.6,
+6F9Q,2017-12-15,1.4,
+6FD2,2017-12-21,2.55,
+6FIJ,2018-01-18,2.77,
+6FIK,2018-01-18,7.1,
+6FKO,2018-01-24,2.1,
+6FLF,2018-01-25,1.33,
+6FM0,2018-01-29,1.7,
+6FM1,2018-01-29,2.35,
+6FM3,2018-01-30,1.95,
+6FSQ,2018-02-20,2.79,
+6FT5,2018-02-20,1.94,
+6FTE,2018-02-21,1.52,
+6FW7,2018-03-05,3.0,
+6FW8,2018-03-05,2.4,
+6FW9,2018-03-05,2.739,
+6FWA,2018-03-05,2.846,
+6FXD,2018-03-08,1.45,
+6G2P,2018-03-23,2.6,
+6G56,2018-03-29,2.15,
+6G58,2018-03-29,1.9,
+6G59,2018-03-29,2.45,
+6GE8,2018-04-25,1.869,
+6GHF,2018-05-07,3.52,
+6GJC,2018-05-16,3.3,
+6GMZ,2018-05-29,2.22,
+6GQ3,2018-06-07,1.85,
+6GRG,2018-06-11,2.35,
+6GRH,2018-06-11,1.85,
+6GRI,2018-06-11,2.7,
+6GS2,2018-06-13,2.04,
+6H31,2018-07-17,2.3,
+6H3D,2018-07-18,2.05,
+6H3F,2018-07-18,2.21,
+6H5E,2018-07-24,2.139,
+6HFD,2018-08-21,1.86996804092,
+6HFE,2018-08-21,1.47997437573,
+6HFF,2018-08-21,1.51000106105,
+6HFH,2018-08-21,1.44871265165,
+6HFI,2018-08-21,1.45994719309,
+6HFJ,2018-08-21,1.2,
+6HFK,2018-08-21,1.45914405408,
+6HFL,2018-08-21,1.35,
+6HFN,2018-08-21,1.44965143011,
+6HFP,2018-08-21,1.19822864429,
+6HFQ,2018-08-21,1.14542458871,
+6HFR,2018-08-21,1.29949373933,
+6HFS,2018-08-21,1.34904510922,
+6HFU,2018-08-21,1.39971025955,
+6HG1,2018-08-22,2.12,
+6HG2,2018-08-22,1.83,
+6HG3,2018-08-22,1.97,
+6HK1,2018-09-05,2.55,
+6HNL,2018-09-16,2.2,
+6HNM,2018-09-16,2.0,
+6HNN,2018-09-16,2.7,
+6HQV,2018-09-25,3.0,
+6HS8,2018-09-29,1.7,
+6HS9,2018-09-29,1.05,
+6HSA,2018-09-29,0.92,
+6HSB,2018-09-29,1.95,
+6HSQ,2018-10-01,1.46,
+6HSR,2018-10-01,2.0,
+6HSU,2018-10-01,1.6,
+6HWP,2018-10-12,2.547,
+6I0M,2018-10-26,2.567,
+6I0O,2018-10-26,2.623,
+6I86,2018-11-19,2.0,
+6IHC,2018-09-29,2.4,
+6IPV,2018-11-05,2.2,
+6IPW,2018-11-05,2.1,
+6IUS,2018-11-30,2.12,
+6IX3,2018-12-09,2.13,
+6IX5,2018-12-09,1.7,
+6IX7,2018-12-09,1.835,
+6IX8,2018-12-09,1.659,
+6IX9,2018-12-09,1.776,
+6J0P,2018-12-25,1.79,
+6J1E,2018-12-28,2.4,
+6J1F,2018-12-28,2.1,
+6J1G,2018-12-28,2.5,
+6J1H,2018-12-28,2.101,
+6J1I,2018-12-28,2.29,
+6J1J,2018-12-28,2.0,
+6J1M,2018-12-28,2.001,
+6J1N,2018-12-28,2.532,
+6J31,2019-01-03,2.244,
+6J32,2019-01-03,2.5,
+6JDD,2019-02-01,2.6,
+6JH7,2019-02-17,1.38,
+6JHA,2019-02-17,1.78,
+6JHB,2019-02-17,2.27,
+6JLS,2019-03-06,2.24,
+6JSX,2019-04-08,2.7,
+6JT7,2019-04-10,1.86,
+6JT8,2019-04-10,1.9,
+6JT9,2019-04-10,2.1,
+6JTA,2019-04-10,1.75,
+6JV6,2019-04-16,2.15,
+6JZV,2019-05-04,2.0,
+6JZW,2019-05-04,2.64,
+6K0K,2019-05-07,2.68,
+6K3C,2019-05-17,3.074,
+6K4F,2019-05-23,1.735,
+6KA2,2019-06-20,2.35,
+6KA3,2019-06-20,1.951,
+6KFY,2019-07-09,1.97,
+6KFZ,2019-07-09,1.96,
+6KG0,2019-07-09,2.78,
+6KG1,2019-07-09,2.7,
+6KNH,2019-08-05,1.76,
+6KNI,2019-08-05,1.97,
+6KNK,2019-08-05,2.3,
+6KOG,2019-08-10,1.68,
+6KU3,2019-08-30,2.15,
+6KUN,2019-09-02,2.002,
+6KV9,2019-09-03,1.48,
+6KVC,2019-09-04,1.66,
+6LD7,2019-11-20,2.1,
+6LD8,2019-11-20,2.31,
+6LD9,2019-11-20,2.5,
+6LE0,2019-11-23,2.51,
+6LE3,2019-11-23,2.1,
+6LGO,2019-12-05,2.39,
+6LK3,2019-12-18,2.1,
+6LKC,2019-12-19,1.998,
+6LKZ,2019-12-21,2.8,
+6LTA,2020-01-22,2.45,
+6LTB,2020-01-22,3.1,
+6LTC,2020-01-22,3.3,
+6LTD,2020-01-22,4.1,
+6LV0,2020-02-02,1.998,
+6LVT,2020-02-05,,
+6LVU,2020-02-05,2.294,
+6M03,2020-02-19,2.0,
+6M25,2020-02-26,2.5,
+6M26,2020-02-26,2.61,
+6M27,2020-02-26,2.6,
+6M28,2020-02-26,3.0,
+6M29,2020-02-26,2.9,
+6M2A,2020-02-26,2.23,
+6M2E,2020-02-27,2.6,
+6M2F,2020-02-27,2.4,
+6M2G,2020-02-27,2.8,
+6M2H,2020-02-27,3.1,
+6M2Y,2020-03-02,2.1,
+6M2Z,2020-03-02,2.35,
+6M53,2020-03-09,1.55,
+6M7L,2018-08-20,2.64829708903,
+6M7Y,2018-08-21,2.794,
+6MF9,2018-09-10,2.037,
+6MIC,2018-09-19,1.531,
+6MJF,2018-09-20,2.198,
+6MJG,2018-09-20,2.123,
+6MOE,2018-10-04,2.091,
+6MOF,2018-10-04,2.894,
+6MOG,2018-10-04,1.21,
+6MOH,2018-10-04,3.2,
+6MOI,2018-10-04,2.065,
+6MOJ,2018-10-04,2.431,
+6MOK,2018-10-04,5.101,
+6MOL,2018-10-04,3.163,
+6N04,2018-11-06,1.998,
+6N3P,2018-11-15,2.5,
+6N6Z,2018-11-27,2.642,
+6N70,2018-11-27,2.738,
+6N72,2018-11-27,2.735,
+6N73,2018-11-27,2.398,
+6N74,2018-11-27,1.852,
+6N75,2018-11-27,2.991,
+6N76,2018-11-27,2.892,
+6N9A,2018-12-01,2.5,
+6NCS,2018-12-12,1.8,
+6NEG,2018-12-17,1.95,
+6NEH,2018-12-17,1.52,
+6NEJ,2018-12-17,1.6,
+6NHT,2018-12-23,2.9,
+6NHV,2018-12-24,3.5,
+6NIE,2018-12-27,1.95,
+6NL2,2019-01-07,1.92,
+6NNC,2019-01-14,1.8,
+6NND,2019-01-14,1.7,
+6NNH,2019-01-15,1.523,
+6NNI,2019-01-15,1.561,
+6NOX,2019-01-16,,
+6NR6,2019-01-22,1.9,
+6NSD,2019-01-24,1.74,
+6NVA,2019-02-04,2.16,
+6NW4,2019-02-06,3.0,
+6OBW,2019-03-21,,
+6OC2,2019-03-21,,
+6OC4,2019-03-21,,
+6ODD,2019-03-26,2.0,
+6OHI,2019-04-05,2.27,
+6OHJ,2019-04-05,3.19,
+6OJO,2019-04-11,1.886,
+6OLD,2019-04-16,,
+6OM4,2019-04-18,1.7,
+6OYF,2019-05-14,2.1,
+6OZV,2019-05-16,2.18,
+6P1J,2019-05-20,2.95,
+6P29,2019-05-21,1.5,
+6P3I,2019-05-23,2.15,
+6P4U,2019-05-28,2.1,
+6P5X,2019-05-31,1.97,
+6P5Z,2019-05-31,2.26,
+6P63,2019-05-31,2.4,
+6PBN,2019-06-14,1.65,
+6PBP,2019-06-14,1.64,
+6PBT,2019-06-14,2.18,
+6PD1,2019-06-18,2.72,
+6PD2,2019-06-18,1.95,
+6PE3,2019-06-19,2.3,
+6PEU,2019-06-20,1.95,
+6PH9,2019-06-25,1.92,
+6PIB,2019-06-26,2.26,
+6PJ3,2019-06-27,2.25,
+6PQZ,2019-07-10,2.23,
+6PVF,2019-07-20,1.69,
+6PVG,2019-07-20,1.709,
+6PVH,2019-07-20,1.89,
+6PVI,2019-07-20,2.093,
+6PVJ,2019-07-20,1.25,
+6Q32,2018-12-03,1.39,
+6QSP,2019-02-21,1.45,
+6QSR,2019-02-21,1.85,
+6QTL,2019-02-25,2.25,
+6R2G,2019-03-17,1.9,
+6RM2,2019-05-04,2.5,
+6SBB,2019-07-19,1.95,
+6SBC,2019-07-19,1.35,
+6SBD,2019-07-19,1.4,
+6SBE,2019-07-19,1.4,
+6SBF,2019-07-19,1.3,
+6SBG,2019-07-19,2.3,
+6SM5,2019-08-21,2.75,
+6SME,2019-08-21,1.7,
+6SMF,2019-08-21,2.343,
+6T5X,2019-10-17,1.5,
+6T60,2019-10-17,1.66,
+6T62,2019-10-17,1.8,
+6T65,2019-10-17,2.35,
+6T6N,2019-10-18,2.5,
+6T6P,2019-10-18,1.57,
+6T77,2019-10-21,1.75,
+6T7M,2019-10-22,2.65,
+6TA1,2019-10-29,3.1,
+6TA8,2019-10-29,2.4,
+6TBB,2019-11-01,2.45,
+6TBC,2019-11-01,2.55,
+6TBD,2019-11-01,2.3,
+6TBL,2019-11-01,2.65,
+6TBN,2019-11-01,2.0,
+6TG5,2019-11-15,,
+6THU,2019-11-21,2.6,
+6TIV,2019-11-22,2.38,
+6TJ1,2019-11-23,2.4,
+6TJA,2019-11-25,2.27,
+6TJZ,2019-11-27,2.4,
+6TMS,2019-12-05,2.7,
+6TNH,2019-12-08,2.21,
+6U1Q,2019-08-16,2.87,
+6U24,2019-08-19,,
+6U7Q,2019-09-03,,
+6U7R,2019-09-03,,
+6U7S,2019-09-03,,
+6U7U,2019-09-03,,
+6U7W,2019-09-03,,
+6U7X,2019-09-03,,
+6U8E,2019-09-04,3.03,
+6U8N,2019-09-05,3.29,
+6U8R,2019-09-05,3.91,
+6U8S,2019-09-05,3.14,
+6U9O,2019-09-09,3.36,
+6UA2,2019-09-10,4.2,
+6UA4,2019-09-10,3.65,
+6UA5,2019-09-10,3.79,
+6UAJ,2019-09-10,3.84,
+6UC2,2019-09-13,4.48,
+6UDO,2019-09-19,3.21,
+6UDP,2019-09-19,2.95,
+6UDQ,2019-09-19,3.27,
+6ULU,2019-10-08,2.76,
+6ULW,2019-10-08,3.4,
+6ULX,2019-10-08,2.31,
+6ULY,2019-10-08,2.3,
+6ULZ,2019-10-08,3.1,
+6UVX,2019-11-04,2.3,
+6UW1,2019-11-04,2.205,
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diff --git a/notebooks/casp15_inference_results_plotting.ipynb b/notebooks/casp15_inference_results_plotting.ipynb
index 3d70891d..f964c1c3 100644
--- a/notebooks/casp15_inference_results_plotting.ipynb
+++ b/notebooks/casp15_inference_results_plotting.ipynb
@@ -76,6 +76,8 @@
     "    \"rfaa\",\n",
     "    \"chai-lab_ss\",\n",
     "    \"chai-lab\",\n",
+    "    \"boltz_ss\",\n",
+    "    \"boltz\",\n",
     "    \"alphafold3_ss\",\n",
     "    \"alphafold3\",\n",
     "]\n",
@@ -90,6 +92,8 @@
     "    \"rfaa\": \"RFAA\",\n",
     "    \"chai-lab_ss\": \"Chai-1-Single-Seq\",\n",
     "    \"chai-lab\": \"Chai-1\",\n",
+    "    \"boltz_ss\": \"Boltz-1-Single-Seq\",\n",
+    "    \"boltz\": \"Boltz-1\",\n",
     "    \"alphafold3_ss\": \"AF3-Single-Seq\",\n",
     "    \"alphafold3\": \"AF3\",\n",
     "}\n",
@@ -102,6 +106,8 @@
     "    \"rfaa\": \"DL-based blind\",\n",
     "    \"chai-lab_ss\": \"DL-based blind\",\n",
     "    \"chai-lab\": \"DL-based blind\",\n",
+    "    \"boltz_ss\": \"DL-based blind\",\n",
+    "    \"boltz\": \"DL-based blind\",\n",
     "    \"alphafold3_ss\": \"DL-based blind\",\n",
     "    \"alphafold3\": \"DL-based blind\",\n",
     "}"
@@ -549,7 +555,7 @@
     "colors = [\"#FB8072\", \"#BEBADA\", \"#FCCDE5\"]\n",
     "\n",
     "bar_width = 0.5\n",
-    "r1 = [item - 0.5 for item in range(2, 20, 2)]\n",
+    "r1 = [item - 0.5 for item in range(2, 24, 2)]\n",
     "r2 = [x + bar_width for x in r1]\n",
     "r3 = [x + bar_width for x in r2]\n",
     "\n",
@@ -796,7 +802,7 @@
     "        # add labels, titles, ticks, etc.\n",
     "        axis.set_xlabel(f\"{complex_type.title()}-ligand blind docking ({complex_license})\")\n",
     "        axis.set_ylabel(\"Percentage of predictions\")\n",
-    "        axis.set_xlim(1, 19 + 0.1)\n",
+    "        axis.set_xlim(1, 23 + 0.1)\n",
     "        axis.set_ylim(0, 125)\n",
     "\n",
     "        axis.bar_label(casp15_rmsd_lt2_bar, fmt=\"{:,.1f}\", label_type=\"center\")\n",
@@ -810,7 +816,7 @@
     "        axis.grid(axis=\"y\", color=\"#EAEFF8\")\n",
     "        axis.set_axisbelow(True)\n",
     "\n",
-    "        axis.set_xticks([2, 2 + 1e-3, 4, 6, 8, 10, 11, 12, 14, 16, 18])\n",
+    "        axis.set_xticks([2, 2 + 1e-3, 4, 6, 8, 10, 12, 13, 14, 16, 18, 20, 22])\n",
     "        axis.set_xticks([1 + 0.1], minor=True)\n",
     "        axis.set_xticklabels(\n",
     "            [\n",
@@ -820,9 +826,11 @@
     "                \"DynamicBind\",\n",
     "                \"NeuralPLexer\",\n",
     "                \"RFAA\",\n",
-    "                \"DL-based blind\",\n",
     "                \"Chai-1-Single-Seq\",\n",
+    "                \"DL-based blind\",\n",
     "                \"Chai-1\",\n",
+    "                \"Boltz-1-Single-Seq\",\n",
+    "                \"Boltz-1\",\n",
     "                \"AF3-Single-Seq\",\n",
     "                \"AF3\",\n",
     "            ]\n",
@@ -836,7 +844,7 @@
     "        axis.tick_params(axis=\"y\", which=\"major\", left=\"off\", right=\"on\", color=\"#EAEFF8\")\n",
     "\n",
     "        # vertical alignment of xtick labels\n",
-    "        vert_alignments = [0.0, -0.1, 0.0, 0.0, 0.0, 0.0, -0.1, 0.0, 0.0, 0.0, 0.0]\n",
+    "        vert_alignments = [0.0, -0.1, 0.0, 0.0, 0.0, 0.0, 0.0, -0.1, 0.0, 0.0, 0.0, 0.0, 0.0]\n",
     "        for tick, y in zip(axis.get_xticklabels(), vert_alignments):\n",
     "            tick.set_y(y)\n",
     "\n",
@@ -939,7 +947,7 @@
     "colors = [\"#FB8072\", \"#BEBADA\"]\n",
     "\n",
     "bar_width = 0.75\n",
-    "r1 = [item - 0.25 for item in range(2, 20, 2)]\n",
+    "r1 = [item - 0.25 for item in range(2, 24, 2)]\n",
     "r2 = [x + bar_width for x in r1]\n",
     "\n",
     "for complex_type in [\"single\", \"multi\"]:\n",
@@ -1122,7 +1130,7 @@
     "        # add labels, titles, ticks, etc.\n",
     "        axis.set_xlabel(f\"{complex_type.title()}-ligand blind docking ({complex_license})\")\n",
     "        axis.set_ylabel(\"Percentage of complex predictions\")\n",
-    "        axis.set_xlim(1, 19 + 0.1)\n",
+    "        axis.set_xlim(1, 23 + 0.1)\n",
     "        axis.set_ylim(0, 100)\n",
     "\n",
     "        axis.bar_label(casp15_pb_valid_bar, fmt=\"{:,.1f}\", label_type=\"center\")\n",
@@ -1135,7 +1143,7 @@
     "        axis.grid(axis=\"y\", color=\"#EAEFF8\")\n",
     "        axis.set_axisbelow(True)\n",
     "\n",
-    "        axis.set_xticks([2, 2 + 1e-3, 4, 6, 8, 10, 11, 12, 14, 16, 18])\n",
+    "        axis.set_xticks([2, 2 + 1e-3, 4, 6, 8, 10, 12, 13, 14, 16, 18, 20, 22])\n",
     "        axis.set_xticks([1 + 0.1], minor=True)\n",
     "        axis.set_xticklabels(\n",
     "            [\n",
@@ -1145,9 +1153,11 @@
     "                \"DynamicBind\",\n",
     "                \"NeuralPLexer\",\n",
     "                \"RFAA\",\n",
-    "                \"DL-based blind\",\n",
     "                \"Chai-1-Single-Seq\",\n",
+    "                \"DL-based blind\",\n",
     "                \"Chai-1\",\n",
+    "                \"Boltz-1-Single-Seq\",\n",
+    "                \"Boltz-1\",\n",
     "                \"AF3-Single-Seq\",\n",
     "                \"AF3\",\n",
     "            ]\n",
@@ -1161,7 +1171,7 @@
     "        axis.tick_params(axis=\"y\", which=\"major\", left=\"off\", right=\"on\", color=\"#EAEFF8\")\n",
     "\n",
     "        # vertical alignment of xtick labels\n",
-    "        vert_alignments = [0.0, -0.1, 0.0, 0.0, 0.0, 0.0, -0.1, 0.0, 0.0, 0.0, 0.0]\n",
+    "        vert_alignments = [0.0, -0.1, 0.0, 0.0, 0.0, 0.0, 0.0, -0.1, 0.0, 0.0, 0.0, 0.0, 0.0]\n",
     "        for tick, y in zip(axis.get_xticklabels(), vert_alignments):\n",
     "            tick.set_y(y)\n",
     "\n",
diff --git a/notebooks/casp15_method_interaction_analysis.png b/notebooks/casp15_method_interaction_analysis.png
new file mode 100644
index 00000000..36a58f7f
Binary files /dev/null and b/notebooks/casp15_method_interaction_analysis.png differ
diff --git a/notebooks/casp15_method_interaction_analysis_plotting.ipynb b/notebooks/casp15_method_interaction_analysis_plotting.ipynb
index 41e425ef..cc6e5664 100644
--- a/notebooks/casp15_method_interaction_analysis_plotting.ipynb
+++ b/notebooks/casp15_method_interaction_analysis_plotting.ipynb
@@ -84,6 +84,8 @@
     "    \"rfaa\",\n",
     "    \"chai-lab_ss\",\n",
     "    \"chai-lab\",\n",
+    "    \"boltz_ss\",\n",
+    "    \"boltz\",\n",
     "    \"alphafold3_ss\",\n",
     "    \"alphafold3\",\n",
     "]\n",
@@ -99,7 +101,7 @@
     ")\n",
     "assert os.path.exists(\n",
     "    casp15_set_dir\n",
-    "), \"Please download the (public) CASP15 set from `https://zenodo.org/records/14629652` before proceeding.\"\n",
+    "), \"Please download the (public) CASP15 set from `https://zenodo.org/records/16791095` before proceeding.\"\n",
     "\n",
     "# Mappings\n",
     "method_mapping = {\n",
@@ -110,6 +112,8 @@
     "    \"rfaa\": \"RFAA\",\n",
     "    \"chai-lab_ss\": \"Chai-1-Single-Seq\",\n",
     "    \"chai-lab\": \"Chai-1\",\n",
+    "    \"boltz_ss\": \"Boltz-1-Single-Seq\",\n",
+    "    \"boltz\": \"Boltz-1\",\n",
     "    \"alphafold3_ss\": \"AF3-Single-Seq\",\n",
     "    \"alphafold3\": \"AF3\",\n",
     "}\n",
diff --git a/notebooks/casp15_method_interaction_analysis_plotting.py b/notebooks/casp15_method_interaction_analysis_plotting.py
index 7edea537..787fc5fd 100644
--- a/notebooks/casp15_method_interaction_analysis_plotting.py
+++ b/notebooks/casp15_method_interaction_analysis_plotting.py
@@ -49,6 +49,8 @@
     "rfaa",
     "chai-lab_ss",
     "chai-lab",
+    "boltz_ss",
+    "boltz",
     "alphafold3_ss",
     "alphafold3",
 ]
@@ -64,7 +66,7 @@
 )
 assert os.path.exists(
     casp15_set_dir
-), "Please download the (public) CASP15 set from `https://zenodo.org/records/14629652` before proceeding."
+), "Please download the (public) CASP15 set from `https://zenodo.org/records/16791095` before proceeding."
 
 # Mappings
 method_mapping = {
@@ -75,6 +77,8 @@
     "rfaa": "RFAA",
     "chai-lab_ss": "Chai-1-Single-Seq",
     "chai-lab": "Chai-1",
+    "boltz_ss": "Boltz-1-Single-Seq",
+    "boltz": "Boltz-1",
     "alphafold3_ss": "AF3-Single-Seq",
     "alphafold3": "AF3",
 }
diff --git a/notebooks/casp15_plif_emd_values.png b/notebooks/casp15_plif_emd_values.png
new file mode 100644
index 00000000..29585b23
Binary files /dev/null and b/notebooks/casp15_plif_emd_values.png differ
diff --git a/notebooks/casp15_plif_metrics.csv b/notebooks/casp15_plif_metrics.csv
new file mode 100644
index 00000000..7a213ff2
--- /dev/null
+++ b/notebooks/casp15_plif_metrics.csv
@@ -0,0 +1,188 @@
+,Category,Target,EMD,WM,Method_Histogram,Reference_Histogram
+0,P2Rank-Vina,H1171v2,,0.0,,
+1,P2Rank-Vina,T1158v2,0.4285714285714285,0.9947443860487338,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1}"
+2,P2Rank-Vina,T1152,1178.034482758621,0.0,"{'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 3, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:VdWContact': 384, 'UNL:ASN:HBAcceptor': 1152, 'UNL:ASN:VdWContact': 3584, 'UNL:ASP:VdWContact': 1536, 'UNL:GLN:HBAcceptor': 896, 'UNL:GLN:VdWContact': 2560, 'UNL:GLU:HBAcceptor': 128, 'UNL:GLU:VdWContact': 896, 'UNL:GLY:HBAcceptor': 640, 'UNL:GLY:VdWContact': 1920, 'UNL:ILE:HBAcceptor': 512, 'UNL:ILE:VdWContact': 3072, 'UNL:LEU:VdWContact': 1280, 'UNL:LYS:HBAcceptor': 512, 'UNL:LYS:VdWContact': 4224, 'UNL:MET:VdWContact': 1280, 'UNL:PRO:VdWContact': 2432, 'UNL:SER:HBAcceptor': 128, 'UNL:SER:VdWContact': 512, 'UNL:THR:HBAcceptor': 768, 'UNL:THR:VdWContact': 2048, 'UNL:TRP:HBAcceptor': 512, 'UNL:TRP:VdWContact': 768, 'UNL:TYR:VdWContact': 1024, 'UNL:VAL:VdWContact': 1408}"
+3,P2Rank-Vina,T1158v1,0.36842105263157904,0.9959514170040485,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2}"
+4,P2Rank-Vina,H1171v1,,0.0,,
+5,P2Rank-Vina,H1172v1,14.142857142857144,0.7195413282369804,"{'UNL:ALA:Hydrophobic': 9, 'UNL:ALA:VdWContact': 18, 'UNL:ARG:HBAcceptor': 36, 'UNL:ARG:HBDonor': 9, 'UNL:ARG:VdWContact': 63, 'UNL:ASN:HBAcceptor': 9, 'UNL:ASN:HBDonor': 9, 'UNL:ASN:VdWContact': 18, 'UNL:ASP:HBAcceptor': 9, 'UNL:ASP:VdWContact': 9, 'UNL:GLN:HBAcceptor': 18, 'UNL:GLN:HBDonor': 9, 'UNL:GLN:VdWContact': 27, 'UNL:GLU:Hydrophobic': 18, 'UNL:GLU:VdWContact': 63, 'UNL:GLY:HBAcceptor': 36, 'UNL:GLY:VdWContact': 45, 'UNL:ILE:HBAcceptor': 9, 'UNL:ILE:HBDonor': 18, 'UNL:ILE:Hydrophobic': 27, 'UNL:ILE:VdWContact': 54, 'UNL:LEU:VdWContact': 18, 'UNL:LYS:HBAcceptor': 9, 'UNL:LYS:VdWContact': 36, 'UNL:PRO:Hydrophobic': 54, 'UNL:PRO:VdWContact': 9, 'UNL:SER:VdWContact': 45, 'UNL:THR:HBAcceptor': 36, 'UNL:THR:Hydrophobic': 9, 'UNL:THR:VdWContact': 54, 'UNL:TYR:HBDonor': 9, 'UNL:TYR:Hydrophobic': 36, 'UNL:TYR:VdWContact': 54, 'UNL:VAL:VdWContact': 18}","{'UNL:ARG:HBAcceptor': 54, 'UNL:ARG:VdWContact': 63, 'UNL:GLY:HBAcceptor': 63, 'UNL:GLY:VdWContact': 90, 'UNL:ILE:VdWContact': 54, 'UNL:LEU:VdWContact': 18, 'UNL:LYS:HBAcceptor': 36, 'UNL:LYS:VdWContact': 36, 'UNL:PRO:Hydrophobic': 18, 'UNL:PRO:VdWContact': 45, 'UNL:THR:HBAcceptor': 72, 'UNL:THR:VdWContact': 144, 'UNL:TYR:HBAcceptor': 9, 'UNL:TYR:VdWContact': 9}"
+6,P2Rank-Vina,T1158v4,4.484848484848484,0.9133475220431743,"{'UNL:ALA:Hydrophobic': 4, 'UNL:ALA:VdWContact': 4, 'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:Hydrophobic': 4, 'UNL:ARG:VdWContact': 8, 'UNL:ASP:VdWContact': 4, 'UNL:GLN:HBAcceptor': 4, 'UNL:GLN:HBDonor': 4, 'UNL:GLN:VdWContact': 8, 'UNL:GLY:VdWContact': 8, 'UNL:HIS:VdWContact': 8, 'UNL:ILE:VdWContact': 4, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 12, 'UNL:LYS:VdWContact': 4, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 8, 'UNL:PHE:Hydrophobic': 8, 'UNL:PHE:VdWContact': 4, 'UNL:SER:VdWContact': 8, 'UNL:THR:HBAcceptor': 4, 'UNL:THR:Hydrophobic': 4, 'UNL:THR:VdWContact': 8, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 4, 'UNL:TYR:HBAcceptor': 4, 'UNL:TYR:VdWContact': 12, 'UNL:VAL:VdWContact': 4}","{'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBAcceptor': 4, 'UNL:ASN:VdWContact': 8, 'UNL:ASP:VdWContact': 4, 'UNL:GLN:HBAcceptor': 12, 'UNL:GLN:VdWContact': 24, 'UNL:GLY:HBAcceptor': 24, 'UNL:GLY:VdWContact': 28, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:HBAcceptor': 8, 'UNL:LYS:VdWContact': 8, 'UNL:SER:HBAcceptor': 16, 'UNL:SER:VdWContact': 32}"
+7,P2Rank-Vina,H1172v4,,0.0,,
+8,P2Rank-Vina,T1146,0.7142857142857142,0.989010989010989,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1}"
+9,P2Rank-Vina,H1172v2,,0.0,,
+10,P2Rank-Vina,T1186,0.9999999999999999,0.9832775919732442,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 3, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 4, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+11,P2Rank-Vina,T1187,1.1428571428571426,0.9804108934543717,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 8, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 4, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBDonor': 2, 'UNL:GLY:VdWContact': 4, 'UNL:LYS:HBAcceptor': 2, 'UNL:LYS:VdWContact': 2, 'UNL:SER:HBDonor': 2, 'UNL:SER:VdWContact': 4, 'UNL:THR:VdWContact': 4, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 4}","{'UNL:ALA:HBAcceptor': 4, 'UNL:ALA:VdWContact': 4, 'UNL:ASP:VdWContact': 4, 'UNL:LYS:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:HBAcceptor': 8, 'UNL:TRP:VdWContact': 8, 'UNL:VAL:VdWContact': 2}"
+12,P2Rank-Vina,T1127v2,5.0,0.9030100334448161,"{'UNL:ALA:Hydrophobic': 5, 'UNL:ALA:VdWContact': 5, 'UNL:ARG:HBAcceptor': 10, 'UNL:ARG:HBDonor': 10, 'UNL:ARG:VdWContact': 30, 'UNL:ASN:HBAcceptor': 15, 'UNL:ASN:Hydrophobic': 5, 'UNL:ASN:VdWContact': 15, 'UNL:ASP:VdWContact': 5, 'UNL:GLN:HBAcceptor': 5, 'UNL:GLN:VdWContact': 5, 'UNL:GLU:HBDonor': 10, 'UNL:GLU:Hydrophobic': 15, 'UNL:GLU:VdWContact': 35, 'UNL:GLY:HBDonor': 5, 'UNL:GLY:VdWContact': 5, 'UNL:HIS:VdWContact': 5, 'UNL:ILE:HBAcceptor': 10, 'UNL:ILE:Hydrophobic': 15, 'UNL:ILE:VdWContact': 25, 'UNL:LEU:Hydrophobic': 30, 'UNL:LEU:VdWContact': 35, 'UNL:MET:HBAcceptor': 5, 'UNL:MET:Hydrophobic': 10, 'UNL:MET:VdWContact': 10, 'UNL:PHE:Hydrophobic': 35, 'UNL:PHE:VdWContact': 40, 'UNL:PRO:Hydrophobic': 5, 'UNL:PRO:VdWContact': 5, 'UNL:TRP:Hydrophobic': 10, 'UNL:TRP:VdWContact': 15, 'UNL:TYR:HBAcceptor': 10, 'UNL:TYR:Hydrophobic': 15, 'UNL:TYR:VdWContact': 15, 'UNL:VAL:VdWContact': 10}","{'UNL:ALA:VdWContact': 5, 'UNL:ARG:HBAcceptor': 30, 'UNL:ARG:VdWContact': 35, 'UNL:ASN:HBAcceptor': 10, 'UNL:ASN:Hydrophobic': 10, 'UNL:ASN:VdWContact': 25, 'UNL:ASP:VdWContact': 5, 'UNL:GLN:VdWContact': 10, 'UNL:GLU:VdWContact': 20, 'UNL:GLY:HBAcceptor': 20, 'UNL:GLY:VdWContact': 20, 'UNL:ILE:HBAcceptor': 5, 'UNL:ILE:VdWContact': 5, 'UNL:LEU:VdWContact': 10, 'UNL:LYS:HBAcceptor': 10, 'UNL:LYS:VdWContact': 10, 'UNL:MET:HBAcceptor': 10, 'UNL:MET:VdWContact': 15, 'UNL:PHE:VdWContact': 20, 'UNL:TRP:VdWContact': 5, 'UNL:VAL:HBAcceptor': 5, 'UNL:VAL:VdWContact': 5}"
+13,P2Rank-Vina,T1124,2.0000000000000004,0.9632107023411371,"{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBAcceptor': 8, 'UNL:ASN:HBDonor': 4, 'UNL:ASN:Hydrophobic': 4, 'UNL:ASN:VdWContact': 12, 'UNL:ASP:HBDonor': 4, 'UNL:ASP:VdWContact': 4, 'UNL:GLN:Hydrophobic': 4, 'UNL:GLN:VdWContact': 8, 'UNL:GLU:Hydrophobic': 4, 'UNL:GLU:VdWContact': 4, 'UNL:GLY:VdWContact': 12, 'UNL:HIS:VdWContact': 8, 'UNL:ILE:Hydrophobic': 8, 'UNL:ILE:VdWContact': 8, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 4, 'UNL:PHE:Hydrophobic': 8, 'UNL:PHE:VdWContact': 8, 'UNL:PRO:Hydrophobic': 4, 'UNL:PRO:VdWContact': 4, 'UNL:SER:VdWContact': 8, 'UNL:THR:Hydrophobic': 8, 'UNL:THR:VdWContact': 8, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 8, 'UNL:TYR:HBAcceptor': 4, 'UNL:TYR:Hydrophobic': 8, 'UNL:TYR:VdWContact': 8, 'UNL:VAL:HBDonor': 4, 'UNL:VAL:Hydrophobic': 8, 'UNL:VAL:VdWContact': 8}","{'UNL:ALA:VdWContact': 8, 'UNL:ASN:HBAcceptor': 8, 'UNL:ASN:VdWContact': 8, 'UNL:ASP:VdWContact': 16, 'UNL:GLY:VdWContact': 8, 'UNL:HIS:HBAcceptor': 4, 'UNL:HIS:VdWContact': 8, 'UNL:ILE:Hydrophobic': 8, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 8, 'UNL:LYS:VdWContact': 8, 'UNL:PHE:HBAcceptor': 8, 'UNL:PHE:Hydrophobic': 8, 'UNL:PHE:VdWContact': 8, 'UNL:SER:VdWContact': 8, 'UNL:TYR:Hydrophobic': 8, 'UNL:TYR:VdWContact': 20, 'UNL:VAL:Hydrophobic': 8, 'UNL:VAL:VdWContact': 4}"
+14,P2Rank-Vina,T1158v3,0.4615384615384614,0.9940828402366864,"{'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}"
+15,P2Rank-Vina,H1172v3,,0.0,,
+16,P2Rank-Vina,H1135,48.0,0.04013377926421402,"{'UNL:ALA:VdWContact': 12, 'UNL:ARG:VdWContact': 48, 'UNL:ASN:VdWContact': 24, 'UNL:ASP:VdWContact': 48, 'UNL:GLN:VdWContact': 60, 'UNL:GLY:VdWContact': 24, 'UNL:HIS:VdWContact': 12, 'UNL:ILE:VdWContact': 36, 'UNL:LEU:VdWContact': 24, 'UNL:PHE:VdWContact': 12, 'UNL:SER:VdWContact': 36, 'UNL:THR:VdWContact': 24, 'UNL:TRP:VdWContact': 24, 'UNL:TYR:VdWContact': 48, 'UNL:VAL:VdWContact': 48}","{'UNL:ARG:VdWContact': 72, 'UNL:ASN:VdWContact': 144, 'UNL:ASP:VdWContact': 144, 'UNL:GLN:VdWContact': 144, 'UNL:ILE:VdWContact': 108, 'UNL:SER:VdWContact': 36, 'UNL:TYR:VdWContact': 144, 'UNL:VAL:VdWContact': 144}"
+17,DiffDock-L,H1171v2,,0.0,,
+18,DiffDock-L,T1158v2,0.23076923076923067,0.9987136609210188,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1}"
+19,DiffDock-L,T1152,1138.4999999999998,0.0,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:VdWContact': 3, 'UNL:THR:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 384, 'UNL:ASN:HBAcceptor': 1152, 'UNL:ASN:VdWContact': 3584, 'UNL:ASP:VdWContact': 1536, 'UNL:GLN:HBAcceptor': 896, 'UNL:GLN:VdWContact': 2560, 'UNL:GLU:HBAcceptor': 128, 'UNL:GLU:VdWContact': 896, 'UNL:GLY:HBAcceptor': 640, 'UNL:GLY:VdWContact': 1920, 'UNL:ILE:HBAcceptor': 512, 'UNL:ILE:VdWContact': 3072, 'UNL:LEU:VdWContact': 1280, 'UNL:LYS:HBAcceptor': 512, 'UNL:LYS:VdWContact': 4224, 'UNL:MET:VdWContact': 1280, 'UNL:PRO:VdWContact': 2432, 'UNL:SER:HBAcceptor': 128, 'UNL:SER:VdWContact': 512, 'UNL:THR:HBAcceptor': 768, 'UNL:THR:VdWContact': 2048, 'UNL:TRP:HBAcceptor': 512, 'UNL:TRP:VdWContact': 768, 'UNL:TYR:VdWContact': 1024, 'UNL:VAL:VdWContact': 1408}"
+20,DiffDock-L,T1158v1,0.3846153846153845,0.9956264471314639,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2}"
+21,DiffDock-L,H1171v1,,0.0,,
+22,DiffDock-L,H1172v1,12.789473684210527,0.7466995247315613,"{'UNL:ALA:VdWContact': 9, 'UNL:ARG:VdWContact': 63, 'UNL:GLY:HBAcceptor': 54, 'UNL:GLY:VdWContact': 54, 'UNL:ILE:HBDonor': 27, 'UNL:ILE:Hydrophobic': 27, 'UNL:ILE:VdWContact': 27, 'UNL:LEU:VdWContact': 27, 'UNL:LYS:HBAcceptor': 27, 'UNL:LYS:VdWContact': 27, 'UNL:PRO:Hydrophobic': 99, 'UNL:PRO:VdWContact': 36, 'UNL:THR:HBAcceptor': 27, 'UNL:THR:VdWContact': 54, 'UNL:TYR:HBDonor': 18, 'UNL:TYR:Hydrophobic': 54, 'UNL:TYR:VdWContact': 54}","{'UNL:ARG:HBAcceptor': 54, 'UNL:ARG:VdWContact': 63, 'UNL:GLY:HBAcceptor': 63, 'UNL:GLY:VdWContact': 90, 'UNL:ILE:VdWContact': 54, 'UNL:LEU:VdWContact': 18, 'UNL:LYS:HBAcceptor': 36, 'UNL:LYS:VdWContact': 36, 'UNL:PRO:Hydrophobic': 18, 'UNL:PRO:VdWContact': 45, 'UNL:THR:HBAcceptor': 72, 'UNL:THR:VdWContact': 144, 'UNL:TYR:HBAcceptor': 9, 'UNL:TYR:VdWContact': 9}"
+23,DiffDock-L,T1158v4,6.476190476190476,0.8733874820831342,"{'UNL:ALA:VdWContact': 4, 'UNL:ASP:VdWContact': 4, 'UNL:GLN:HBAcceptor': 4, 'UNL:GLN:VdWContact': 4, 'UNL:GLY:HBAcceptor': 4, 'UNL:GLY:HBDonor': 4, 'UNL:GLY:VdWContact': 8, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:HBAcceptor': 4, 'UNL:LYS:VdWContact': 4, 'UNL:SER:HBAcceptor': 4, 'UNL:SER:HBDonor': 4, 'UNL:SER:VdWContact': 8, 'UNL:THR:VdWContact': 4, 'UNL:TYR:HBAcceptor': 4, 'UNL:TYR:Hydrophobic': 4, 'UNL:TYR:VdWContact': 4, 'UNL:VAL:VdWContact': 4}","{'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBAcceptor': 4, 'UNL:ASN:VdWContact': 8, 'UNL:ASP:VdWContact': 4, 'UNL:GLN:HBAcceptor': 12, 'UNL:GLN:VdWContact': 24, 'UNL:GLY:HBAcceptor': 24, 'UNL:GLY:VdWContact': 28, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:HBAcceptor': 8, 'UNL:LYS:VdWContact': 8, 'UNL:SER:HBAcceptor': 16, 'UNL:SER:VdWContact': 32}"
+24,DiffDock-L,H1172v4,,0.0,,
+25,DiffDock-L,T1146,0.4545454545454546,0.9942231681362116,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1}"
+26,DiffDock-L,H1172v2,,0.0,,
+27,DiffDock-L,T1186,0.4615384615384615,0.9940828402366864,"{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 3, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 4, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+28,DiffDock-L,T1187,1.368421052631579,0.9758845273719415,"{'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 4, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:HBAcceptor': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PRO:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:VdWContact': 4}","{'UNL:ALA:HBAcceptor': 4, 'UNL:ALA:VdWContact': 4, 'UNL:ASP:VdWContact': 4, 'UNL:LYS:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:HBAcceptor': 8, 'UNL:TRP:VdWContact': 8, 'UNL:VAL:VdWContact': 2}"
+29,DiffDock-L,T1127v2,2.5000000000000004,0.9531772575250836,"{'UNL:ALA:Hydrophobic': 5, 'UNL:ALA:VdWContact': 5, 'UNL:ARG:HBAcceptor': 10, 'UNL:ARG:Hydrophobic': 5, 'UNL:ARG:VdWContact': 20, 'UNL:GLN:HBAcceptor': 5, 'UNL:GLN:Hydrophobic': 5, 'UNL:GLN:VdWContact': 5, 'UNL:GLU:VdWContact': 15, 'UNL:GLY:HBAcceptor': 10, 'UNL:GLY:HBDonor': 5, 'UNL:GLY:VdWContact': 10, 'UNL:ILE:HBAcceptor': 5, 'UNL:ILE:Hydrophobic': 15, 'UNL:ILE:VdWContact': 15, 'UNL:LEU:Hydrophobic': 10, 'UNL:LEU:VdWContact': 10, 'UNL:LYS:VdWContact': 5, 'UNL:MET:Hydrophobic': 15, 'UNL:MET:VdWContact': 15, 'UNL:PHE:HBDonor': 5, 'UNL:PHE:Hydrophobic': 5, 'UNL:PHE:VdWContact': 20, 'UNL:TRP:Hydrophobic': 10, 'UNL:TRP:VdWContact': 10, 'UNL:TYR:VdWContact': 5}","{'UNL:ALA:VdWContact': 5, 'UNL:ARG:HBAcceptor': 30, 'UNL:ARG:VdWContact': 35, 'UNL:ASN:HBAcceptor': 10, 'UNL:ASN:Hydrophobic': 10, 'UNL:ASN:VdWContact': 25, 'UNL:ASP:VdWContact': 5, 'UNL:GLN:VdWContact': 10, 'UNL:GLU:VdWContact': 20, 'UNL:GLY:HBAcceptor': 20, 'UNL:GLY:VdWContact': 20, 'UNL:ILE:HBAcceptor': 5, 'UNL:ILE:VdWContact': 5, 'UNL:LEU:VdWContact': 10, 'UNL:LYS:HBAcceptor': 10, 'UNL:LYS:VdWContact': 10, 'UNL:MET:HBAcceptor': 10, 'UNL:MET:VdWContact': 15, 'UNL:PHE:VdWContact': 20, 'UNL:TRP:VdWContact': 5, 'UNL:VAL:HBAcceptor': 5, 'UNL:VAL:VdWContact': 5}"
+30,DiffDock-L,T1124,2.133333333333333,0.9605351170568562,"{'UNL:ALA:VdWContact': 4, 'UNL:ASN:HBAcceptor': 4, 'UNL:ASN:Hydrophobic': 4, 'UNL:ASN:VdWContact': 4, 'UNL:ASP:HBDonor': 8, 'UNL:ASP:Hydrophobic': 4, 'UNL:ASP:VdWContact': 8, 'UNL:CYS:VdWContact': 4, 'UNL:GLY:VdWContact': 8, 'UNL:ILE:Hydrophobic': 8, 'UNL:ILE:VdWContact': 12, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 4, 'UNL:PHE:HBAcceptor': 4, 'UNL:PHE:Hydrophobic': 8, 'UNL:PHE:VdWContact': 8, 'UNL:PRO:Hydrophobic': 4, 'UNL:PRO:VdWContact': 4, 'UNL:SER:HBAcceptor': 4, 'UNL:SER:HBDonor': 4, 'UNL:SER:VdWContact': 4, 'UNL:TRP:Hydrophobic': 8, 'UNL:TRP:VdWContact': 12, 'UNL:TYR:Hydrophobic': 8, 'UNL:TYR:VdWContact': 12, 'UNL:VAL:Hydrophobic': 8, 'UNL:VAL:VdWContact': 4}","{'UNL:ALA:VdWContact': 8, 'UNL:ASN:HBAcceptor': 8, 'UNL:ASN:VdWContact': 8, 'UNL:ASP:VdWContact': 16, 'UNL:GLY:VdWContact': 8, 'UNL:HIS:HBAcceptor': 4, 'UNL:HIS:VdWContact': 8, 'UNL:ILE:Hydrophobic': 8, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 8, 'UNL:LYS:VdWContact': 8, 'UNL:PHE:HBAcceptor': 8, 'UNL:PHE:Hydrophobic': 8, 'UNL:PHE:VdWContact': 8, 'UNL:SER:VdWContact': 8, 'UNL:TYR:Hydrophobic': 8, 'UNL:TYR:VdWContact': 20, 'UNL:VAL:Hydrophobic': 8, 'UNL:VAL:VdWContact': 4}"
+31,DiffDock-L,T1158v3,0.33333333333333326,0.9966555183946488,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}"
+32,DiffDock-L,H1172v3,,0.0,,
+33,DiffDock-L,H1135,55.2,0.0,"{'UNL:ARG:VdWContact': 12, 'UNL:GLN:VdWContact': 12, 'UNL:GLU:VdWContact': 24, 'UNL:LEU:VdWContact': 12, 'UNL:LYS:VdWContact': 12, 'UNL:MET:VdWContact': 12, 'UNL:PHE:VdWContact': 12, 'UNL:SER:VdWContact': 12, 'UNL:THR:VdWContact': 24, 'UNL:TRP:VdWContact': 24}","{'UNL:ARG:VdWContact': 72, 'UNL:ASN:VdWContact': 144, 'UNL:ASP:VdWContact': 144, 'UNL:GLN:VdWContact': 144, 'UNL:ILE:VdWContact': 108, 'UNL:SER:VdWContact': 36, 'UNL:TYR:VdWContact': 144, 'UNL:VAL:VdWContact': 144}"
+34,DynamicBind,H1171v2,20.57142857142857,0.5905398948877211,"{'UNL:ALA:VdWContact': 9, 'UNL:ARG:HBAcceptor': 9, 'UNL:ARG:Hydrophobic': 18, 'UNL:ARG:VdWContact': 45, 'UNL:ASP:Hydrophobic': 9, 'UNL:ASP:VdWContact': 9, 'UNL:GLU:HBAcceptor': 9, 'UNL:GLU:HBDonor': 9, 'UNL:GLU:Hydrophobic': 9, 'UNL:GLU:VdWContact': 27, 'UNL:GLY:HBAcceptor': 36, 'UNL:GLY:HBDonor': 9, 'UNL:GLY:VdWContact': 36, 'UNL:ILE:Hydrophobic': 18, 'UNL:LEU:HBAcceptor': 9, 'UNL:LEU:HBDonor': 9, 'UNL:LEU:VdWContact': 18, 'UNL:LYS:VdWContact': 18, 'UNL:PRO:Hydrophobic': 18, 'UNL:PRO:VdWContact': 18, 'UNL:THR:HBAcceptor': 27, 'UNL:THR:VdWContact': 36, 'UNL:TYR:HBDonor': 9, 'UNL:TYR:Hydrophobic': 18, 'UNL:TYR:VdWContact': 18}","{'UNL:ARG:HBAcceptor': 72, 'UNL:ARG:VdWContact': 81, 'UNL:GLY:HBAcceptor': 72, 'UNL:GLY:VdWContact': 81, 'UNL:ILE:VdWContact': 36, 'UNL:LEU:VdWContact': 27, 'UNL:LYS:HBAcceptor': 45, 'UNL:LYS:VdWContact': 54, 'UNL:PRO:Hydrophobic': 27, 'UNL:PRO:VdWContact': 45, 'UNL:THR:HBAcceptor': 63, 'UNL:THR:Hydrophobic': 9, 'UNL:THR:VdWContact': 162}"
+35,DynamicBind,T1158v2,0.25,0.9983277591973244,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1}"
+36,DynamicBind,T1152,1138.7,0.0,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 384, 'UNL:ASN:HBAcceptor': 1152, 'UNL:ASN:VdWContact': 3584, 'UNL:ASP:VdWContact': 1536, 'UNL:GLN:HBAcceptor': 896, 'UNL:GLN:VdWContact': 2560, 'UNL:GLU:HBAcceptor': 128, 'UNL:GLU:VdWContact': 896, 'UNL:GLY:HBAcceptor': 640, 'UNL:GLY:VdWContact': 1920, 'UNL:ILE:HBAcceptor': 512, 'UNL:ILE:VdWContact': 3072, 'UNL:LEU:VdWContact': 1280, 'UNL:LYS:HBAcceptor': 512, 'UNL:LYS:VdWContact': 4224, 'UNL:MET:VdWContact': 1280, 'UNL:PRO:VdWContact': 2432, 'UNL:SER:HBAcceptor': 128, 'UNL:SER:VdWContact': 512, 'UNL:THR:HBAcceptor': 768, 'UNL:THR:VdWContact': 2048, 'UNL:TRP:HBAcceptor': 512, 'UNL:TRP:VdWContact': 768, 'UNL:TYR:VdWContact': 1024, 'UNL:VAL:VdWContact': 1408}"
+37,DynamicBind,T1158v1,0.2666666666666667,0.9979933110367893,"{'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2}"
+38,DynamicBind,H1171v1,29.480000000000004,0.4117725752508361,"{'UNL:ALA:VdWContact': 11, 'UNL:ARG:HBAcceptor': 22, 'UNL:ARG:Hydrophobic': 22, 'UNL:ARG:VdWContact': 44, 'UNL:ASP:Hydrophobic': 11, 'UNL:ASP:VdWContact': 11, 'UNL:GLU:HBDonor': 11, 'UNL:GLU:Hydrophobic': 11, 'UNL:GLU:VdWContact': 33, 'UNL:GLY:HBAcceptor': 55, 'UNL:GLY:HBDonor': 11, 'UNL:GLY:VdWContact': 55, 'UNL:ILE:Hydrophobic': 22, 'UNL:LEU:HBDonor': 22, 'UNL:LEU:VdWContact': 22, 'UNL:LYS:VdWContact': 22, 'UNL:PRO:Hydrophobic': 22, 'UNL:PRO:VdWContact': 22, 'UNL:THR:HBAcceptor': 22, 'UNL:THR:VdWContact': 33, 'UNL:TYR:Hydrophobic': 44, 'UNL:TYR:VdWContact': 22}","{'UNL:ARG:HBAcceptor': 110, 'UNL:ARG:VdWContact': 99, 'UNL:ASN:VdWContact': 11, 'UNL:ASP:VdWContact': 22, 'UNL:GLY:HBAcceptor': 99, 'UNL:GLY:VdWContact': 121, 'UNL:ILE:VdWContact': 55, 'UNL:LEU:VdWContact': 11, 'UNL:LYS:HBAcceptor': 44, 'UNL:LYS:VdWContact': 44, 'UNL:PRO:Hydrophobic': 44, 'UNL:PRO:VdWContact': 55, 'UNL:THR:HBAcceptor': 88, 'UNL:THR:VdWContact': 231, 'UNL:TYR:VdWContact': 11}"
+39,DynamicBind,H1172v1,18.0,0.6421404682274248,"{'UNL:ARG:HBAcceptor': 18, 'UNL:ARG:VdWContact': 36, 'UNL:ASP:VdWContact': 9, 'UNL:GLU:Hydrophobic': 9, 'UNL:GLU:VdWContact': 18, 'UNL:GLY:HBAcceptor': 36, 'UNL:GLY:HBDonor': 9, 'UNL:GLY:VdWContact': 36, 'UNL:ILE:HBDonor': 9, 'UNL:ILE:Hydrophobic': 18, 'UNL:ILE:VdWContact': 9, 'UNL:LEU:HBAcceptor': 9, 'UNL:LEU:HBDonor': 9, 'UNL:LEU:VdWContact': 18, 'UNL:LYS:HBAcceptor': 9, 'UNL:LYS:VdWContact': 18, 'UNL:PRO:Hydrophobic': 36, 'UNL:PRO:VdWContact': 27, 'UNL:THR:HBAcceptor': 18, 'UNL:THR:Hydrophobic': 9, 'UNL:THR:VdWContact': 45, 'UNL:TYR:HBDonor': 9, 'UNL:TYR:Hydrophobic': 27, 'UNL:TYR:VdWContact': 36}","{'UNL:ARG:HBAcceptor': 54, 'UNL:ARG:VdWContact': 63, 'UNL:GLY:HBAcceptor': 63, 'UNL:GLY:VdWContact': 90, 'UNL:ILE:VdWContact': 54, 'UNL:LEU:VdWContact': 18, 'UNL:LYS:HBAcceptor': 36, 'UNL:LYS:VdWContact': 36, 'UNL:PRO:Hydrophobic': 18, 'UNL:PRO:VdWContact': 45, 'UNL:THR:HBAcceptor': 72, 'UNL:THR:VdWContact': 144, 'UNL:TYR:HBAcceptor': 9, 'UNL:TYR:VdWContact': 9}"
+40,DynamicBind,T1158v4,4.545454545454545,0.9121313469139556,"{'UNL:ALA:VdWContact': 4, 'UNL:ARG:VdWContact': 12, 'UNL:GLU:VdWContact': 4, 'UNL:GLY:HBAcceptor': 8, 'UNL:GLY:HBDonor': 4, 'UNL:GLY:VdWContact': 12, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:HBDonor': 4, 'UNL:LYS:VdWContact': 8, 'UNL:PHE:VdWContact': 4, 'UNL:SER:VdWContact': 8, 'UNL:THR:VdWContact': 4, 'UNL:TRP:VdWContact': 4, 'UNL:VAL:HBDonor': 4, 'UNL:VAL:VdWContact': 8}","{'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBAcceptor': 4, 'UNL:ASN:VdWContact': 8, 'UNL:ASP:VdWContact': 4, 'UNL:GLN:HBAcceptor': 12, 'UNL:GLN:VdWContact': 24, 'UNL:GLY:HBAcceptor': 24, 'UNL:GLY:VdWContact': 28, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:HBAcceptor': 8, 'UNL:LYS:VdWContact': 8, 'UNL:SER:HBAcceptor': 16, 'UNL:SER:VdWContact': 32}"
+41,DynamicBind,H1172v4,14.225806451612902,0.717876793613119,"{'UNL:ALA:Hydrophobic': 9, 'UNL:ARG:HBAcceptor': 9, 'UNL:ARG:HBDonor': 9, 'UNL:ARG:Hydrophobic': 18, 'UNL:ARG:VdWContact': 54, 'UNL:ASN:Hydrophobic': 9, 'UNL:ASN:VdWContact': 9, 'UNL:ASP:Hydrophobic': 9, 'UNL:ASP:VdWContact': 9, 'UNL:GLU:HBAcceptor': 9, 'UNL:GLU:HBDonor': 9, 'UNL:GLU:Hydrophobic': 9, 'UNL:GLU:VdWContact': 18, 'UNL:GLY:HBAcceptor': 36, 'UNL:GLY:VdWContact': 36, 'UNL:ILE:HBDonor': 9, 'UNL:ILE:Hydrophobic': 18, 'UNL:ILE:VdWContact': 9, 'UNL:LEU:VdWContact': 27, 'UNL:LYS:VdWContact': 27, 'UNL:PRO:Hydrophobic': 36, 'UNL:PRO:VdWContact': 18, 'UNL:SER:VdWContact': 9, 'UNL:THR:HBAcceptor': 54, 'UNL:THR:Hydrophobic': 9, 'UNL:THR:VdWContact': 63, 'UNL:TYR:HBDonor': 9, 'UNL:TYR:Hydrophobic': 36, 'UNL:TYR:VdWContact': 36}","{'UNL:ARG:HBAcceptor': 63, 'UNL:ARG:VdWContact': 63, 'UNL:GLY:HBAcceptor': 99, 'UNL:GLY:VdWContact': 81, 'UNL:ILE:VdWContact': 45, 'UNL:LEU:HBAcceptor': 9, 'UNL:LEU:VdWContact': 27, 'UNL:LYS:HBAcceptor': 45, 'UNL:LYS:VdWContact': 45, 'UNL:PRO:Hydrophobic': 27, 'UNL:PRO:VdWContact': 36, 'UNL:THR:HBAcceptor': 72, 'UNL:THR:VdWContact': 135, 'UNL:TYR:VdWContact': 18}"
+42,DynamicBind,T1146,0.19999999999999996,0.9993311036789297,"{'UNL:ASP:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1}"
+43,DynamicBind,H1172v2,19.173913043478258,0.6185836847462558,"{'UNL:ARG:HBAcceptor': 18, 'UNL:ARG:Hydrophobic': 18, 'UNL:ARG:VdWContact': 63, 'UNL:ASP:VdWContact': 18, 'UNL:GLU:VdWContact': 18, 'UNL:GLY:HBAcceptor': 18, 'UNL:GLY:VdWContact': 36, 'UNL:ILE:HBDonor': 9, 'UNL:ILE:Hydrophobic': 9, 'UNL:ILE:VdWContact': 18, 'UNL:LEU:HBDonor': 9, 'UNL:LEU:VdWContact': 18, 'UNL:LYS:VdWContact': 18, 'UNL:PHE:VdWContact': 9, 'UNL:PRO:Hydrophobic': 36, 'UNL:PRO:VdWContact': 27, 'UNL:THR:HBAcceptor': 27, 'UNL:THR:Hydrophobic': 18, 'UNL:THR:VdWContact': 54, 'UNL:TYR:HBDonor': 9, 'UNL:TYR:Hydrophobic': 18, 'UNL:TYR:VdWContact': 18}","{'UNL:ARG:HBAcceptor': 63, 'UNL:ARG:VdWContact': 63, 'UNL:GLY:HBAcceptor': 72, 'UNL:GLY:VdWContact': 81, 'UNL:ILE:VdWContact': 45, 'UNL:LEU:VdWContact': 9, 'UNL:LYS:HBAcceptor': 27, 'UNL:LYS:VdWContact': 45, 'UNL:PRO:Hydrophobic': 18, 'UNL:PRO:VdWContact': 27, 'UNL:THR:HBAcceptor': 72, 'UNL:THR:VdWContact': 135, 'UNL:TYR:VdWContact': 18}"
+44,DynamicBind,T1186,0.4285714285714285,0.9947443860487338,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 3, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 3, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 4, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+45,DynamicBind,T1187,1.5294117647058825,0.9726539445209522,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 4, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:TRP:HBAcceptor': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 4, 'UNL:ALA:VdWContact': 4, 'UNL:ASP:VdWContact': 4, 'UNL:LYS:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:HBAcceptor': 8, 'UNL:TRP:VdWContact': 8, 'UNL:VAL:VdWContact': 2}"
+46,DynamicBind,T1127v2,2.027027027027027,0.9626683539727018,"{'UNL:ARG:HBAcceptor': 5, 'UNL:ARG:HBDonor': 5, 'UNL:ARG:Hydrophobic': 5, 'UNL:ARG:VdWContact': 15, 'UNL:ASP:Hydrophobic': 5, 'UNL:ASP:VdWContact': 5, 'UNL:GLU:HBDonor': 10, 'UNL:GLU:Hydrophobic': 20, 'UNL:GLU:VdWContact': 20, 'UNL:ILE:Hydrophobic': 10, 'UNL:ILE:VdWContact': 15, 'UNL:LEU:Hydrophobic': 15, 'UNL:LEU:VdWContact': 25, 'UNL:MET:Hydrophobic': 5, 'UNL:MET:VdWContact': 5, 'UNL:PHE:Hydrophobic': 5, 'UNL:PHE:VdWContact': 5, 'UNL:SER:VdWContact': 5, 'UNL:TRP:HBAcceptor': 5, 'UNL:TRP:Hydrophobic': 10, 'UNL:TRP:VdWContact': 15, 'UNL:TYR:HBAcceptor': 5, 'UNL:TYR:Hydrophobic': 10, 'UNL:TYR:VdWContact': 10}","{'UNL:ALA:VdWContact': 5, 'UNL:ARG:HBAcceptor': 30, 'UNL:ARG:VdWContact': 35, 'UNL:ASN:HBAcceptor': 10, 'UNL:ASN:Hydrophobic': 10, 'UNL:ASN:VdWContact': 25, 'UNL:ASP:VdWContact': 5, 'UNL:GLN:VdWContact': 10, 'UNL:GLU:VdWContact': 20, 'UNL:GLY:HBAcceptor': 20, 'UNL:GLY:VdWContact': 20, 'UNL:ILE:HBAcceptor': 5, 'UNL:ILE:VdWContact': 5, 'UNL:LEU:VdWContact': 10, 'UNL:LYS:HBAcceptor': 10, 'UNL:LYS:VdWContact': 10, 'UNL:MET:HBAcceptor': 10, 'UNL:MET:VdWContact': 15, 'UNL:PHE:VdWContact': 20, 'UNL:TRP:VdWContact': 5, 'UNL:VAL:HBAcceptor': 5, 'UNL:VAL:VdWContact': 5}"
+47,DynamicBind,T1124,,0.0,,
+48,DynamicBind,T1158v3,0.3333333333333334,0.9966555183946488,"{'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2}","{'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}"
+49,DynamicBind,H1172v3,13.538461538461537,0.7316696681245176,"{'UNL:ARG:HBAcceptor': 8, 'UNL:ARG:Hydrophobic': 16, 'UNL:ARG:VdWContact': 40, 'UNL:ASP:VdWContact': 16, 'UNL:GLU:Hydrophobic': 8, 'UNL:GLU:VdWContact': 24, 'UNL:GLY:HBAcceptor': 32, 'UNL:GLY:HBDonor': 8, 'UNL:GLY:VdWContact': 40, 'UNL:ILE:HBDonor': 8, 'UNL:ILE:Hydrophobic': 16, 'UNL:ILE:VdWContact': 8, 'UNL:LEU:HBDonor': 8, 'UNL:LEU:VdWContact': 24, 'UNL:LYS:HBAcceptor': 16, 'UNL:LYS:HBDonor': 8, 'UNL:LYS:Hydrophobic': 8, 'UNL:LYS:VdWContact': 16, 'UNL:PRO:Hydrophobic': 56, 'UNL:PRO:VdWContact': 48, 'UNL:THR:HBAcceptor': 24, 'UNL:THR:Hydrophobic': 24, 'UNL:THR:VdWContact': 40, 'UNL:TYR:HBDonor': 16, 'UNL:TYR:Hydrophobic': 32, 'UNL:TYR:VdWContact': 24}","{'UNL:ARG:HBAcceptor': 56, 'UNL:ARG:VdWContact': 64, 'UNL:GLY:HBAcceptor': 64, 'UNL:GLY:VdWContact': 72, 'UNL:ILE:VdWContact': 32, 'UNL:LEU:VdWContact': 24, 'UNL:LYS:HBAcceptor': 40, 'UNL:LYS:VdWContact': 48, 'UNL:PRO:Hydrophobic': 16, 'UNL:PRO:VdWContact': 24, 'UNL:THR:HBAcceptor': 56, 'UNL:THR:VdWContact': 88}"
+50,DynamicBind,H1135,51.69230769230769,0.0,"{'UNL:CYS:VdWContact': 24, 'UNL:GLY:VdWContact': 24, 'UNL:MET:VdWContact': 12, 'UNL:PRO:VdWContact': 60, 'UNL:SER:VdWContact': 60, 'UNL:THR:VdWContact': 36, 'UNL:TYR:VdWContact': 36, 'UNL:VAL:VdWContact': 12}","{'UNL:ARG:VdWContact': 72, 'UNL:ASN:VdWContact': 144, 'UNL:ASP:VdWContact': 144, 'UNL:GLN:VdWContact': 144, 'UNL:ILE:VdWContact': 108, 'UNL:SER:VdWContact': 36, 'UNL:TYR:VdWContact': 144, 'UNL:VAL:VdWContact': 144}"
+51,NeuralPLexer,H1171v2,13.178571428571429,0.7388915432393693,"{'UNL:ALA:Hydrophobic': 18, 'UNL:ALA:VdWContact': 9, 'UNL:ARG:HBDonor': 18, 'UNL:ARG:Hydrophobic': 36, 'UNL:ARG:VdWContact': 117, 'UNL:ASN:HBAcceptor': 27, 'UNL:ASN:HBDonor': 27, 'UNL:ASN:VdWContact': 36, 'UNL:GLU:HBDonor': 18, 'UNL:GLU:VdWContact': 18, 'UNL:GLY:HBAcceptor': 27, 'UNL:GLY:VdWContact': 90, 'UNL:ILE:Hydrophobic': 45, 'UNL:ILE:VdWContact': 36, 'UNL:LEU:Hydrophobic': 18, 'UNL:LEU:VdWContact': 90, 'UNL:LYS:HBAcceptor': 27, 'UNL:LYS:Hydrophobic': 9, 'UNL:LYS:VdWContact': 45, 'UNL:PRO:Hydrophobic': 63, 'UNL:PRO:VdWContact': 63, 'UNL:THR:HBAcceptor': 9, 'UNL:THR:VdWContact': 81, 'UNL:TYR:HBAcceptor': 9, 'UNL:TYR:Hydrophobic': 27, 'UNL:TYR:VdWContact': 36}","{'UNL:ARG:HBAcceptor': 72, 'UNL:ARG:VdWContact': 81, 'UNL:GLY:HBAcceptor': 72, 'UNL:GLY:VdWContact': 81, 'UNL:ILE:VdWContact': 36, 'UNL:LEU:VdWContact': 27, 'UNL:LYS:HBAcceptor': 45, 'UNL:LYS:VdWContact': 54, 'UNL:PRO:Hydrophobic': 27, 'UNL:PRO:VdWContact': 45, 'UNL:THR:HBAcceptor': 63, 'UNL:THR:Hydrophobic': 9, 'UNL:THR:VdWContact': 162}"
+52,NeuralPLexer,T1158v2,0.39999999999999997,0.9953177257525083,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1}"
+53,NeuralPLexer,T1152,1220.1785714285713,0.0,"{'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:VdWContact': 384, 'UNL:ASN:HBAcceptor': 1152, 'UNL:ASN:VdWContact': 3584, 'UNL:ASP:VdWContact': 1536, 'UNL:GLN:HBAcceptor': 896, 'UNL:GLN:VdWContact': 2560, 'UNL:GLU:HBAcceptor': 128, 'UNL:GLU:VdWContact': 896, 'UNL:GLY:HBAcceptor': 640, 'UNL:GLY:VdWContact': 1920, 'UNL:ILE:HBAcceptor': 512, 'UNL:ILE:VdWContact': 3072, 'UNL:LEU:VdWContact': 1280, 'UNL:LYS:HBAcceptor': 512, 'UNL:LYS:VdWContact': 4224, 'UNL:MET:VdWContact': 1280, 'UNL:PRO:VdWContact': 2432, 'UNL:SER:HBAcceptor': 128, 'UNL:SER:VdWContact': 512, 'UNL:THR:HBAcceptor': 768, 'UNL:THR:VdWContact': 2048, 'UNL:TRP:HBAcceptor': 512, 'UNL:TRP:VdWContact': 768, 'UNL:TYR:VdWContact': 1024, 'UNL:VAL:VdWContact': 1408}"
+54,NeuralPLexer,T1158v1,0.44444444444444453,0.9944258639910813,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2}"
+55,NeuralPLexer,H1171v1,16.84375,0.6653428093645486,"{'UNL:ALA:Hydrophobic': 11, 'UNL:ARG:HBDonor': 22, 'UNL:ARG:Hydrophobic': 33, 'UNL:ARG:VdWContact': 121, 'UNL:ASN:HBAcceptor': 44, 'UNL:ASN:Hydrophobic': 22, 'UNL:ASN:VdWContact': 55, 'UNL:ASP:VdWContact': 11, 'UNL:GLU:HBDonor': 22, 'UNL:GLU:VdWContact': 22, 'UNL:GLY:VdWContact': 99, 'UNL:ILE:Hydrophobic': 33, 'UNL:ILE:VdWContact': 33, 'UNL:LEU:HBAcceptor': 11, 'UNL:LEU:HBDonor': 11, 'UNL:LEU:Hydrophobic': 11, 'UNL:LEU:VdWContact': 77, 'UNL:LYS:HBAcceptor': 22, 'UNL:LYS:Hydrophobic': 33, 'UNL:LYS:VdWContact': 55, 'UNL:MET:HBAcceptor': 11, 'UNL:MET:VdWContact': 22, 'UNL:PRO:HBDonor': 11, 'UNL:PRO:Hydrophobic': 44, 'UNL:PRO:VdWContact': 44, 'UNL:THR:HBAcceptor': 22, 'UNL:THR:VdWContact': 132, 'UNL:TYR:HBDonor': 11, 'UNL:TYR:Hydrophobic': 44, 'UNL:TYR:VdWContact': 55}","{'UNL:ARG:HBAcceptor': 110, 'UNL:ARG:VdWContact': 99, 'UNL:ASN:VdWContact': 11, 'UNL:ASP:VdWContact': 22, 'UNL:GLY:HBAcceptor': 99, 'UNL:GLY:VdWContact': 121, 'UNL:ILE:VdWContact': 55, 'UNL:LEU:VdWContact': 11, 'UNL:LYS:HBAcceptor': 44, 'UNL:LYS:VdWContact': 44, 'UNL:PRO:Hydrophobic': 44, 'UNL:PRO:VdWContact': 55, 'UNL:THR:HBAcceptor': 88, 'UNL:THR:VdWContact': 231, 'UNL:TYR:VdWContact': 11}"
+56,NeuralPLexer,H1172v1,16.758620689655167,0.6670510898396957,"{'UNL:ALA:Hydrophobic': 9, 'UNL:ALA:VdWContact': 9, 'UNL:ARG:HBDonor': 36, 'UNL:ARG:Hydrophobic': 18, 'UNL:ARG:VdWContact': 99, 'UNL:ASN:HBAcceptor': 18, 'UNL:ASN:HBDonor': 18, 'UNL:ASN:VdWContact': 54, 'UNL:GLU:HBDonor': 18, 'UNL:GLU:VdWContact': 18, 'UNL:GLY:HBAcceptor': 36, 'UNL:GLY:VdWContact': 99, 'UNL:ILE:Hydrophobic': 63, 'UNL:ILE:VdWContact': 54, 'UNL:LEU:HBAcceptor': 9, 'UNL:LEU:VdWContact': 99, 'UNL:LYS:HBAcceptor': 27, 'UNL:LYS:Hydrophobic': 18, 'UNL:LYS:VdWContact': 54, 'UNL:MET:HBAcceptor': 9, 'UNL:PRO:HBDonor': 9, 'UNL:PRO:Hydrophobic': 81, 'UNL:PRO:VdWContact': 81, 'UNL:THR:HBAcceptor': 18, 'UNL:THR:VdWContact': 81, 'UNL:TYR:Hydrophobic': 45, 'UNL:TYR:VdWContact': 27}","{'UNL:ARG:HBAcceptor': 54, 'UNL:ARG:VdWContact': 63, 'UNL:GLY:HBAcceptor': 63, 'UNL:GLY:VdWContact': 90, 'UNL:ILE:VdWContact': 54, 'UNL:LEU:VdWContact': 18, 'UNL:LYS:HBAcceptor': 36, 'UNL:LYS:VdWContact': 36, 'UNL:PRO:Hydrophobic': 18, 'UNL:PRO:VdWContact': 45, 'UNL:THR:HBAcceptor': 72, 'UNL:THR:VdWContact': 144, 'UNL:TYR:HBAcceptor': 9, 'UNL:TYR:VdWContact': 9}"
+57,NeuralPLexer,T1158v4,4.190476190476191,0.9192546583850931,"{'UNL:ASP:HBDonor': 4, 'UNL:ASP:Hydrophobic': 4, 'UNL:ASP:VdWContact': 4, 'UNL:GLY:HBAcceptor': 12, 'UNL:GLY:VdWContact': 16, 'UNL:LYS:HBAcceptor': 4, 'UNL:LYS:VdWContact': 8, 'UNL:SER:HBAcceptor': 8, 'UNL:SER:VdWContact': 16, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 4, 'UNL:TYR:HBAcceptor': 4, 'UNL:TYR:Hydrophobic': 4, 'UNL:TYR:VdWContact': 4, 'UNL:VAL:VdWContact': 8}","{'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBAcceptor': 4, 'UNL:ASN:VdWContact': 8, 'UNL:ASP:VdWContact': 4, 'UNL:GLN:HBAcceptor': 12, 'UNL:GLN:VdWContact': 24, 'UNL:GLY:HBAcceptor': 24, 'UNL:GLY:VdWContact': 28, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:HBAcceptor': 8, 'UNL:LYS:VdWContact': 8, 'UNL:SER:HBAcceptor': 16, 'UNL:SER:VdWContact': 32}"
+58,NeuralPLexer,H1172v4,10.741935483870968,0.7877872478152983,"{'UNL:ALA:Hydrophobic': 9, 'UNL:ALA:VdWContact': 9, 'UNL:ARG:HBDonor': 27, 'UNL:ARG:Hydrophobic': 18, 'UNL:ARG:VdWContact': 126, 'UNL:ASN:HBAcceptor': 27, 'UNL:ASN:HBDonor': 9, 'UNL:ASN:VdWContact': 27, 'UNL:ASP:VdWContact': 9, 'UNL:GLU:HBDonor': 27, 'UNL:GLU:VdWContact': 27, 'UNL:GLY:HBAcceptor': 9, 'UNL:GLY:VdWContact': 90, 'UNL:ILE:Hydrophobic': 27, 'UNL:ILE:VdWContact': 9, 'UNL:LEU:HBAcceptor': 9, 'UNL:LEU:HBDonor': 9, 'UNL:LEU:Hydrophobic': 9, 'UNL:LEU:VdWContact': 81, 'UNL:LYS:HBAcceptor': 36, 'UNL:LYS:HBDonor': 9, 'UNL:LYS:Hydrophobic': 18, 'UNL:LYS:VdWContact': 45, 'UNL:PRO:HBDonor': 18, 'UNL:PRO:Hydrophobic': 54, 'UNL:PRO:VdWContact': 90, 'UNL:THR:HBAcceptor': 18, 'UNL:THR:VdWContact': 90, 'UNL:TYR:Hydrophobic': 45, 'UNL:TYR:VdWContact': 27}","{'UNL:ARG:HBAcceptor': 63, 'UNL:ARG:VdWContact': 63, 'UNL:GLY:HBAcceptor': 99, 'UNL:GLY:VdWContact': 81, 'UNL:ILE:VdWContact': 45, 'UNL:LEU:HBAcceptor': 9, 'UNL:LEU:VdWContact': 27, 'UNL:LYS:HBAcceptor': 45, 'UNL:LYS:VdWContact': 45, 'UNL:PRO:Hydrophobic': 27, 'UNL:PRO:VdWContact': 36, 'UNL:THR:HBAcceptor': 72, 'UNL:THR:VdWContact': 135, 'UNL:TYR:VdWContact': 18}"
+59,NeuralPLexer,T1146,0.36363636363636365,0.9960474308300395,"{'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1}"
+60,NeuralPLexer,H1172v2,14.0625,0.7211538461538461,"{'UNL:ALA:Hydrophobic': 9, 'UNL:ALA:VdWContact': 9, 'UNL:ARG:HBDonor': 27, 'UNL:ARG:Hydrophobic': 27, 'UNL:ARG:VdWContact': 90, 'UNL:ASN:HBAcceptor': 54, 'UNL:ASN:HBDonor': 27, 'UNL:ASN:VdWContact': 63, 'UNL:ASP:VdWContact': 9, 'UNL:GLU:HBDonor': 27, 'UNL:GLU:VdWContact': 27, 'UNL:GLY:HBAcceptor': 9, 'UNL:GLY:HBDonor': 9, 'UNL:GLY:VdWContact': 99, 'UNL:ILE:Hydrophobic': 45, 'UNL:ILE:VdWContact': 45, 'UNL:LEU:Hydrophobic': 9, 'UNL:LEU:VdWContact': 54, 'UNL:LYS:HBAcceptor': 9, 'UNL:LYS:Hydrophobic': 9, 'UNL:LYS:VdWContact': 54, 'UNL:MET:HBAcceptor': 9, 'UNL:MET:Hydrophobic': 9, 'UNL:MET:VdWContact': 18, 'UNL:PRO:HBDonor': 9, 'UNL:PRO:Hydrophobic': 63, 'UNL:PRO:VdWContact': 81, 'UNL:THR:HBAcceptor': 9, 'UNL:THR:VdWContact': 117, 'UNL:TYR:Hydrophobic': 36, 'UNL:TYR:VdWContact': 27}","{'UNL:ARG:HBAcceptor': 63, 'UNL:ARG:VdWContact': 63, 'UNL:GLY:HBAcceptor': 72, 'UNL:GLY:VdWContact': 81, 'UNL:ILE:VdWContact': 45, 'UNL:LEU:VdWContact': 9, 'UNL:LYS:HBAcceptor': 27, 'UNL:LYS:VdWContact': 45, 'UNL:PRO:Hydrophobic': 18, 'UNL:PRO:VdWContact': 27, 'UNL:THR:HBAcceptor': 72, 'UNL:THR:VdWContact': 135, 'UNL:TYR:VdWContact': 18}"
+61,NeuralPLexer,T1186,0.5,0.9933110367892977,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 3, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 4, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+62,NeuralPLexer,T1187,1.25,0.9782608695652174,"{'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 10, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:MET:VdWContact': 2, 'UNL:SER:HBDonor': 2, 'UNL:SER:VdWContact': 4, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 4, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 4, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 4, 'UNL:ALA:VdWContact': 4, 'UNL:ASP:VdWContact': 4, 'UNL:LYS:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:HBAcceptor': 8, 'UNL:TRP:VdWContact': 8, 'UNL:VAL:VdWContact': 2}"
+63,NeuralPLexer,T1127v2,1.71875,0.9688545150501672,"{'UNL:ALA:VdWContact': 5, 'UNL:ARG:HBAcceptor': 20, 'UNL:ARG:HBDonor': 5, 'UNL:ARG:Hydrophobic': 10, 'UNL:ARG:VdWContact': 25, 'UNL:ASN:HBDonor': 5, 'UNL:ASN:Hydrophobic': 10, 'UNL:ASN:VdWContact': 15, 'UNL:GLN:VdWContact': 15, 'UNL:GLU:VdWContact': 25, 'UNL:GLY:HBAcceptor': 10, 'UNL:GLY:HBDonor': 5, 'UNL:GLY:VdWContact': 20, 'UNL:ILE:VdWContact': 5, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 5, 'UNL:LYS:HBAcceptor': 10, 'UNL:LYS:HBDonor': 5, 'UNL:LYS:VdWContact': 10, 'UNL:MET:Hydrophobic': 10, 'UNL:MET:VdWContact': 10, 'UNL:PHE:Hydrophobic': 30, 'UNL:PHE:VdWContact': 40, 'UNL:TRP:Hydrophobic': 10, 'UNL:TRP:VdWContact': 10, 'UNL:TYR:VdWContact': 10, 'UNL:VAL:VdWContact': 5}","{'UNL:ALA:VdWContact': 5, 'UNL:ARG:HBAcceptor': 30, 'UNL:ARG:VdWContact': 35, 'UNL:ASN:HBAcceptor': 10, 'UNL:ASN:Hydrophobic': 10, 'UNL:ASN:VdWContact': 25, 'UNL:ASP:VdWContact': 5, 'UNL:GLN:VdWContact': 10, 'UNL:GLU:VdWContact': 20, 'UNL:GLY:HBAcceptor': 20, 'UNL:GLY:VdWContact': 20, 'UNL:ILE:HBAcceptor': 5, 'UNL:ILE:VdWContact': 5, 'UNL:LEU:VdWContact': 10, 'UNL:LYS:HBAcceptor': 10, 'UNL:LYS:VdWContact': 10, 'UNL:MET:HBAcceptor': 10, 'UNL:MET:VdWContact': 15, 'UNL:PHE:VdWContact': 20, 'UNL:TRP:VdWContact': 5, 'UNL:VAL:HBAcceptor': 5, 'UNL:VAL:VdWContact': 5}"
+64,NeuralPLexer,T1124,2.580645161290323,0.9515589599741072,"{'UNL:ALA:Hydrophobic': 4, 'UNL:ALA:VdWContact': 4, 'UNL:ASN:Hydrophobic': 8, 'UNL:ASN:VdWContact': 8, 'UNL:ASP:HBDonor': 4, 'UNL:ASP:Hydrophobic': 4, 'UNL:ASP:VdWContact': 16, 'UNL:CYS:VdWContact': 8, 'UNL:GLN:VdWContact': 4, 'UNL:GLY:VdWContact': 12, 'UNL:HIS:VdWContact': 4, 'UNL:ILE:Hydrophobic': 8, 'UNL:ILE:VdWContact': 4, 'UNL:LEU:Hydrophobic': 12, 'UNL:PHE:HBAcceptor': 4, 'UNL:PHE:Hydrophobic': 16, 'UNL:PHE:VdWContact': 24, 'UNL:PRO:Hydrophobic': 4, 'UNL:PRO:VdWContact': 4, 'UNL:TRP:Hydrophobic': 8, 'UNL:TRP:VdWContact': 16, 'UNL:TYR:HBAcceptor': 4, 'UNL:TYR:VdWContact': 24, 'UNL:VAL:Hydrophobic': 8}","{'UNL:ALA:VdWContact': 8, 'UNL:ASN:HBAcceptor': 8, 'UNL:ASN:VdWContact': 8, 'UNL:ASP:VdWContact': 16, 'UNL:GLY:VdWContact': 8, 'UNL:HIS:HBAcceptor': 4, 'UNL:HIS:VdWContact': 8, 'UNL:ILE:Hydrophobic': 8, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 8, 'UNL:LYS:VdWContact': 8, 'UNL:PHE:HBAcceptor': 8, 'UNL:PHE:Hydrophobic': 8, 'UNL:PHE:VdWContact': 8, 'UNL:SER:VdWContact': 8, 'UNL:TYR:Hydrophobic': 8, 'UNL:TYR:VdWContact': 20, 'UNL:VAL:Hydrophobic': 8, 'UNL:VAL:VdWContact': 4}"
+65,NeuralPLexer,T1158v3,0.33333333333333326,0.9966555183946488,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}"
+66,NeuralPLexer,H1172v3,11.84,0.765752508361204,"{'UNL:ARG:HBAcceptor': 8, 'UNL:ARG:HBDonor': 8, 'UNL:ARG:VdWContact': 88, 'UNL:ASN:HBAcceptor': 16, 'UNL:ASN:HBDonor': 8, 'UNL:ASN:VdWContact': 40, 'UNL:GLU:HBDonor': 16, 'UNL:GLU:VdWContact': 24, 'UNL:GLY:HBAcceptor': 24, 'UNL:GLY:VdWContact': 88, 'UNL:ILE:Hydrophobic': 48, 'UNL:ILE:VdWContact': 32, 'UNL:LEU:HBDonor': 8, 'UNL:LEU:VdWContact': 64, 'UNL:LYS:HBAcceptor': 16, 'UNL:LYS:Hydrophobic': 8, 'UNL:LYS:VdWContact': 32, 'UNL:PRO:HBDonor': 16, 'UNL:PRO:Hydrophobic': 64, 'UNL:PRO:VdWContact': 80, 'UNL:THR:HBAcceptor': 24, 'UNL:THR:HBDonor': 8, 'UNL:THR:VdWContact': 72, 'UNL:TYR:Hydrophobic': 48, 'UNL:TYR:VdWContact': 40}","{'UNL:ARG:HBAcceptor': 56, 'UNL:ARG:VdWContact': 64, 'UNL:GLY:HBAcceptor': 64, 'UNL:GLY:VdWContact': 72, 'UNL:ILE:VdWContact': 32, 'UNL:LEU:VdWContact': 24, 'UNL:LYS:HBAcceptor': 40, 'UNL:LYS:VdWContact': 48, 'UNL:PRO:Hydrophobic': 16, 'UNL:PRO:VdWContact': 24, 'UNL:THR:HBAcceptor': 56, 'UNL:THR:VdWContact': 88}"
+67,NeuralPLexer,H1135,43.71428571428571,0.12613473483038717,"{'UNL:ARG:VdWContact': 12, 'UNL:ASN:VdWContact': 60, 'UNL:ASP:VdWContact': 60, 'UNL:GLN:VdWContact': 24, 'UNL:GLU:VdWContact': 24, 'UNL:GLY:VdWContact': 36, 'UNL:HIS:VdWContact': 12, 'UNL:ILE:VdWContact': 12, 'UNL:LEU:VdWContact': 48, 'UNL:PRO:VdWContact': 60, 'UNL:SER:VdWContact': 72, 'UNL:TRP:VdWContact': 12, 'UNL:TYR:VdWContact': 48, 'UNL:VAL:VdWContact': 12}","{'UNL:ARG:VdWContact': 72, 'UNL:ASN:VdWContact': 144, 'UNL:ASP:VdWContact': 144, 'UNL:GLN:VdWContact': 144, 'UNL:ILE:VdWContact': 108, 'UNL:SER:VdWContact': 36, 'UNL:TYR:VdWContact': 144, 'UNL:VAL:VdWContact': 144}"
+68,RFAA,H1171v2,,0.0,,
+69,RFAA,T1158v2,0.5,0.9933110367892977,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1}"
+70,RFAA,T1152,1366.52,0.0,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 2}","{'UNL:ALA:VdWContact': 384, 'UNL:ASN:HBAcceptor': 1152, 'UNL:ASN:VdWContact': 3584, 'UNL:ASP:VdWContact': 1536, 'UNL:GLN:HBAcceptor': 896, 'UNL:GLN:VdWContact': 2560, 'UNL:GLU:HBAcceptor': 128, 'UNL:GLU:VdWContact': 896, 'UNL:GLY:HBAcceptor': 640, 'UNL:GLY:VdWContact': 1920, 'UNL:ILE:HBAcceptor': 512, 'UNL:ILE:VdWContact': 3072, 'UNL:LEU:VdWContact': 1280, 'UNL:LYS:HBAcceptor': 512, 'UNL:LYS:VdWContact': 4224, 'UNL:MET:VdWContact': 1280, 'UNL:PRO:VdWContact': 2432, 'UNL:SER:HBAcceptor': 128, 'UNL:SER:VdWContact': 512, 'UNL:THR:HBAcceptor': 768, 'UNL:THR:VdWContact': 2048, 'UNL:TRP:HBAcceptor': 512, 'UNL:TRP:VdWContact': 768, 'UNL:TYR:VdWContact': 1024, 'UNL:VAL:VdWContact': 1408}"
+71,RFAA,T1158v1,,0.0,,
+72,RFAA,H1171v1,,0.0,,
+73,RFAA,H1172v1,,0.0,,
+74,RFAA,T1158v4,,0.0,,
+75,RFAA,H1172v4,,0.0,,
+76,RFAA,T1146,0.5833333333333333,0.9916387959866221,"{'UNL:ALA:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1}"
+77,RFAA,H1172v2,,0.0,,
+78,RFAA,T1186,,0.0,,
+79,RFAA,T1187,1.3333333333333333,0.9765886287625418,"{'UNL:ALA:VdWContact': 2, 'UNL:ASP:VdWContact': 6, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 4, 'UNL:TRP:HBAcceptor': 2, 'UNL:TRP:HBDonor': 2, 'UNL:TRP:Hydrophobic': 6, 'UNL:TRP:VdWContact': 10, 'UNL:TYR:Hydrophobic': 4, 'UNL:TYR:VdWContact': 4, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 4, 'UNL:ALA:VdWContact': 4, 'UNL:ASP:VdWContact': 4, 'UNL:LYS:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:HBAcceptor': 8, 'UNL:TRP:VdWContact': 8, 'UNL:VAL:VdWContact': 2}"
+80,RFAA,T1127v2,2.1794871794871793,0.9596089529199897,"{'UNL:ALA:HBAcceptor': 5, 'UNL:ALA:HBDonor': 5, 'UNL:ALA:VdWContact': 10, 'UNL:ARG:HBDonor': 5, 'UNL:ARG:VdWContact': 20, 'UNL:ASN:VdWContact': 15, 'UNL:CYS:VdWContact': 5, 'UNL:GLN:VdWContact': 10, 'UNL:GLU:HBDonor': 10, 'UNL:GLU:VdWContact': 30, 'UNL:GLY:VdWContact': 5, 'UNL:HIS:VdWContact': 5, 'UNL:ILE:HBAcceptor': 5, 'UNL:ILE:HBDonor': 5, 'UNL:ILE:Hydrophobic': 5, 'UNL:ILE:VdWContact': 20, 'UNL:LEU:Hydrophobic': 10, 'UNL:LEU:VdWContact': 20, 'UNL:MET:HBAcceptor': 10, 'UNL:MET:VdWContact': 10, 'UNL:PHE:HBDonor': 5, 'UNL:PHE:Hydrophobic': 5, 'UNL:PHE:VdWContact': 25, 'UNL:THR:HBDonor': 5, 'UNL:THR:VdWContact': 5, 'UNL:TRP:Hydrophobic': 10, 'UNL:TRP:VdWContact': 15, 'UNL:TYR:HBDonor': 5, 'UNL:TYR:Hydrophobic': 15, 'UNL:TYR:VdWContact': 15, 'UNL:VAL:VdWContact': 10}","{'UNL:ALA:VdWContact': 5, 'UNL:ARG:HBAcceptor': 30, 'UNL:ARG:VdWContact': 35, 'UNL:ASN:HBAcceptor': 10, 'UNL:ASN:Hydrophobic': 10, 'UNL:ASN:VdWContact': 25, 'UNL:ASP:VdWContact': 5, 'UNL:GLN:VdWContact': 10, 'UNL:GLU:VdWContact': 20, 'UNL:GLY:HBAcceptor': 20, 'UNL:GLY:VdWContact': 20, 'UNL:ILE:HBAcceptor': 5, 'UNL:ILE:VdWContact': 5, 'UNL:LEU:VdWContact': 10, 'UNL:LYS:HBAcceptor': 10, 'UNL:LYS:VdWContact': 10, 'UNL:MET:HBAcceptor': 10, 'UNL:MET:VdWContact': 15, 'UNL:PHE:VdWContact': 20, 'UNL:TRP:VdWContact': 5, 'UNL:VAL:HBAcceptor': 5, 'UNL:VAL:VdWContact': 5}"
+81,RFAA,T1124,,0.0,,
+82,RFAA,T1158v3,,0.0,,
+83,RFAA,H1172v3,,0.0,,
+84,RFAA,H1135,,0.0,,
+85,Chai-1-Single-Seq,H1171v2,,0.0,,
+86,Chai-1-Single-Seq,T1158v2,,0.0,,
+87,Chai-1-Single-Seq,T1152,1101.4516129032259,0.0,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 5, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 384, 'UNL:ASN:HBAcceptor': 1152, 'UNL:ASN:VdWContact': 3584, 'UNL:ASP:VdWContact': 1536, 'UNL:GLN:HBAcceptor': 896, 'UNL:GLN:VdWContact': 2560, 'UNL:GLU:HBAcceptor': 128, 'UNL:GLU:VdWContact': 896, 'UNL:GLY:HBAcceptor': 640, 'UNL:GLY:VdWContact': 1920, 'UNL:ILE:HBAcceptor': 512, 'UNL:ILE:VdWContact': 3072, 'UNL:LEU:VdWContact': 1280, 'UNL:LYS:HBAcceptor': 512, 'UNL:LYS:VdWContact': 4224, 'UNL:MET:VdWContact': 1280, 'UNL:PRO:VdWContact': 2432, 'UNL:SER:HBAcceptor': 128, 'UNL:SER:VdWContact': 512, 'UNL:THR:HBAcceptor': 768, 'UNL:THR:VdWContact': 2048, 'UNL:TRP:HBAcceptor': 512, 'UNL:TRP:VdWContact': 768, 'UNL:TYR:VdWContact': 1024, 'UNL:VAL:VdWContact': 1408}"
+88,Chai-1-Single-Seq,T1158v1,,0.0,,
+89,Chai-1-Single-Seq,H1171v1,,0.0,,
+90,Chai-1-Single-Seq,H1172v1,,0.0,,
+91,Chai-1-Single-Seq,T1158v4,3.259259259259259,0.9379412857673727,"{'UNL:ALA:HBDonor': 4, 'UNL:ALA:VdWContact': 4, 'UNL:ASN:HBDonor': 4, 'UNL:ASN:VdWContact': 4, 'UNL:ASP:HBDonor': 4, 'UNL:ASP:VdWContact': 12, 'UNL:GLN:HBAcceptor': 12, 'UNL:GLN:HBDonor': 4, 'UNL:GLN:VdWContact': 12, 'UNL:GLY:HBAcceptor': 24, 'UNL:GLY:HBDonor': 4, 'UNL:GLY:VdWContact': 24, 'UNL:HIS:HBDonor': 4, 'UNL:HIS:VdWContact': 4, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:HBAcceptor': 8, 'UNL:LYS:VdWContact': 8, 'UNL:PHE:VdWContact': 4, 'UNL:SER:HBAcceptor': 16, 'UNL:SER:HBDonor': 4, 'UNL:SER:VdWContact': 28, 'UNL:THR:VdWContact': 12, 'UNL:TRP:VdWContact': 4, 'UNL:TYR:VdWContact': 4, 'UNL:VAL:VdWContact': 12}","{'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBAcceptor': 4, 'UNL:ASN:VdWContact': 8, 'UNL:ASP:VdWContact': 4, 'UNL:GLN:HBAcceptor': 12, 'UNL:GLN:VdWContact': 24, 'UNL:GLY:HBAcceptor': 24, 'UNL:GLY:VdWContact': 28, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:HBAcceptor': 8, 'UNL:LYS:VdWContact': 8, 'UNL:SER:HBAcceptor': 16, 'UNL:SER:VdWContact': 32}"
+92,Chai-1-Single-Seq,H1172v4,,0.0,,
+93,Chai-1-Single-Seq,T1146,0.9375,0.9845317725752508,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1}"
+94,Chai-1-Single-Seq,H1172v2,,0.0,,
+95,Chai-1-Single-Seq,T1186,0.689655172413793,0.9895052473763118,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 3, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 4, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+96,Chai-1-Single-Seq,T1187,1.391304347826087,0.9754253308128544,"{'UNL:ALA:VdWContact': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 4, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:PHE:HBAcceptor': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 4, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 4, 'UNL:ALA:VdWContact': 4, 'UNL:ASP:VdWContact': 4, 'UNL:LYS:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:HBAcceptor': 8, 'UNL:TRP:VdWContact': 8, 'UNL:VAL:VdWContact': 2}"
+97,Chai-1-Single-Seq,T1127v2,3.5555555555555554,0.9319955406911928,"{'UNL:ALA:HBAcceptor': 5, 'UNL:ALA:Hydrophobic': 10, 'UNL:ALA:VdWContact': 20, 'UNL:ARG:HBAcceptor': 5, 'UNL:ARG:VdWContact': 10, 'UNL:ASN:HBAcceptor': 5, 'UNL:ASN:Hydrophobic': 5, 'UNL:ASN:VdWContact': 5, 'UNL:ASP:VdWContact': 5, 'UNL:GLN:HBAcceptor': 5, 'UNL:GLN:HBDonor': 5, 'UNL:GLN:Hydrophobic': 5, 'UNL:GLN:VdWContact': 15, 'UNL:GLU:VdWContact': 5, 'UNL:GLY:HBAcceptor': 5, 'UNL:GLY:VdWContact': 10, 'UNL:ILE:HBDonor': 5, 'UNL:ILE:Hydrophobic': 5, 'UNL:ILE:VdWContact': 15, 'UNL:LEU:HBAcceptor': 5, 'UNL:LEU:HBDonor': 5, 'UNL:LEU:Hydrophobic': 25, 'UNL:LEU:VdWContact': 40, 'UNL:LYS:HBDonor': 5, 'UNL:LYS:VdWContact': 5, 'UNL:MET:Hydrophobic': 5, 'UNL:PHE:HBAcceptor': 5, 'UNL:PHE:Hydrophobic': 35, 'UNL:PHE:VdWContact': 50, 'UNL:PRO:Hydrophobic': 5, 'UNL:PRO:VdWContact': 15, 'UNL:SER:VdWContact': 15, 'UNL:THR:HBDonor': 10, 'UNL:THR:Hydrophobic': 5, 'UNL:THR:VdWContact': 15, 'UNL:TYR:Hydrophobic': 5, 'UNL:TYR:VdWContact': 10, 'UNL:VAL:Hydrophobic': 20, 'UNL:VAL:VdWContact': 25}","{'UNL:ALA:VdWContact': 5, 'UNL:ARG:HBAcceptor': 30, 'UNL:ARG:VdWContact': 35, 'UNL:ASN:HBAcceptor': 10, 'UNL:ASN:Hydrophobic': 10, 'UNL:ASN:VdWContact': 25, 'UNL:ASP:VdWContact': 5, 'UNL:GLN:VdWContact': 10, 'UNL:GLU:VdWContact': 20, 'UNL:GLY:HBAcceptor': 20, 'UNL:GLY:VdWContact': 20, 'UNL:ILE:HBAcceptor': 5, 'UNL:ILE:VdWContact': 5, 'UNL:LEU:VdWContact': 10, 'UNL:LYS:HBAcceptor': 10, 'UNL:LYS:VdWContact': 10, 'UNL:MET:HBAcceptor': 10, 'UNL:MET:VdWContact': 15, 'UNL:PHE:VdWContact': 20, 'UNL:TRP:VdWContact': 5, 'UNL:VAL:HBAcceptor': 5, 'UNL:VAL:VdWContact': 5}"
+98,Chai-1-Single-Seq,T1124,3.172413793103448,0.9396840041517702,"{'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 4, 'UNL:GLN:VdWContact': 4, 'UNL:HIS:VdWContact': 4, 'UNL:ILE:HBAcceptor': 4, 'UNL:ILE:VdWContact': 4, 'UNL:LEU:VdWContact': 4, 'UNL:PRO:Hydrophobic': 4, 'UNL:PRO:VdWContact': 4, 'UNL:SER:VdWContact': 4, 'UNL:THR:HBDonor': 8, 'UNL:THR:Hydrophobic': 4, 'UNL:THR:VdWContact': 12, 'UNL:TYR:HBDonor': 4, 'UNL:TYR:VdWContact': 4}","{'UNL:ALA:VdWContact': 8, 'UNL:ASN:HBAcceptor': 8, 'UNL:ASN:VdWContact': 8, 'UNL:ASP:VdWContact': 16, 'UNL:GLY:VdWContact': 8, 'UNL:HIS:HBAcceptor': 4, 'UNL:HIS:VdWContact': 8, 'UNL:ILE:Hydrophobic': 8, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 8, 'UNL:LYS:VdWContact': 8, 'UNL:PHE:HBAcceptor': 8, 'UNL:PHE:Hydrophobic': 8, 'UNL:PHE:VdWContact': 8, 'UNL:SER:VdWContact': 8, 'UNL:TYR:Hydrophobic': 8, 'UNL:TYR:VdWContact': 20, 'UNL:VAL:Hydrophobic': 8, 'UNL:VAL:VdWContact': 4}"
+99,Chai-1-Single-Seq,T1158v3,0.8461538461538461,0.9863648057627991,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}"
+100,Chai-1-Single-Seq,H1172v3,,0.0,,
+101,Chai-1-Single-Seq,H1135,29.333333333333336,0.4147157190635452,"{'UNL:ARG:VdWContact': 108, 'UNL:ASN:VdWContact': 108, 'UNL:ASP:VdWContact': 108, 'UNL:GLN:VdWContact': 108, 'UNL:ILE:VdWContact': 108, 'UNL:PRO:VdWContact': 12, 'UNL:SER:VdWContact': 12, 'UNL:TYR:VdWContact': 108, 'UNL:VAL:VdWContact': 192}","{'UNL:ARG:VdWContact': 72, 'UNL:ASN:VdWContact': 144, 'UNL:ASP:VdWContact': 144, 'UNL:GLN:VdWContact': 144, 'UNL:ILE:VdWContact': 108, 'UNL:SER:VdWContact': 36, 'UNL:TYR:VdWContact': 144, 'UNL:VAL:VdWContact': 144}"
+102,Chai-1,H1171v2,,0.0,,
+103,Chai-1,T1158v2,,0.0,,
+104,Chai-1,T1152,1101.9032258064517,0.0,"{'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:VdWContact': 384, 'UNL:ASN:HBAcceptor': 1152, 'UNL:ASN:VdWContact': 3584, 'UNL:ASP:VdWContact': 1536, 'UNL:GLN:HBAcceptor': 896, 'UNL:GLN:VdWContact': 2560, 'UNL:GLU:HBAcceptor': 128, 'UNL:GLU:VdWContact': 896, 'UNL:GLY:HBAcceptor': 640, 'UNL:GLY:VdWContact': 1920, 'UNL:ILE:HBAcceptor': 512, 'UNL:ILE:VdWContact': 3072, 'UNL:LEU:VdWContact': 1280, 'UNL:LYS:HBAcceptor': 512, 'UNL:LYS:VdWContact': 4224, 'UNL:MET:VdWContact': 1280, 'UNL:PRO:VdWContact': 2432, 'UNL:SER:HBAcceptor': 128, 'UNL:SER:VdWContact': 512, 'UNL:THR:HBAcceptor': 768, 'UNL:THR:VdWContact': 2048, 'UNL:TRP:HBAcceptor': 512, 'UNL:TRP:VdWContact': 768, 'UNL:TYR:VdWContact': 1024, 'UNL:VAL:VdWContact': 1408}"
+105,Chai-1,T1158v1,0.4666666666666667,0.9939799331103679,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2}"
+106,Chai-1,H1171v1,,0.0,,
+107,Chai-1,H1172v1,,0.0,,
+108,Chai-1,T1158v4,1.9999999999999998,0.9632107023411371,"{'UNL:ASN:HBDonor': 4, 'UNL:ASN:VdWContact': 4, 'UNL:GLN:HBAcceptor': 8, 'UNL:GLN:VdWContact': 16, 'UNL:GLY:HBAcceptor': 24, 'UNL:GLY:HBDonor': 12, 'UNL:GLY:VdWContact': 32, 'UNL:HIS:HBAcceptor': 4, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:HBAcceptor': 8, 'UNL:LYS:HBDonor': 4, 'UNL:LYS:VdWContact': 8, 'UNL:PHE:VdWContact': 4, 'UNL:SER:HBAcceptor': 16, 'UNL:SER:HBDonor': 4, 'UNL:SER:VdWContact': 28, 'UNL:THR:VdWContact': 8, 'UNL:TRP:VdWContact': 4, 'UNL:TYR:VdWContact': 4, 'UNL:VAL:HBDonor': 4, 'UNL:VAL:VdWContact': 8}","{'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBAcceptor': 4, 'UNL:ASN:VdWContact': 8, 'UNL:ASP:VdWContact': 4, 'UNL:GLN:HBAcceptor': 12, 'UNL:GLN:VdWContact': 24, 'UNL:GLY:HBAcceptor': 24, 'UNL:GLY:VdWContact': 28, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:HBAcceptor': 8, 'UNL:LYS:VdWContact': 8, 'UNL:SER:HBAcceptor': 16, 'UNL:SER:VdWContact': 32}"
+109,Chai-1,H1172v4,,0.0,,
+110,Chai-1,T1146,0.6666666666666666,0.9899665551839465,"{'UNL:ALA:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1}"
+111,Chai-1,H1172v2,,0.0,,
+112,Chai-1,T1186,0.625,0.9908026755852842,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 4, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 3, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 4, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+113,Chai-1,T1187,0.7999999999999999,0.9872909698996656,"{'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 4, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:HBAcceptor': 2, 'UNL:LYS:Hydrophobic': 4, 'UNL:LYS:VdWContact': 10, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 6, 'UNL:THR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 4, 'UNL:ALA:VdWContact': 4, 'UNL:ASP:VdWContact': 4, 'UNL:LYS:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:HBAcceptor': 8, 'UNL:TRP:VdWContact': 8, 'UNL:VAL:VdWContact': 2}"
+114,Chai-1,T1127v2,1.4634146341463414,0.9739783016559262,"{'UNL:ALA:HBDonor': 5, 'UNL:ALA:Hydrophobic': 5, 'UNL:ALA:VdWContact': 5, 'UNL:ARG:HBDonor': 10, 'UNL:ARG:Hydrophobic': 10, 'UNL:ARG:VdWContact': 20, 'UNL:CYS:Hydrophobic': 5, 'UNL:CYS:VdWContact': 5, 'UNL:GLN:Hydrophobic': 5, 'UNL:GLN:VdWContact': 10, 'UNL:GLU:HBDonor': 5, 'UNL:GLU:VdWContact': 10, 'UNL:GLY:VdWContact': 10, 'UNL:HIS:HBAcceptor': 5, 'UNL:HIS:HBDonor': 5, 'UNL:HIS:Hydrophobic': 5, 'UNL:HIS:VdWContact': 5, 'UNL:ILE:VdWContact': 10, 'UNL:LEU:Hydrophobic': 15, 'UNL:LEU:VdWContact': 20, 'UNL:LYS:Hydrophobic': 5, 'UNL:LYS:VdWContact': 5, 'UNL:PHE:HBAcceptor': 5, 'UNL:PHE:Hydrophobic': 15, 'UNL:PHE:VdWContact': 25, 'UNL:THR:VdWContact': 15, 'UNL:TRP:Hydrophobic': 5, 'UNL:TRP:VdWContact': 10, 'UNL:VAL:Hydrophobic': 20, 'UNL:VAL:VdWContact': 35}","{'UNL:ALA:VdWContact': 5, 'UNL:ARG:HBAcceptor': 30, 'UNL:ARG:VdWContact': 35, 'UNL:ASN:HBAcceptor': 10, 'UNL:ASN:Hydrophobic': 10, 'UNL:ASN:VdWContact': 25, 'UNL:ASP:VdWContact': 5, 'UNL:GLN:VdWContact': 10, 'UNL:GLU:VdWContact': 20, 'UNL:GLY:HBAcceptor': 20, 'UNL:GLY:VdWContact': 20, 'UNL:ILE:HBAcceptor': 5, 'UNL:ILE:VdWContact': 5, 'UNL:LEU:VdWContact': 10, 'UNL:LYS:HBAcceptor': 10, 'UNL:LYS:VdWContact': 10, 'UNL:MET:HBAcceptor': 10, 'UNL:MET:VdWContact': 15, 'UNL:PHE:VdWContact': 20, 'UNL:TRP:VdWContact': 5, 'UNL:VAL:HBAcceptor': 5, 'UNL:VAL:VdWContact': 5}"
+115,Chai-1,T1124,,0.0,,
+116,Chai-1,T1158v3,0.8095238095238095,0.987099856665074,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}"
+117,Chai-1,H1172v3,,0.0,,
+118,Chai-1,H1135,37.26315789473684,0.2555888047878895,"{'UNL:ALA:VdWContact': 36, 'UNL:ARG:VdWContact': 60, 'UNL:ASN:VdWContact': 24, 'UNL:ASP:VdWContact': 48, 'UNL:CYS:VdWContact': 12, 'UNL:GLU:VdWContact': 24, 'UNL:GLY:VdWContact': 48, 'UNL:HIS:VdWContact': 12, 'UNL:ILE:VdWContact': 60, 'UNL:LEU:VdWContact': 48, 'UNL:LYS:VdWContact': 12, 'UNL:PHE:VdWContact': 24, 'UNL:PRO:VdWContact': 108, 'UNL:SER:VdWContact': 72, 'UNL:THR:VdWContact': 48, 'UNL:TRP:VdWContact': 12, 'UNL:TYR:VdWContact': 36, 'UNL:VAL:VdWContact': 48}","{'UNL:ARG:VdWContact': 72, 'UNL:ASN:VdWContact': 144, 'UNL:ASP:VdWContact': 144, 'UNL:GLN:VdWContact': 144, 'UNL:ILE:VdWContact': 108, 'UNL:SER:VdWContact': 36, 'UNL:TYR:VdWContact': 144, 'UNL:VAL:VdWContact': 144}"
+119,Boltz-1-Single-Seq,H1171v2,,0.0,,
+120,Boltz-1-Single-Seq,T1158v2,0.75,0.9882943143812709,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1}"
+121,Boltz-1-Single-Seq,T1152,1138.8333333333333,0.0,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 384, 'UNL:ASN:HBAcceptor': 1152, 'UNL:ASN:VdWContact': 3584, 'UNL:ASP:VdWContact': 1536, 'UNL:GLN:HBAcceptor': 896, 'UNL:GLN:VdWContact': 2560, 'UNL:GLU:HBAcceptor': 128, 'UNL:GLU:VdWContact': 896, 'UNL:GLY:HBAcceptor': 640, 'UNL:GLY:VdWContact': 1920, 'UNL:ILE:HBAcceptor': 512, 'UNL:ILE:VdWContact': 3072, 'UNL:LEU:VdWContact': 1280, 'UNL:LYS:HBAcceptor': 512, 'UNL:LYS:VdWContact': 4224, 'UNL:MET:VdWContact': 1280, 'UNL:PRO:VdWContact': 2432, 'UNL:SER:HBAcceptor': 128, 'UNL:SER:VdWContact': 512, 'UNL:THR:HBAcceptor': 768, 'UNL:THR:VdWContact': 2048, 'UNL:TRP:HBAcceptor': 512, 'UNL:TRP:VdWContact': 768, 'UNL:TYR:VdWContact': 1024, 'UNL:VAL:VdWContact': 1408}"
+122,Boltz-1-Single-Seq,T1158v1,0.6111111111111113,0.9910813823857302,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2}"
+123,Boltz-1-Single-Seq,H1171v1,,0.0,,
+124,Boltz-1-Single-Seq,H1172v1,,0.0,,
+125,Boltz-1-Single-Seq,T1158v4,3.384615384615385,0.9354257782351427,"{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBDonor': 4, 'UNL:ASN:VdWContact': 4, 'UNL:ASP:HBDonor': 4, 'UNL:ASP:VdWContact': 4, 'UNL:GLN:HBAcceptor': 12, 'UNL:GLN:VdWContact': 8, 'UNL:GLY:HBAcceptor': 28, 'UNL:GLY:HBDonor': 12, 'UNL:GLY:VdWContact': 28, 'UNL:LYS:HBAcceptor': 8, 'UNL:LYS:HBDonor': 8, 'UNL:LYS:VdWContact': 8, 'UNL:SER:HBAcceptor': 16, 'UNL:SER:HBDonor': 12, 'UNL:SER:VdWContact': 28, 'UNL:THR:HBAcceptor': 4, 'UNL:THR:HBDonor': 4, 'UNL:THR:VdWContact': 12, 'UNL:TRP:VdWContact': 4, 'UNL:TYR:VdWContact': 4, 'UNL:VAL:HBDonor': 4, 'UNL:VAL:VdWContact': 8}","{'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBAcceptor': 4, 'UNL:ASN:VdWContact': 8, 'UNL:ASP:VdWContact': 4, 'UNL:GLN:HBAcceptor': 12, 'UNL:GLN:VdWContact': 24, 'UNL:GLY:HBAcceptor': 24, 'UNL:GLY:VdWContact': 28, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:HBAcceptor': 8, 'UNL:LYS:VdWContact': 8, 'UNL:SER:HBAcceptor': 16, 'UNL:SER:VdWContact': 32}"
+126,Boltz-1-Single-Seq,H1172v4,,0.0,,
+127,Boltz-1-Single-Seq,T1146,0.625,0.9908026755852842,"{'UNL:GLN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1}"
+128,Boltz-1-Single-Seq,H1172v2,,0.0,,
+129,Boltz-1-Single-Seq,T1186,0.5714285714285713,0.9918776875298615,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 3, 'UNL:SER:HBDonor': 3, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 3, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 4, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+130,Boltz-1-Single-Seq,T1187,2.0,0.9632107023411371,"{'UNL:ALA:HBAcceptor': 4, 'UNL:ALA:VdWContact': 4, 'UNL:LYS:VdWContact': 4, 'UNL:THR:VdWContact': 4, 'UNL:TRP:HBAcceptor': 8, 'UNL:TRP:HBDonor': 4, 'UNL:TRP:Hydrophobic': 6, 'UNL:TRP:VdWContact': 12, 'UNL:TYR:Hydrophobic': 4, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 4}","{'UNL:ALA:HBAcceptor': 4, 'UNL:ALA:VdWContact': 4, 'UNL:ASP:VdWContact': 4, 'UNL:LYS:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:HBAcceptor': 8, 'UNL:TRP:VdWContact': 8, 'UNL:VAL:VdWContact': 2}"
+131,Boltz-1-Single-Seq,T1127v2,4.444444444444446,0.9141583054626532,"{'UNL:ALA:Hydrophobic': 10, 'UNL:ARG:HBAcceptor': 20, 'UNL:ARG:HBDonor': 15, 'UNL:ARG:VdWContact': 30, 'UNL:ASN:HBAcceptor': 10, 'UNL:ASN:HBDonor': 15, 'UNL:ASN:VdWContact': 20, 'UNL:ASP:VdWContact': 10, 'UNL:GLN:VdWContact': 10, 'UNL:GLU:HBDonor': 10, 'UNL:GLU:VdWContact': 20, 'UNL:GLY:HBAcceptor': 20, 'UNL:GLY:VdWContact': 20, 'UNL:ILE:Hydrophobic': 20, 'UNL:ILE:VdWContact': 25, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 5, 'UNL:LYS:HBAcceptor': 10, 'UNL:LYS:VdWContact': 10, 'UNL:MET:HBAcceptor': 10, 'UNL:MET:HBDonor': 5, 'UNL:MET:Hydrophobic': 10, 'UNL:MET:VdWContact': 10, 'UNL:PHE:HBAcceptor': 10, 'UNL:PHE:Hydrophobic': 40, 'UNL:PHE:VdWContact': 35, 'UNL:PRO:VdWContact': 5, 'UNL:TRP:Hydrophobic': 5, 'UNL:TRP:VdWContact': 10, 'UNL:TYR:VdWContact': 10, 'UNL:VAL:Hydrophobic': 5, 'UNL:VAL:VdWContact': 10}","{'UNL:ALA:VdWContact': 5, 'UNL:ARG:HBAcceptor': 30, 'UNL:ARG:VdWContact': 35, 'UNL:ASN:HBAcceptor': 10, 'UNL:ASN:Hydrophobic': 10, 'UNL:ASN:VdWContact': 25, 'UNL:ASP:VdWContact': 5, 'UNL:GLN:VdWContact': 10, 'UNL:GLU:VdWContact': 20, 'UNL:GLY:HBAcceptor': 20, 'UNL:GLY:VdWContact': 20, 'UNL:ILE:HBAcceptor': 5, 'UNL:ILE:VdWContact': 5, 'UNL:LEU:VdWContact': 10, 'UNL:LYS:HBAcceptor': 10, 'UNL:LYS:VdWContact': 10, 'UNL:MET:HBAcceptor': 10, 'UNL:MET:VdWContact': 15, 'UNL:PHE:VdWContact': 20, 'UNL:TRP:VdWContact': 5, 'UNL:VAL:HBAcceptor': 5, 'UNL:VAL:VdWContact': 5}"
+132,Boltz-1-Single-Seq,T1124,0.96551724137931,0.9839695536846961,"{'UNL:ASN:VdWContact': 8, 'UNL:CYS:VdWContact': 8, 'UNL:GLN:HBAcceptor': 12, 'UNL:GLN:HBDonor': 8, 'UNL:GLN:VdWContact': 12, 'UNL:GLU:HBDonor': 4, 'UNL:GLU:VdWContact': 8, 'UNL:HIS:HBAcceptor': 4, 'UNL:HIS:VdWContact': 8, 'UNL:ILE:Hydrophobic': 8, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 24, 'UNL:MET:Hydrophobic': 8, 'UNL:MET:VdWContact': 8, 'UNL:PHE:Hydrophobic': 12, 'UNL:PHE:VdWContact': 12, 'UNL:TRP:Hydrophobic': 8, 'UNL:TRP:VdWContact': 8, 'UNL:TYR:Hydrophobic': 8, 'UNL:TYR:VdWContact': 16}","{'UNL:ALA:VdWContact': 8, 'UNL:ASN:HBAcceptor': 8, 'UNL:ASN:VdWContact': 8, 'UNL:ASP:VdWContact': 16, 'UNL:GLY:VdWContact': 8, 'UNL:HIS:HBAcceptor': 4, 'UNL:HIS:VdWContact': 8, 'UNL:ILE:Hydrophobic': 8, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 8, 'UNL:LYS:VdWContact': 8, 'UNL:PHE:HBAcceptor': 8, 'UNL:PHE:Hydrophobic': 8, 'UNL:PHE:VdWContact': 8, 'UNL:SER:VdWContact': 8, 'UNL:TYR:Hydrophobic': 8, 'UNL:TYR:VdWContact': 20, 'UNL:VAL:Hydrophobic': 8, 'UNL:VAL:VdWContact': 4}"
+133,Boltz-1-Single-Seq,T1158v3,0.7857142857142857,0.9875776397515528,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}"
+134,Boltz-1-Single-Seq,H1172v3,,0.0,,
+135,Boltz-1-Single-Seq,H1135,,0.0,,
+136,Boltz-1,H1171v2,,0.0,,
+137,Boltz-1,T1158v2,0.7333333333333334,0.988628762541806,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1}"
+138,Boltz-1,T1152,1177.9655172413795,0.0,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:VdWContact': 384, 'UNL:ASN:HBAcceptor': 1152, 'UNL:ASN:VdWContact': 3584, 'UNL:ASP:VdWContact': 1536, 'UNL:GLN:HBAcceptor': 896, 'UNL:GLN:VdWContact': 2560, 'UNL:GLU:HBAcceptor': 128, 'UNL:GLU:VdWContact': 896, 'UNL:GLY:HBAcceptor': 640, 'UNL:GLY:VdWContact': 1920, 'UNL:ILE:HBAcceptor': 512, 'UNL:ILE:VdWContact': 3072, 'UNL:LEU:VdWContact': 1280, 'UNL:LYS:HBAcceptor': 512, 'UNL:LYS:VdWContact': 4224, 'UNL:MET:VdWContact': 1280, 'UNL:PRO:VdWContact': 2432, 'UNL:SER:HBAcceptor': 128, 'UNL:SER:VdWContact': 512, 'UNL:THR:HBAcceptor': 768, 'UNL:THR:VdWContact': 2048, 'UNL:TRP:HBAcceptor': 512, 'UNL:TRP:VdWContact': 768, 'UNL:TYR:VdWContact': 1024, 'UNL:VAL:VdWContact': 1408}"
+139,Boltz-1,T1158v1,0.3333333333333333,0.9966555183946488,"{'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2}"
+140,Boltz-1,H1171v1,,0.0,,
+141,Boltz-1,H1172v1,,0.0,,
+142,Boltz-1,T1158v4,2.666666666666666,0.9498327759197325,"{'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBDonor': 4, 'UNL:ASN:VdWContact': 4, 'UNL:ASP:HBDonor': 4, 'UNL:ASP:VdWContact': 4, 'UNL:GLN:HBAcceptor': 16, 'UNL:GLN:VdWContact': 12, 'UNL:GLY:HBAcceptor': 24, 'UNL:GLY:HBDonor': 4, 'UNL:GLY:VdWContact': 28, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:HBAcceptor': 8, 'UNL:LYS:HBDonor': 4, 'UNL:LYS:VdWContact': 8, 'UNL:SER:HBAcceptor': 16, 'UNL:SER:HBDonor': 12, 'UNL:SER:VdWContact': 28, 'UNL:THR:HBAcceptor': 4, 'UNL:THR:HBDonor': 4, 'UNL:THR:VdWContact': 12, 'UNL:TRP:VdWContact': 4, 'UNL:TYR:VdWContact': 4, 'UNL:VAL:VdWContact': 4}","{'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBAcceptor': 4, 'UNL:ASN:VdWContact': 8, 'UNL:ASP:VdWContact': 4, 'UNL:GLN:HBAcceptor': 12, 'UNL:GLN:VdWContact': 24, 'UNL:GLY:HBAcceptor': 24, 'UNL:GLY:VdWContact': 28, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:HBAcceptor': 8, 'UNL:LYS:VdWContact': 8, 'UNL:SER:HBAcceptor': 16, 'UNL:SER:VdWContact': 32}"
+143,Boltz-1,H1172v4,,0.0,,
+144,Boltz-1,T1146,0.6428571428571429,0.9904443382704252,"{'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1}"
+145,Boltz-1,H1172v2,,0.0,,
+146,Boltz-1,T1186,0.5714285714285713,0.9918776875298615,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 3, 'UNL:SER:HBDonor': 3, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 3, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 4, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+147,Boltz-1,T1187,1.8333333333333337,0.9665551839464883,"{'UNL:ALA:HBAcceptor': 4, 'UNL:ALA:VdWContact': 4, 'UNL:THR:VdWContact': 4, 'UNL:TRP:HBAcceptor': 8, 'UNL:TRP:HBDonor': 4, 'UNL:TRP:Hydrophobic': 8, 'UNL:TRP:VdWContact': 12, 'UNL:TYR:Hydrophobic': 4, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 4}","{'UNL:ALA:HBAcceptor': 4, 'UNL:ALA:VdWContact': 4, 'UNL:ASP:VdWContact': 4, 'UNL:LYS:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:HBAcceptor': 8, 'UNL:TRP:VdWContact': 8, 'UNL:VAL:VdWContact': 2}"
+148,Boltz-1,T1127v2,4.705882352941176,0.9089120598072005,"{'UNL:ALA:Hydrophobic': 10, 'UNL:ARG:HBAcceptor': 20, 'UNL:ARG:HBDonor': 15, 'UNL:ARG:VdWContact': 30, 'UNL:ASN:HBAcceptor': 10, 'UNL:ASN:HBDonor': 15, 'UNL:ASN:VdWContact': 20, 'UNL:ASP:VdWContact': 10, 'UNL:GLN:HBDonor': 5, 'UNL:GLN:VdWContact': 10, 'UNL:GLU:HBDonor': 5, 'UNL:GLU:VdWContact': 20, 'UNL:GLY:HBAcceptor': 20, 'UNL:GLY:VdWContact': 20, 'UNL:ILE:Hydrophobic': 20, 'UNL:ILE:VdWContact': 25, 'UNL:LEU:Hydrophobic': 10, 'UNL:LEU:VdWContact': 5, 'UNL:LYS:HBAcceptor': 10, 'UNL:LYS:VdWContact': 20, 'UNL:MET:HBAcceptor': 10, 'UNL:MET:Hydrophobic': 15, 'UNL:MET:VdWContact': 10, 'UNL:PHE:HBAcceptor': 10, 'UNL:PHE:Hydrophobic': 40, 'UNL:PHE:VdWContact': 40, 'UNL:TRP:Hydrophobic': 10, 'UNL:TRP:VdWContact': 5, 'UNL:TYR:VdWContact': 10}","{'UNL:ALA:VdWContact': 5, 'UNL:ARG:HBAcceptor': 30, 'UNL:ARG:VdWContact': 35, 'UNL:ASN:HBAcceptor': 10, 'UNL:ASN:Hydrophobic': 10, 'UNL:ASN:VdWContact': 25, 'UNL:ASP:VdWContact': 5, 'UNL:GLN:VdWContact': 10, 'UNL:GLU:VdWContact': 20, 'UNL:GLY:HBAcceptor': 20, 'UNL:GLY:VdWContact': 20, 'UNL:ILE:HBAcceptor': 5, 'UNL:ILE:VdWContact': 5, 'UNL:LEU:VdWContact': 10, 'UNL:LYS:HBAcceptor': 10, 'UNL:LYS:VdWContact': 10, 'UNL:MET:HBAcceptor': 10, 'UNL:MET:VdWContact': 15, 'UNL:PHE:VdWContact': 20, 'UNL:TRP:VdWContact': 5, 'UNL:VAL:HBAcceptor': 5, 'UNL:VAL:VdWContact': 5}"
+149,Boltz-1,T1124,1.5483870967741926,0.9722731686266048,"{'UNL:ASN:HBAcceptor': 8, 'UNL:ASN:HBDonor': 8, 'UNL:ASN:VdWContact': 16, 'UNL:CYS:Hydrophobic': 8, 'UNL:CYS:VdWContact': 8, 'UNL:GLN:HBDonor': 8, 'UNL:GLN:VdWContact': 8, 'UNL:GLU:VdWContact': 4, 'UNL:GLY:VdWContact': 8, 'UNL:HIS:VdWContact': 8, 'UNL:ILE:Hydrophobic': 8, 'UNL:ILE:VdWContact': 8, 'UNL:LEU:VdWContact': 32, 'UNL:MET:Hydrophobic': 8, 'UNL:MET:VdWContact': 8, 'UNL:PHE:Hydrophobic': 16, 'UNL:PHE:VdWContact': 12, 'UNL:TRP:Hydrophobic': 8, 'UNL:TRP:VdWContact': 8, 'UNL:TYR:HBDonor': 4, 'UNL:TYR:VdWContact': 8, 'UNL:VAL:Hydrophobic': 8}","{'UNL:ALA:VdWContact': 8, 'UNL:ASN:HBAcceptor': 8, 'UNL:ASN:VdWContact': 8, 'UNL:ASP:VdWContact': 16, 'UNL:GLY:VdWContact': 8, 'UNL:HIS:HBAcceptor': 4, 'UNL:HIS:VdWContact': 8, 'UNL:ILE:Hydrophobic': 8, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 8, 'UNL:LYS:VdWContact': 8, 'UNL:PHE:HBAcceptor': 8, 'UNL:PHE:Hydrophobic': 8, 'UNL:PHE:VdWContact': 8, 'UNL:SER:VdWContact': 8, 'UNL:TYR:Hydrophobic': 8, 'UNL:TYR:VdWContact': 20, 'UNL:VAL:Hydrophobic': 8, 'UNL:VAL:VdWContact': 4}"
+150,Boltz-1,T1158v3,0.8823529411764706,0.9856384025181979,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}"
+151,Boltz-1,H1172v3,,0.0,,
+152,Boltz-1,H1135,,0.0,,
+153,AF3-Single-Seq,H1171v2,12.374999999999998,0.7550167224080268,"{'UNL:ARG:HBAcceptor': 27, 'UNL:ARG:HBDonor': 18, 'UNL:ARG:VdWContact': 45, 'UNL:ASP:VdWContact': 27, 'UNL:GLN:HBAcceptor': 9, 'UNL:GLN:HBDonor': 18, 'UNL:GLN:VdWContact': 27, 'UNL:GLY:HBAcceptor': 90, 'UNL:GLY:HBDonor': 27, 'UNL:GLY:VdWContact': 90, 'UNL:ILE:VdWContact': 9, 'UNL:LEU:HBDonor': 18, 'UNL:LEU:VdWContact': 27, 'UNL:LYS:HBAcceptor': 45, 'UNL:LYS:HBDonor': 27, 'UNL:LYS:VdWContact': 45, 'UNL:MET:VdWContact': 9, 'UNL:PHE:VdWContact': 54, 'UNL:PRO:VdWContact': 18, 'UNL:THR:HBAcceptor': 81, 'UNL:THR:HBDonor': 18, 'UNL:THR:VdWContact': 126}","{'UNL:ARG:HBAcceptor': 72, 'UNL:ARG:VdWContact': 81, 'UNL:GLY:HBAcceptor': 72, 'UNL:GLY:VdWContact': 81, 'UNL:ILE:VdWContact': 36, 'UNL:LEU:VdWContact': 27, 'UNL:LYS:HBAcceptor': 45, 'UNL:LYS:VdWContact': 54, 'UNL:PRO:Hydrophobic': 27, 'UNL:PRO:VdWContact': 45, 'UNL:THR:HBAcceptor': 63, 'UNL:THR:Hydrophobic': 9, 'UNL:THR:VdWContact': 162}"
+154,AF3-Single-Seq,T1158v2,,0.0,,
+155,AF3-Single-Seq,T1152,1004.5882352941178,0.0,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 384, 'UNL:ASN:HBAcceptor': 1152, 'UNL:ASN:VdWContact': 3584, 'UNL:ASP:VdWContact': 1536, 'UNL:GLN:HBAcceptor': 896, 'UNL:GLN:VdWContact': 2560, 'UNL:GLU:HBAcceptor': 128, 'UNL:GLU:VdWContact': 896, 'UNL:GLY:HBAcceptor': 640, 'UNL:GLY:VdWContact': 1920, 'UNL:ILE:HBAcceptor': 512, 'UNL:ILE:VdWContact': 3072, 'UNL:LEU:VdWContact': 1280, 'UNL:LYS:HBAcceptor': 512, 'UNL:LYS:VdWContact': 4224, 'UNL:MET:VdWContact': 1280, 'UNL:PRO:VdWContact': 2432, 'UNL:SER:HBAcceptor': 128, 'UNL:SER:VdWContact': 512, 'UNL:THR:HBAcceptor': 768, 'UNL:THR:VdWContact': 2048, 'UNL:TRP:HBAcceptor': 512, 'UNL:TRP:VdWContact': 768, 'UNL:TYR:VdWContact': 1024, 'UNL:VAL:VdWContact': 1408}"
+156,AF3-Single-Seq,T1158v1,,0.0,,
+157,AF3-Single-Seq,H1171v1,11.578947368421053,0.7709910227072698,"{'UNL:ASP:VdWContact': 55, 'UNL:GLY:HBAcceptor': 132, 'UNL:GLY:HBDonor': 33, 'UNL:GLY:VdWContact': 187, 'UNL:LEU:HBDonor': 11, 'UNL:LEU:VdWContact': 11, 'UNL:LYS:HBAcceptor': 66, 'UNL:LYS:HBDonor': 44, 'UNL:LYS:VdWContact': 66, 'UNL:PRO:VdWContact': 33, 'UNL:THR:HBAcceptor': 132, 'UNL:THR:HBDonor': 55, 'UNL:THR:VdWContact': 132}","{'UNL:ARG:HBAcceptor': 110, 'UNL:ARG:VdWContact': 99, 'UNL:ASN:VdWContact': 11, 'UNL:ASP:VdWContact': 22, 'UNL:GLY:HBAcceptor': 99, 'UNL:GLY:VdWContact': 121, 'UNL:ILE:VdWContact': 55, 'UNL:LEU:VdWContact': 11, 'UNL:LYS:HBAcceptor': 44, 'UNL:LYS:VdWContact': 44, 'UNL:PRO:Hydrophobic': 44, 'UNL:PRO:VdWContact': 55, 'UNL:THR:HBAcceptor': 88, 'UNL:THR:VdWContact': 231, 'UNL:TYR:VdWContact': 11}"
+158,AF3-Single-Seq,H1172v1,9.409090909090908,0.8145332927941624,"{'UNL:ALA:VdWContact': 9, 'UNL:ASP:VdWContact': 18, 'UNL:GLU:VdWContact': 9, 'UNL:GLY:HBAcceptor': 108, 'UNL:GLY:HBDonor': 36, 'UNL:GLY:VdWContact': 108, 'UNL:LEU:VdWContact': 45, 'UNL:LYS:HBAcceptor': 54, 'UNL:LYS:HBDonor': 27, 'UNL:LYS:VdWContact': 108, 'UNL:PRO:VdWContact': 45, 'UNL:THR:HBAcceptor': 90, 'UNL:THR:HBDonor': 27, 'UNL:THR:VdWContact': 99, 'UNL:VAL:HBDonor': 9, 'UNL:VAL:VdWContact': 18}","{'UNL:ARG:HBAcceptor': 54, 'UNL:ARG:VdWContact': 63, 'UNL:GLY:HBAcceptor': 63, 'UNL:GLY:VdWContact': 90, 'UNL:ILE:VdWContact': 54, 'UNL:LEU:VdWContact': 18, 'UNL:LYS:HBAcceptor': 36, 'UNL:LYS:VdWContact': 36, 'UNL:PRO:Hydrophobic': 18, 'UNL:PRO:VdWContact': 45, 'UNL:THR:HBAcceptor': 72, 'UNL:THR:VdWContact': 144, 'UNL:TYR:HBAcceptor': 9, 'UNL:TYR:VdWContact': 9}"
+159,AF3-Single-Seq,T1158v4,,0.0,,
+160,AF3-Single-Seq,H1172v4,8.571428571428573,0.8313425704730052,"{'UNL:ALA:VdWContact': 9, 'UNL:ASP:VdWContact': 18, 'UNL:GLU:VdWContact': 9, 'UNL:GLY:HBAcceptor': 108, 'UNL:GLY:HBDonor': 36, 'UNL:GLY:VdWContact': 108, 'UNL:LEU:VdWContact': 45, 'UNL:LYS:HBAcceptor': 54, 'UNL:LYS:HBDonor': 27, 'UNL:LYS:VdWContact': 108, 'UNL:PRO:VdWContact': 45, 'UNL:THR:HBAcceptor': 90, 'UNL:THR:HBDonor': 9, 'UNL:THR:VdWContact': 99, 'UNL:VAL:VdWContact': 18}","{'UNL:ARG:HBAcceptor': 63, 'UNL:ARG:VdWContact': 63, 'UNL:GLY:HBAcceptor': 99, 'UNL:GLY:VdWContact': 81, 'UNL:ILE:VdWContact': 45, 'UNL:LEU:HBAcceptor': 9, 'UNL:LEU:VdWContact': 27, 'UNL:LYS:HBAcceptor': 45, 'UNL:LYS:VdWContact': 45, 'UNL:PRO:Hydrophobic': 27, 'UNL:PRO:VdWContact': 36, 'UNL:THR:HBAcceptor': 72, 'UNL:THR:VdWContact': 135, 'UNL:TYR:VdWContact': 18}"
+161,AF3-Single-Seq,T1146,0.16666666666666669,1.0,"{'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1}"
+162,AF3-Single-Seq,H1172v2,14.499999999999998,0.7123745819397993,"{'UNL:ASP:VdWContact': 81, 'UNL:GLY:HBAcceptor': 108, 'UNL:GLY:HBDonor': 36, 'UNL:GLY:VdWContact': 108, 'UNL:LEU:HBDonor': 18, 'UNL:LEU:VdWContact': 90, 'UNL:LYS:HBAcceptor': 54, 'UNL:LYS:HBDonor': 18, 'UNL:LYS:VdWContact': 54, 'UNL:PRO:VdWContact': 36, 'UNL:THR:HBAcceptor': 135, 'UNL:THR:HBDonor': 36, 'UNL:THR:VdWContact': 162}","{'UNL:ARG:HBAcceptor': 63, 'UNL:ARG:VdWContact': 63, 'UNL:GLY:HBAcceptor': 72, 'UNL:GLY:VdWContact': 81, 'UNL:ILE:VdWContact': 45, 'UNL:LEU:VdWContact': 9, 'UNL:LYS:HBAcceptor': 27, 'UNL:LYS:VdWContact': 45, 'UNL:PRO:Hydrophobic': 18, 'UNL:PRO:VdWContact': 27, 'UNL:THR:HBAcceptor': 72, 'UNL:THR:VdWContact': 135, 'UNL:TYR:VdWContact': 18}"
+163,AF3-Single-Seq,T1186,,0.0,,
+164,AF3-Single-Seq,T1187,1.0,0.9832775919732442,"{'UNL:ARG:VdWContact': 4, 'UNL:GLU:HBDonor': 4, 'UNL:GLU:Hydrophobic': 4, 'UNL:GLU:VdWContact': 4, 'UNL:GLY:VdWContact': 4, 'UNL:LYS:Hydrophobic': 2, 'UNL:THR:VdWContact': 4, 'UNL:TYR:VdWContact': 4, 'UNL:VAL:Hydrophobic': 8, 'UNL:VAL:VdWContact': 4}","{'UNL:ALA:HBAcceptor': 4, 'UNL:ALA:VdWContact': 4, 'UNL:ASP:VdWContact': 4, 'UNL:LYS:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:HBAcceptor': 8, 'UNL:TRP:VdWContact': 8, 'UNL:VAL:VdWContact': 2}"
+165,AF3-Single-Seq,T1127v2,1.184210526315789,0.9795810596725929,"{'UNL:ALA:VdWContact': 15, 'UNL:ARG:HBAcceptor': 20, 'UNL:ARG:HBDonor': 5, 'UNL:ARG:Hydrophobic': 10, 'UNL:ARG:VdWContact': 30, 'UNL:ASN:HBAcceptor': 5, 'UNL:ASN:HBDonor': 5, 'UNL:ASN:Hydrophobic': 5, 'UNL:ASN:VdWContact': 10, 'UNL:GLU:Hydrophobic': 5, 'UNL:GLU:VdWContact': 5, 'UNL:GLY:HBAcceptor': 5, 'UNL:GLY:HBDonor': 10, 'UNL:GLY:VdWContact': 10, 'UNL:HIS:VdWContact': 5, 'UNL:LEU:Hydrophobic': 20, 'UNL:LEU:VdWContact': 15, 'UNL:LYS:VdWContact': 10, 'UNL:PHE:Hydrophobic': 25, 'UNL:PHE:VdWContact': 30, 'UNL:PRO:VdWContact': 5, 'UNL:SER:VdWContact': 10, 'UNL:THR:VdWContact': 5, 'UNL:TYR:HBAcceptor': 5, 'UNL:TYR:HBDonor': 5, 'UNL:TYR:Hydrophobic': 20, 'UNL:TYR:VdWContact': 15, 'UNL:VAL:Hydrophobic': 5}","{'UNL:ALA:VdWContact': 5, 'UNL:ARG:HBAcceptor': 30, 'UNL:ARG:VdWContact': 35, 'UNL:ASN:HBAcceptor': 10, 'UNL:ASN:Hydrophobic': 10, 'UNL:ASN:VdWContact': 25, 'UNL:ASP:VdWContact': 5, 'UNL:GLN:VdWContact': 10, 'UNL:GLU:VdWContact': 20, 'UNL:GLY:HBAcceptor': 20, 'UNL:GLY:VdWContact': 20, 'UNL:ILE:HBAcceptor': 5, 'UNL:ILE:VdWContact': 5, 'UNL:LEU:VdWContact': 10, 'UNL:LYS:HBAcceptor': 10, 'UNL:LYS:VdWContact': 10, 'UNL:MET:HBAcceptor': 10, 'UNL:MET:VdWContact': 15, 'UNL:PHE:VdWContact': 20, 'UNL:TRP:VdWContact': 5, 'UNL:VAL:HBAcceptor': 5, 'UNL:VAL:VdWContact': 5}"
+166,AF3-Single-Seq,T1124,1.7600000000000002,0.9680267558528428,"{'UNL:ASN:VdWContact': 8, 'UNL:ASP:HBDonor': 4, 'UNL:ASP:Hydrophobic': 8, 'UNL:ASP:VdWContact': 16, 'UNL:GLU:Hydrophobic': 8, 'UNL:HIS:Hydrophobic': 8, 'UNL:HIS:VdWContact': 16, 'UNL:ILE:VdWContact': 8, 'UNL:LEU:VdWContact': 8, 'UNL:LYS:HBDonor': 4, 'UNL:LYS:VdWContact': 8, 'UNL:SER:VdWContact': 8, 'UNL:TYR:Hydrophobic': 8, 'UNL:TYR:VdWContact': 8}","{'UNL:ALA:VdWContact': 8, 'UNL:ASN:HBAcceptor': 8, 'UNL:ASN:VdWContact': 8, 'UNL:ASP:VdWContact': 16, 'UNL:GLY:VdWContact': 8, 'UNL:HIS:HBAcceptor': 4, 'UNL:HIS:VdWContact': 8, 'UNL:ILE:Hydrophobic': 8, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 8, 'UNL:LYS:VdWContact': 8, 'UNL:PHE:HBAcceptor': 8, 'UNL:PHE:Hydrophobic': 8, 'UNL:PHE:VdWContact': 8, 'UNL:SER:VdWContact': 8, 'UNL:TYR:Hydrophobic': 8, 'UNL:TYR:VdWContact': 20, 'UNL:VAL:Hydrophobic': 8, 'UNL:VAL:VdWContact': 4}"
+167,AF3-Single-Seq,T1158v3,,0.0,,
+168,AF3-Single-Seq,H1172v3,12.210526315789473,0.7583171976764654,"{'UNL:ARG:VdWContact': 8, 'UNL:ASP:VdWContact': 16, 'UNL:GLY:HBAcceptor': 96, 'UNL:GLY:HBDonor': 16, 'UNL:GLY:VdWContact': 96, 'UNL:LEU:VdWContact': 72, 'UNL:LYS:HBAcceptor': 48, 'UNL:LYS:HBDonor': 16, 'UNL:LYS:VdWContact': 48, 'UNL:PHE:HBDonor': 16, 'UNL:PHE:VdWContact': 40, 'UNL:PRO:VdWContact': 8, 'UNL:THR:HBAcceptor': 96, 'UNL:THR:HBDonor': 32, 'UNL:THR:VdWContact': 96, 'UNL:TYR:VdWContact': 96}","{'UNL:ARG:HBAcceptor': 56, 'UNL:ARG:VdWContact': 64, 'UNL:GLY:HBAcceptor': 64, 'UNL:GLY:VdWContact': 72, 'UNL:ILE:VdWContact': 32, 'UNL:LEU:VdWContact': 24, 'UNL:LYS:HBAcceptor': 40, 'UNL:LYS:VdWContact': 48, 'UNL:PRO:Hydrophobic': 16, 'UNL:PRO:VdWContact': 24, 'UNL:THR:HBAcceptor': 56, 'UNL:THR:VdWContact': 88}"
+169,AF3-Single-Seq,H1135,,0.0,,
+170,AF3,H1171v2,33.0,0.3411371237458194,"{'UNL:ARG:HBAcceptor': 81, 'UNL:ARG:HBDonor': 54, 'UNL:ARG:VdWContact': 135, 'UNL:ASP:VdWContact': 18, 'UNL:GLU:VdWContact': 9, 'UNL:GLY:HBAcceptor': 108, 'UNL:GLY:HBDonor': 72, 'UNL:GLY:VdWContact': 108, 'UNL:ILE:HBAcceptor': 54, 'UNL:ILE:VdWContact': 108, 'UNL:LEU:HBDonor': 54, 'UNL:LEU:VdWContact': 72, 'UNL:LYS:HBAcceptor': 54, 'UNL:LYS:HBDonor': 18, 'UNL:LYS:VdWContact': 54, 'UNL:PRO:VdWContact': 90, 'UNL:THR:HBAcceptor': 108, 'UNL:THR:VdWContact': 108, 'UNL:TYR:VdWContact': 108}","{'UNL:ARG:HBAcceptor': 72, 'UNL:ARG:VdWContact': 81, 'UNL:GLY:HBAcceptor': 72, 'UNL:GLY:VdWContact': 81, 'UNL:ILE:VdWContact': 36, 'UNL:LEU:VdWContact': 27, 'UNL:LYS:HBAcceptor': 45, 'UNL:LYS:VdWContact': 54, 'UNL:PRO:Hydrophobic': 27, 'UNL:PRO:VdWContact': 45, 'UNL:THR:HBAcceptor': 63, 'UNL:THR:Hydrophobic': 9, 'UNL:THR:VdWContact': 162}"
+171,AF3,T1158v2,,0.0,,
+172,AF3,T1152,1138.6333333333334,0.0,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:VdWContact': 384, 'UNL:ASN:HBAcceptor': 1152, 'UNL:ASN:VdWContact': 3584, 'UNL:ASP:VdWContact': 1536, 'UNL:GLN:HBAcceptor': 896, 'UNL:GLN:VdWContact': 2560, 'UNL:GLU:HBAcceptor': 128, 'UNL:GLU:VdWContact': 896, 'UNL:GLY:HBAcceptor': 640, 'UNL:GLY:VdWContact': 1920, 'UNL:ILE:HBAcceptor': 512, 'UNL:ILE:VdWContact': 3072, 'UNL:LEU:VdWContact': 1280, 'UNL:LYS:HBAcceptor': 512, 'UNL:LYS:VdWContact': 4224, 'UNL:MET:VdWContact': 1280, 'UNL:PRO:VdWContact': 2432, 'UNL:SER:HBAcceptor': 128, 'UNL:SER:VdWContact': 512, 'UNL:THR:HBAcceptor': 768, 'UNL:THR:VdWContact': 2048, 'UNL:TRP:HBAcceptor': 512, 'UNL:TRP:VdWContact': 768, 'UNL:TYR:VdWContact': 1024, 'UNL:VAL:VdWContact': 1408}"
+173,AF3,T1158v1,,0.0,,
+174,AF3,H1171v1,44.55,0.10936454849498334,"{'UNL:ARG:HBAcceptor': 132, 'UNL:ARG:HBDonor': 77, 'UNL:ARG:VdWContact': 187, 'UNL:ASP:VdWContact': 55, 'UNL:GLY:HBAcceptor': 132, 'UNL:GLY:HBDonor': 77, 'UNL:GLY:VdWContact': 132, 'UNL:ILE:HBAcceptor': 66, 'UNL:ILE:VdWContact': 132, 'UNL:LEU:HBDonor': 66, 'UNL:LEU:VdWContact': 77, 'UNL:LYS:HBAcceptor': 66, 'UNL:LYS:HBDonor': 66, 'UNL:LYS:VdWContact': 66, 'UNL:PRO:VdWContact': 121, 'UNL:THR:HBAcceptor': 132, 'UNL:THR:VdWContact': 132, 'UNL:TYR:VdWContact': 132}","{'UNL:ARG:HBAcceptor': 110, 'UNL:ARG:VdWContact': 99, 'UNL:ASN:VdWContact': 11, 'UNL:ASP:VdWContact': 22, 'UNL:GLY:HBAcceptor': 99, 'UNL:GLY:VdWContact': 121, 'UNL:ILE:VdWContact': 55, 'UNL:LEU:VdWContact': 11, 'UNL:LYS:HBAcceptor': 44, 'UNL:LYS:VdWContact': 44, 'UNL:PRO:Hydrophobic': 44, 'UNL:PRO:VdWContact': 55, 'UNL:THR:HBAcceptor': 88, 'UNL:THR:VdWContact': 231, 'UNL:TYR:VdWContact': 11}"
+175,AF3,H1172v1,33.3,0.3351170568561873,"{'UNL:ARG:HBAcceptor': 90, 'UNL:ARG:HBDonor': 27, 'UNL:ARG:VdWContact': 135, 'UNL:ASP:VdWContact': 9, 'UNL:GLY:HBAcceptor': 108, 'UNL:GLY:HBDonor': 63, 'UNL:GLY:VdWContact': 108, 'UNL:ILE:HBAcceptor': 54, 'UNL:ILE:VdWContact': 108, 'UNL:LEU:HBDonor': 54, 'UNL:LEU:VdWContact': 81, 'UNL:LYS:HBAcceptor': 54, 'UNL:LYS:HBDonor': 9, 'UNL:LYS:VdWContact': 54, 'UNL:PRO:VdWContact': 81, 'UNL:THR:HBAcceptor': 108, 'UNL:THR:VdWContact': 108, 'UNL:TYR:VdWContact': 108}","{'UNL:ARG:HBAcceptor': 54, 'UNL:ARG:VdWContact': 63, 'UNL:GLY:HBAcceptor': 63, 'UNL:GLY:VdWContact': 90, 'UNL:ILE:VdWContact': 54, 'UNL:LEU:VdWContact': 18, 'UNL:LYS:HBAcceptor': 36, 'UNL:LYS:VdWContact': 36, 'UNL:PRO:Hydrophobic': 18, 'UNL:PRO:VdWContact': 45, 'UNL:THR:HBAcceptor': 72, 'UNL:THR:VdWContact': 144, 'UNL:TYR:HBAcceptor': 9, 'UNL:TYR:VdWContact': 9}"
+176,AF3,T1158v4,,0.0,,
+177,AF3,H1172v4,30.6,0.38929765886287626,"{'UNL:ARG:HBAcceptor': 90, 'UNL:ARG:HBDonor': 36, 'UNL:ARG:VdWContact': 135, 'UNL:ASP:VdWContact': 9, 'UNL:GLY:HBAcceptor': 108, 'UNL:GLY:HBDonor': 63, 'UNL:GLY:VdWContact': 108, 'UNL:ILE:HBAcceptor': 54, 'UNL:ILE:VdWContact': 108, 'UNL:LEU:HBDonor': 54, 'UNL:LEU:VdWContact': 81, 'UNL:LYS:HBAcceptor': 54, 'UNL:LYS:HBDonor': 18, 'UNL:LYS:VdWContact': 54, 'UNL:PRO:VdWContact': 81, 'UNL:THR:HBAcceptor': 108, 'UNL:THR:VdWContact': 108, 'UNL:TYR:VdWContact': 108}","{'UNL:ARG:HBAcceptor': 63, 'UNL:ARG:VdWContact': 63, 'UNL:GLY:HBAcceptor': 99, 'UNL:GLY:VdWContact': 81, 'UNL:ILE:VdWContact': 45, 'UNL:LEU:HBAcceptor': 9, 'UNL:LEU:VdWContact': 27, 'UNL:LYS:HBAcceptor': 45, 'UNL:LYS:VdWContact': 45, 'UNL:PRO:Hydrophobic': 27, 'UNL:PRO:VdWContact': 36, 'UNL:THR:HBAcceptor': 72, 'UNL:THR:VdWContact': 135, 'UNL:TYR:VdWContact': 18}"
+178,AF3,T1146,0.5555555555555556,0.992196209587514,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1}"
+179,AF3,H1172v2,39.0,0.22073578595317722,"{'UNL:ARG:HBAcceptor': 81, 'UNL:ARG:HBDonor': 54, 'UNL:ARG:VdWContact': 126, 'UNL:ASP:VdWContact': 18, 'UNL:GLY:HBAcceptor': 108, 'UNL:GLY:HBDonor': 63, 'UNL:GLY:VdWContact': 108, 'UNL:ILE:HBAcceptor': 54, 'UNL:ILE:VdWContact': 108, 'UNL:LEU:HBDonor': 45, 'UNL:LEU:VdWContact': 45, 'UNL:LYS:HBAcceptor': 54, 'UNL:LYS:VdWContact': 54, 'UNL:PRO:VdWContact': 117, 'UNL:THR:HBAcceptor': 108, 'UNL:THR:VdWContact': 108, 'UNL:TYR:VdWContact': 108}","{'UNL:ARG:HBAcceptor': 63, 'UNL:ARG:VdWContact': 63, 'UNL:GLY:HBAcceptor': 72, 'UNL:GLY:VdWContact': 81, 'UNL:ILE:VdWContact': 45, 'UNL:LEU:VdWContact': 9, 'UNL:LYS:HBAcceptor': 27, 'UNL:LYS:VdWContact': 45, 'UNL:PRO:Hydrophobic': 18, 'UNL:PRO:VdWContact': 27, 'UNL:THR:HBAcceptor': 72, 'UNL:THR:VdWContact': 135, 'UNL:TYR:VdWContact': 18}"
+180,AF3,T1186,,0.0,,
+181,AF3,T1187,0.9230769230769229,0.9848211988680217,"{'UNL:ALA:HBAcceptor': 4, 'UNL:ALA:VdWContact': 4, 'UNL:PRO:Hydrophobic': 4, 'UNL:PRO:VdWContact': 2, 'UNL:TRP:HBAcceptor': 8, 'UNL:TRP:Hydrophobic': 8, 'UNL:TRP:VdWContact': 8, 'UNL:TYR:Hydrophobic': 4, 'UNL:VAL:Hydrophobic': 4}","{'UNL:ALA:HBAcceptor': 4, 'UNL:ALA:VdWContact': 4, 'UNL:ASP:VdWContact': 4, 'UNL:LYS:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:HBAcceptor': 8, 'UNL:TRP:VdWContact': 8, 'UNL:VAL:VdWContact': 2}"
+182,AF3,T1127v2,5.0,0.9030100334448161,"{'UNL:ALA:Hydrophobic': 10, 'UNL:ARG:HBAcceptor': 25, 'UNL:ARG:HBDonor': 10, 'UNL:ARG:VdWContact': 40, 'UNL:ASN:HBAcceptor': 10, 'UNL:ASN:VdWContact': 30, 'UNL:ASP:VdWContact': 10, 'UNL:GLN:HBDonor': 5, 'UNL:GLN:VdWContact': 5, 'UNL:GLU:VdWContact': 20, 'UNL:GLY:HBAcceptor': 20, 'UNL:GLY:VdWContact': 20, 'UNL:ILE:HBAcceptor': 5, 'UNL:ILE:Hydrophobic': 10, 'UNL:ILE:VdWContact': 20, 'UNL:LEU:VdWContact': 5, 'UNL:LYS:HBAcceptor': 10, 'UNL:LYS:Hydrophobic': 10, 'UNL:LYS:VdWContact': 20, 'UNL:MET:HBAcceptor': 10, 'UNL:MET:HBDonor': 5, 'UNL:MET:Hydrophobic': 10, 'UNL:MET:VdWContact': 20, 'UNL:PHE:Hydrophobic': 40, 'UNL:PHE:VdWContact': 45, 'UNL:THR:HBAcceptor': 5, 'UNL:THR:VdWContact': 5, 'UNL:TRP:Hydrophobic': 5, 'UNL:TRP:VdWContact': 10, 'UNL:TYR:VdWContact': 10, 'UNL:VAL:VdWContact': 10}","{'UNL:ALA:VdWContact': 5, 'UNL:ARG:HBAcceptor': 30, 'UNL:ARG:VdWContact': 35, 'UNL:ASN:HBAcceptor': 10, 'UNL:ASN:Hydrophobic': 10, 'UNL:ASN:VdWContact': 25, 'UNL:ASP:VdWContact': 5, 'UNL:GLN:VdWContact': 10, 'UNL:GLU:VdWContact': 20, 'UNL:GLY:HBAcceptor': 20, 'UNL:GLY:VdWContact': 20, 'UNL:ILE:HBAcceptor': 5, 'UNL:ILE:VdWContact': 5, 'UNL:LEU:VdWContact': 10, 'UNL:LYS:HBAcceptor': 10, 'UNL:LYS:VdWContact': 10, 'UNL:MET:HBAcceptor': 10, 'UNL:MET:VdWContact': 15, 'UNL:PHE:VdWContact': 20, 'UNL:TRP:VdWContact': 5, 'UNL:VAL:HBAcceptor': 5, 'UNL:VAL:VdWContact': 5}"
+183,AF3,T1124,4.363636363636363,0.9157798723016115,"{'UNL:ALA:HBDonor': 4, 'UNL:ALA:VdWContact': 8, 'UNL:ASN:HBAcceptor': 8, 'UNL:ASN:Hydrophobic': 8, 'UNL:ASN:VdWContact': 8, 'UNL:ASP:HBDonor': 8, 'UNL:ASP:VdWContact': 16, 'UNL:CYS:VdWContact': 8, 'UNL:GLY:HBDonor': 4, 'UNL:GLY:VdWContact': 8, 'UNL:HIS:HBDonor': 4, 'UNL:HIS:VdWContact': 8, 'UNL:ILE:Hydrophobic': 24, 'UNL:ILE:VdWContact': 16, 'UNL:LEU:Hydrophobic': 16, 'UNL:LEU:VdWContact': 8, 'UNL:LYS:VdWContact': 8, 'UNL:MET:Hydrophobic': 8, 'UNL:MET:VdWContact': 8, 'UNL:PHE:HBAcceptor': 8, 'UNL:PHE:HBDonor': 8, 'UNL:PHE:Hydrophobic': 8, 'UNL:PHE:VdWContact': 16, 'UNL:SER:HBDonor': 4, 'UNL:SER:VdWContact': 8, 'UNL:TRP:Hydrophobic': 8, 'UNL:TRP:VdWContact': 8, 'UNL:TYR:HBAcceptor': 8, 'UNL:TYR:Hydrophobic': 8, 'UNL:TYR:VdWContact': 24, 'UNL:VAL:Hydrophobic': 8, 'UNL:VAL:VdWContact': 12}","{'UNL:ALA:VdWContact': 8, 'UNL:ASN:HBAcceptor': 8, 'UNL:ASN:VdWContact': 8, 'UNL:ASP:VdWContact': 16, 'UNL:GLY:VdWContact': 8, 'UNL:HIS:HBAcceptor': 4, 'UNL:HIS:VdWContact': 8, 'UNL:ILE:Hydrophobic': 8, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 8, 'UNL:LYS:VdWContact': 8, 'UNL:PHE:HBAcceptor': 8, 'UNL:PHE:Hydrophobic': 8, 'UNL:PHE:VdWContact': 8, 'UNL:SER:VdWContact': 8, 'UNL:TYR:Hydrophobic': 8, 'UNL:TYR:VdWContact': 20, 'UNL:VAL:Hydrophobic': 8, 'UNL:VAL:VdWContact': 4}"
+184,AF3,T1158v3,,0.0,,
+185,AF3,H1172v3,34.66666666666666,0.3076923076923078,"{'UNL:ARG:HBAcceptor': 72, 'UNL:ARG:HBDonor': 48, 'UNL:ARG:VdWContact': 112, 'UNL:ASP:VdWContact': 8, 'UNL:GLY:HBAcceptor': 96, 'UNL:GLY:HBDonor': 64, 'UNL:GLY:VdWContact': 96, 'UNL:ILE:HBAcceptor': 48, 'UNL:ILE:VdWContact': 96, 'UNL:LEU:HBDonor': 40, 'UNL:LEU:VdWContact': 40, 'UNL:LYS:HBAcceptor': 48, 'UNL:LYS:VdWContact': 48, 'UNL:PRO:VdWContact': 104, 'UNL:THR:HBAcceptor': 96, 'UNL:THR:VdWContact': 96, 'UNL:TYR:VdWContact': 96}","{'UNL:ARG:HBAcceptor': 56, 'UNL:ARG:VdWContact': 64, 'UNL:GLY:HBAcceptor': 64, 'UNL:GLY:VdWContact': 72, 'UNL:ILE:VdWContact': 32, 'UNL:LEU:VdWContact': 24, 'UNL:LYS:HBAcceptor': 40, 'UNL:LYS:VdWContact': 48, 'UNL:PRO:Hydrophobic': 16, 'UNL:PRO:VdWContact': 24, 'UNL:THR:HBAcceptor': 56, 'UNL:THR:VdWContact': 88}"
+186,AF3,H1135,25.333333333333336,0.49498327759197325,"{'UNL:ARG:VdWContact': 48, 'UNL:ASN:VdWContact': 108, 'UNL:ASP:VdWContact': 108, 'UNL:CYS:VdWContact': 12, 'UNL:GLN:VdWContact': 108, 'UNL:ILE:VdWContact': 108, 'UNL:TYR:VdWContact': 108, 'UNL:VAL:VdWContact': 108}","{'UNL:ARG:VdWContact': 72, 'UNL:ASN:VdWContact': 144, 'UNL:ASP:VdWContact': 144, 'UNL:GLN:VdWContact': 144, 'UNL:ILE:VdWContact': 108, 'UNL:SER:VdWContact': 36, 'UNL:TYR:VdWContact': 144, 'UNL:VAL:VdWContact': 144}"
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@@ -0,0 +1,107 @@
+,Category,Target,Structured_EMD,Unstructured_EMD,Method_Histogram,Reference_Histogram
+0,P2Rank-Vina,T1158v2,1.0,0.6666666666666667,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1}"
+1,P2Rank-Vina,T1152,524.6999999999999,1521.8947368421054,"{'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 3, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:VdWContact': 384, 'UNL:ASN:HBAcceptor': 1152, 'UNL:ASN:VdWContact': 3584, 'UNL:ASP:VdWContact': 1536, 'UNL:GLN:HBAcceptor': 896, 'UNL:GLN:VdWContact': 2560, 'UNL:GLU:HBAcceptor': 128, 'UNL:GLU:VdWContact': 896, 'UNL:GLY:HBAcceptor': 640, 'UNL:GLY:VdWContact': 1920, 'UNL:ILE:HBAcceptor': 512, 'UNL:ILE:VdWContact': 3072, 'UNL:LEU:VdWContact': 1280, 'UNL:LYS:HBAcceptor': 512, 'UNL:LYS:VdWContact': 4224, 'UNL:MET:VdWContact': 1280, 'UNL:PRO:VdWContact': 2432, 'UNL:SER:HBAcceptor': 128, 'UNL:SER:VdWContact': 512, 'UNL:THR:HBAcceptor': 768, 'UNL:THR:VdWContact': 2048, 'UNL:TRP:HBAcceptor': 512, 'UNL:TRP:VdWContact': 768, 'UNL:TYR:VdWContact': 1024, 'UNL:VAL:VdWContact': 1408}"
+2,P2Rank-Vina,T1158v1,0.75,0.6666666666666667,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2}"
+3,P2Rank-Vina,H1172v1,12.857142857142858,21.000000000000004,"{'UNL:ALA:Hydrophobic': 9, 'UNL:ALA:VdWContact': 18, 'UNL:ARG:HBAcceptor': 36, 'UNL:ARG:HBDonor': 9, 'UNL:ARG:VdWContact': 63, 'UNL:ASN:HBAcceptor': 9, 'UNL:ASN:HBDonor': 9, 'UNL:ASN:VdWContact': 18, 'UNL:ASP:HBAcceptor': 9, 'UNL:ASP:VdWContact': 9, 'UNL:GLN:HBAcceptor': 18, 'UNL:GLN:HBDonor': 9, 'UNL:GLN:VdWContact': 27, 'UNL:GLU:Hydrophobic': 18, 'UNL:GLU:VdWContact': 63, 'UNL:GLY:HBAcceptor': 36, 'UNL:GLY:VdWContact': 45, 'UNL:ILE:HBAcceptor': 9, 'UNL:ILE:HBDonor': 18, 'UNL:ILE:Hydrophobic': 27, 'UNL:ILE:VdWContact': 54, 'UNL:LEU:VdWContact': 18, 'UNL:LYS:HBAcceptor': 9, 'UNL:LYS:VdWContact': 36, 'UNL:PRO:Hydrophobic': 54, 'UNL:PRO:VdWContact': 9, 'UNL:SER:VdWContact': 45, 'UNL:THR:HBAcceptor': 36, 'UNL:THR:Hydrophobic': 9, 'UNL:THR:VdWContact': 54, 'UNL:TYR:HBDonor': 9, 'UNL:TYR:Hydrophobic': 36, 'UNL:TYR:VdWContact': 54, 'UNL:VAL:VdWContact': 18}","{'UNL:ARG:HBAcceptor': 54, 'UNL:ARG:VdWContact': 63, 'UNL:GLY:HBAcceptor': 63, 'UNL:GLY:VdWContact': 90, 'UNL:ILE:VdWContact': 54, 'UNL:LEU:VdWContact': 18, 'UNL:LYS:HBAcceptor': 36, 'UNL:LYS:VdWContact': 36, 'UNL:PRO:Hydrophobic': 18, 'UNL:PRO:VdWContact': 45, 'UNL:THR:HBAcceptor': 72, 'UNL:THR:VdWContact': 144, 'UNL:TYR:HBAcceptor': 9, 'UNL:TYR:VdWContact': 9}"
+4,P2Rank-Vina,T1158v4,4.888888888888889,5.666666666666666,"{'UNL:ALA:Hydrophobic': 4, 'UNL:ALA:VdWContact': 4, 'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:Hydrophobic': 4, 'UNL:ARG:VdWContact': 8, 'UNL:ASP:VdWContact': 4, 'UNL:GLN:HBAcceptor': 4, 'UNL:GLN:HBDonor': 4, 'UNL:GLN:VdWContact': 8, 'UNL:GLY:VdWContact': 8, 'UNL:HIS:VdWContact': 8, 'UNL:ILE:VdWContact': 4, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 12, 'UNL:LYS:VdWContact': 4, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 8, 'UNL:PHE:Hydrophobic': 8, 'UNL:PHE:VdWContact': 4, 'UNL:SER:VdWContact': 8, 'UNL:THR:HBAcceptor': 4, 'UNL:THR:Hydrophobic': 4, 'UNL:THR:VdWContact': 8, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 4, 'UNL:TYR:HBAcceptor': 4, 'UNL:TYR:VdWContact': 12, 'UNL:VAL:VdWContact': 4}","{'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBAcceptor': 4, 'UNL:ASN:VdWContact': 8, 'UNL:ASP:VdWContact': 4, 'UNL:GLN:HBAcceptor': 12, 'UNL:GLN:VdWContact': 24, 'UNL:GLY:HBAcceptor': 24, 'UNL:GLY:VdWContact': 28, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:HBAcceptor': 8, 'UNL:LYS:VdWContact': 8, 'UNL:SER:HBAcceptor': 16, 'UNL:SER:VdWContact': 32}"
+5,P2Rank-Vina,T1146,1.0,0.6,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1}"
+6,P2Rank-Vina,T1186,0.6666666666666667,1.1428571428571428,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 3, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 4, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+7,P2Rank-Vina,T1187,2.0,1.2857142857142856,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 8, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 4, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBDonor': 2, 'UNL:GLY:VdWContact': 4, 'UNL:LYS:HBAcceptor': 2, 'UNL:LYS:VdWContact': 2, 'UNL:SER:HBDonor': 2, 'UNL:SER:VdWContact': 4, 'UNL:THR:VdWContact': 4, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 4}","{'UNL:ALA:HBAcceptor': 4, 'UNL:ALA:VdWContact': 4, 'UNL:ASP:VdWContact': 4, 'UNL:LYS:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:HBAcceptor': 8, 'UNL:TRP:VdWContact': 8, 'UNL:VAL:VdWContact': 2}"
+8,P2Rank-Vina,T1127v2,3.333333333333334,7.592592592592592,"{'UNL:ALA:Hydrophobic': 5, 'UNL:ALA:VdWContact': 5, 'UNL:ARG:HBAcceptor': 10, 'UNL:ARG:HBDonor': 10, 'UNL:ARG:VdWContact': 30, 'UNL:ASN:HBAcceptor': 15, 'UNL:ASN:Hydrophobic': 5, 'UNL:ASN:VdWContact': 15, 'UNL:ASP:VdWContact': 5, 'UNL:GLN:HBAcceptor': 5, 'UNL:GLN:VdWContact': 5, 'UNL:GLU:HBDonor': 10, 'UNL:GLU:Hydrophobic': 15, 'UNL:GLU:VdWContact': 35, 'UNL:GLY:HBDonor': 5, 'UNL:GLY:VdWContact': 5, 'UNL:HIS:VdWContact': 5, 'UNL:ILE:HBAcceptor': 10, 'UNL:ILE:Hydrophobic': 15, 'UNL:ILE:VdWContact': 25, 'UNL:LEU:Hydrophobic': 30, 'UNL:LEU:VdWContact': 35, 'UNL:MET:HBAcceptor': 5, 'UNL:MET:Hydrophobic': 10, 'UNL:MET:VdWContact': 10, 'UNL:PHE:Hydrophobic': 35, 'UNL:PHE:VdWContact': 40, 'UNL:PRO:Hydrophobic': 5, 'UNL:PRO:VdWContact': 5, 'UNL:TRP:Hydrophobic': 10, 'UNL:TRP:VdWContact': 15, 'UNL:TYR:HBAcceptor': 10, 'UNL:TYR:Hydrophobic': 15, 'UNL:TYR:VdWContact': 15, 'UNL:VAL:VdWContact': 10}","{'UNL:ALA:VdWContact': 5, 'UNL:ARG:HBAcceptor': 30, 'UNL:ARG:VdWContact': 35, 'UNL:ASN:HBAcceptor': 10, 'UNL:ASN:Hydrophobic': 10, 'UNL:ASN:VdWContact': 25, 'UNL:ASP:VdWContact': 5, 'UNL:GLN:VdWContact': 10, 'UNL:GLU:VdWContact': 20, 'UNL:GLY:HBAcceptor': 20, 'UNL:GLY:VdWContact': 20, 'UNL:ILE:HBAcceptor': 5, 'UNL:ILE:VdWContact': 5, 'UNL:LEU:VdWContact': 10, 'UNL:LYS:HBAcceptor': 10, 'UNL:LYS:VdWContact': 10, 'UNL:MET:HBAcceptor': 10, 'UNL:MET:VdWContact': 15, 'UNL:PHE:VdWContact': 20, 'UNL:TRP:VdWContact': 5, 'UNL:VAL:HBAcceptor': 5, 'UNL:VAL:VdWContact': 5}"
+9,P2Rank-Vina,T1124,2.0,2.2666666666666666,"{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBAcceptor': 8, 'UNL:ASN:HBDonor': 4, 'UNL:ASN:Hydrophobic': 4, 'UNL:ASN:VdWContact': 12, 'UNL:ASP:HBDonor': 4, 'UNL:ASP:VdWContact': 4, 'UNL:GLN:Hydrophobic': 4, 'UNL:GLN:VdWContact': 8, 'UNL:GLU:Hydrophobic': 4, 'UNL:GLU:VdWContact': 4, 'UNL:GLY:VdWContact': 12, 'UNL:HIS:VdWContact': 8, 'UNL:ILE:Hydrophobic': 8, 'UNL:ILE:VdWContact': 8, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 4, 'UNL:PHE:Hydrophobic': 8, 'UNL:PHE:VdWContact': 8, 'UNL:PRO:Hydrophobic': 4, 'UNL:PRO:VdWContact': 4, 'UNL:SER:VdWContact': 8, 'UNL:THR:Hydrophobic': 8, 'UNL:THR:VdWContact': 8, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 8, 'UNL:TYR:HBAcceptor': 4, 'UNL:TYR:Hydrophobic': 8, 'UNL:TYR:VdWContact': 8, 'UNL:VAL:HBDonor': 4, 'UNL:VAL:Hydrophobic': 8, 'UNL:VAL:VdWContact': 8}","{'UNL:ALA:VdWContact': 8, 'UNL:ASN:HBAcceptor': 8, 'UNL:ASN:VdWContact': 8, 'UNL:ASP:VdWContact': 16, 'UNL:GLY:VdWContact': 8, 'UNL:HIS:HBAcceptor': 4, 'UNL:HIS:VdWContact': 8, 'UNL:ILE:Hydrophobic': 8, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 8, 'UNL:LYS:VdWContact': 8, 'UNL:PHE:HBAcceptor': 8, 'UNL:PHE:Hydrophobic': 8, 'UNL:PHE:VdWContact': 8, 'UNL:SER:VdWContact': 8, 'UNL:TYR:Hydrophobic': 8, 'UNL:TYR:VdWContact': 20, 'UNL:VAL:Hydrophobic': 8, 'UNL:VAL:VdWContact': 4}"
+10,DiffDock-L,T1158v2,0.6666666666666667,0.5,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1}"
+11,DiffDock-L,T1152,476.72727272727263,1521.6315789473683,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:VdWContact': 3, 'UNL:THR:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 384, 'UNL:ASN:HBAcceptor': 1152, 'UNL:ASN:VdWContact': 3584, 'UNL:ASP:VdWContact': 1536, 'UNL:GLN:HBAcceptor': 896, 'UNL:GLN:VdWContact': 2560, 'UNL:GLU:HBAcceptor': 128, 'UNL:GLU:VdWContact': 896, 'UNL:GLY:HBAcceptor': 640, 'UNL:GLY:VdWContact': 1920, 'UNL:ILE:HBAcceptor': 512, 'UNL:ILE:VdWContact': 3072, 'UNL:LEU:VdWContact': 1280, 'UNL:LYS:HBAcceptor': 512, 'UNL:LYS:VdWContact': 4224, 'UNL:MET:VdWContact': 1280, 'UNL:PRO:VdWContact': 2432, 'UNL:SER:HBAcceptor': 128, 'UNL:SER:VdWContact': 512, 'UNL:THR:HBAcceptor': 768, 'UNL:THR:VdWContact': 2048, 'UNL:TRP:HBAcceptor': 512, 'UNL:TRP:VdWContact': 768, 'UNL:TYR:VdWContact': 1024, 'UNL:VAL:VdWContact': 1408}"
+12,DiffDock-L,T1158v1,1.3333333333333335,0.6999999999999998,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2}"
+13,DiffDock-L,H1172v1,14.142857142857142,18.0,"{'UNL:ALA:VdWContact': 9, 'UNL:ARG:VdWContact': 63, 'UNL:GLY:HBAcceptor': 54, 'UNL:GLY:VdWContact': 54, 'UNL:ILE:HBDonor': 27, 'UNL:ILE:Hydrophobic': 27, 'UNL:ILE:VdWContact': 27, 'UNL:LEU:VdWContact': 27, 'UNL:LYS:HBAcceptor': 27, 'UNL:LYS:VdWContact': 27, 'UNL:PRO:Hydrophobic': 99, 'UNL:PRO:VdWContact': 36, 'UNL:THR:HBAcceptor': 27, 'UNL:THR:VdWContact': 54, 'UNL:TYR:HBDonor': 18, 'UNL:TYR:Hydrophobic': 54, 'UNL:TYR:VdWContact': 54}","{'UNL:ARG:HBAcceptor': 54, 'UNL:ARG:VdWContact': 63, 'UNL:GLY:HBAcceptor': 63, 'UNL:GLY:VdWContact': 90, 'UNL:ILE:VdWContact': 54, 'UNL:LEU:VdWContact': 18, 'UNL:LYS:HBAcceptor': 36, 'UNL:LYS:VdWContact': 36, 'UNL:PRO:Hydrophobic': 18, 'UNL:PRO:VdWContact': 45, 'UNL:THR:HBAcceptor': 72, 'UNL:THR:VdWContact': 144, 'UNL:TYR:HBAcceptor': 9, 'UNL:TYR:VdWContact': 9}"
+14,DiffDock-L,T1158v4,6.5,6.461538461538461,"{'UNL:ALA:VdWContact': 4, 'UNL:ASP:VdWContact': 4, 'UNL:GLN:HBAcceptor': 4, 'UNL:GLN:VdWContact': 4, 'UNL:GLY:HBAcceptor': 4, 'UNL:GLY:HBDonor': 4, 'UNL:GLY:VdWContact': 8, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:HBAcceptor': 4, 'UNL:LYS:VdWContact': 4, 'UNL:SER:HBAcceptor': 4, 'UNL:SER:HBDonor': 4, 'UNL:SER:VdWContact': 8, 'UNL:THR:VdWContact': 4, 'UNL:TYR:HBAcceptor': 4, 'UNL:TYR:Hydrophobic': 4, 'UNL:TYR:VdWContact': 4, 'UNL:VAL:VdWContact': 4}","{'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBAcceptor': 4, 'UNL:ASN:VdWContact': 8, 'UNL:ASP:VdWContact': 4, 'UNL:GLN:HBAcceptor': 12, 'UNL:GLN:VdWContact': 24, 'UNL:GLY:HBAcceptor': 24, 'UNL:GLY:VdWContact': 28, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:HBAcceptor': 8, 'UNL:LYS:VdWContact': 8, 'UNL:SER:HBAcceptor': 16, 'UNL:SER:VdWContact': 32}"
+15,DiffDock-L,T1146,0.5,0.4285714285714286,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1}"
+16,DiffDock-L,T1186,0.3333333333333333,0.5,"{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 3, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 4, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+17,DiffDock-L,T1187,2.0,1.2,"{'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 4, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:HBAcceptor': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PRO:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:VdWContact': 4}","{'UNL:ALA:HBAcceptor': 4, 'UNL:ALA:VdWContact': 4, 'UNL:ASP:VdWContact': 4, 'UNL:LYS:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:HBAcceptor': 8, 'UNL:TRP:VdWContact': 8, 'UNL:VAL:VdWContact': 2}"
+18,DiffDock-L,T1127v2,5.0,3.125,"{'UNL:ALA:Hydrophobic': 5, 'UNL:ALA:VdWContact': 5, 'UNL:ARG:HBAcceptor': 10, 'UNL:ARG:Hydrophobic': 5, 'UNL:ARG:VdWContact': 20, 'UNL:GLN:HBAcceptor': 5, 'UNL:GLN:Hydrophobic': 5, 'UNL:GLN:VdWContact': 5, 'UNL:GLU:VdWContact': 15, 'UNL:GLY:HBAcceptor': 10, 'UNL:GLY:HBDonor': 5, 'UNL:GLY:VdWContact': 10, 'UNL:ILE:HBAcceptor': 5, 'UNL:ILE:Hydrophobic': 15, 'UNL:ILE:VdWContact': 15, 'UNL:LEU:Hydrophobic': 10, 'UNL:LEU:VdWContact': 10, 'UNL:LYS:VdWContact': 5, 'UNL:MET:Hydrophobic': 15, 'UNL:MET:VdWContact': 15, 'UNL:PHE:HBDonor': 5, 'UNL:PHE:Hydrophobic': 5, 'UNL:PHE:VdWContact': 20, 'UNL:TRP:Hydrophobic': 10, 'UNL:TRP:VdWContact': 10, 'UNL:TYR:VdWContact': 5}","{'UNL:ALA:VdWContact': 5, 'UNL:ARG:HBAcceptor': 30, 'UNL:ARG:VdWContact': 35, 'UNL:ASN:HBAcceptor': 10, 'UNL:ASN:Hydrophobic': 10, 'UNL:ASN:VdWContact': 25, 'UNL:ASP:VdWContact': 5, 'UNL:GLN:VdWContact': 10, 'UNL:GLU:VdWContact': 20, 'UNL:GLY:HBAcceptor': 20, 'UNL:GLY:VdWContact': 20, 'UNL:ILE:HBAcceptor': 5, 'UNL:ILE:VdWContact': 5, 'UNL:LEU:VdWContact': 10, 'UNL:LYS:HBAcceptor': 10, 'UNL:LYS:VdWContact': 10, 'UNL:MET:HBAcceptor': 10, 'UNL:MET:VdWContact': 15, 'UNL:PHE:VdWContact': 20, 'UNL:TRP:VdWContact': 5, 'UNL:VAL:HBAcceptor': 5, 'UNL:VAL:VdWContact': 5}"
+19,DiffDock-L,T1124,2.0000000000000004,2.1666666666666665,"{'UNL:ALA:VdWContact': 4, 'UNL:ASN:HBAcceptor': 4, 'UNL:ASN:Hydrophobic': 4, 'UNL:ASN:VdWContact': 4, 'UNL:ASP:HBDonor': 8, 'UNL:ASP:Hydrophobic': 4, 'UNL:ASP:VdWContact': 8, 'UNL:CYS:VdWContact': 4, 'UNL:GLY:VdWContact': 8, 'UNL:ILE:Hydrophobic': 8, 'UNL:ILE:VdWContact': 12, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 4, 'UNL:PHE:HBAcceptor': 4, 'UNL:PHE:Hydrophobic': 8, 'UNL:PHE:VdWContact': 8, 'UNL:PRO:Hydrophobic': 4, 'UNL:PRO:VdWContact': 4, 'UNL:SER:HBAcceptor': 4, 'UNL:SER:HBDonor': 4, 'UNL:SER:VdWContact': 4, 'UNL:TRP:Hydrophobic': 8, 'UNL:TRP:VdWContact': 12, 'UNL:TYR:Hydrophobic': 8, 'UNL:TYR:VdWContact': 12, 'UNL:VAL:Hydrophobic': 8, 'UNL:VAL:VdWContact': 4}","{'UNL:ALA:VdWContact': 8, 'UNL:ASN:HBAcceptor': 8, 'UNL:ASN:VdWContact': 8, 'UNL:ASP:VdWContact': 16, 'UNL:GLY:VdWContact': 8, 'UNL:HIS:HBAcceptor': 4, 'UNL:HIS:VdWContact': 8, 'UNL:ILE:Hydrophobic': 8, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 8, 'UNL:LYS:VdWContact': 8, 'UNL:PHE:HBAcceptor': 8, 'UNL:PHE:Hydrophobic': 8, 'UNL:PHE:VdWContact': 8, 'UNL:SER:VdWContact': 8, 'UNL:TYR:Hydrophobic': 8, 'UNL:TYR:VdWContact': 20, 'UNL:VAL:Hydrophobic': 8, 'UNL:VAL:VdWContact': 4}"
+20,DynamicBind,H1171v2,21.600000000000005,22.0,"{'UNL:ALA:VdWContact': 9, 'UNL:ARG:HBAcceptor': 9, 'UNL:ARG:Hydrophobic': 18, 'UNL:ARG:VdWContact': 45, 'UNL:ASP:Hydrophobic': 9, 'UNL:ASP:VdWContact': 9, 'UNL:GLU:HBAcceptor': 9, 'UNL:GLU:HBDonor': 9, 'UNL:GLU:Hydrophobic': 9, 'UNL:GLU:VdWContact': 27, 'UNL:GLY:HBAcceptor': 36, 'UNL:GLY:HBDonor': 9, 'UNL:GLY:VdWContact': 36, 'UNL:ILE:Hydrophobic': 18, 'UNL:LEU:HBAcceptor': 9, 'UNL:LEU:HBDonor': 9, 'UNL:LEU:VdWContact': 18, 'UNL:LYS:VdWContact': 18, 'UNL:PRO:Hydrophobic': 18, 'UNL:PRO:VdWContact': 18, 'UNL:THR:HBAcceptor': 27, 'UNL:THR:VdWContact': 36, 'UNL:TYR:HBDonor': 9, 'UNL:TYR:Hydrophobic': 18, 'UNL:TYR:VdWContact': 18}","{'UNL:ARG:HBAcceptor': 72, 'UNL:ARG:VdWContact': 81, 'UNL:GLY:HBAcceptor': 72, 'UNL:GLY:VdWContact': 81, 'UNL:ILE:VdWContact': 36, 'UNL:LEU:VdWContact': 27, 'UNL:LYS:HBAcceptor': 45, 'UNL:LYS:VdWContact': 54, 'UNL:PRO:Hydrophobic': 27, 'UNL:PRO:VdWContact': 45, 'UNL:THR:HBAcceptor': 63, 'UNL:THR:Hydrophobic': 9, 'UNL:THR:VdWContact': 162}"
+21,DynamicBind,T1158v2,0.6666666666666667,0.4615384615384616,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1}"
+22,DynamicBind,H1171v1,34.57142857142857,27.500000000000004,"{'UNL:ALA:VdWContact': 11, 'UNL:ARG:HBAcceptor': 22, 'UNL:ARG:Hydrophobic': 22, 'UNL:ARG:VdWContact': 44, 'UNL:ASP:Hydrophobic': 11, 'UNL:ASP:VdWContact': 11, 'UNL:GLU:HBDonor': 11, 'UNL:GLU:Hydrophobic': 11, 'UNL:GLU:VdWContact': 33, 'UNL:GLY:HBAcceptor': 55, 'UNL:GLY:HBDonor': 11, 'UNL:GLY:VdWContact': 55, 'UNL:ILE:Hydrophobic': 22, 'UNL:LEU:HBDonor': 22, 'UNL:LEU:VdWContact': 22, 'UNL:LYS:VdWContact': 22, 'UNL:PRO:Hydrophobic': 22, 'UNL:PRO:VdWContact': 22, 'UNL:THR:HBAcceptor': 22, 'UNL:THR:VdWContact': 33, 'UNL:TYR:Hydrophobic': 44, 'UNL:TYR:VdWContact': 22}","{'UNL:ARG:HBAcceptor': 110, 'UNL:ARG:VdWContact': 99, 'UNL:ASN:VdWContact': 11, 'UNL:ASP:VdWContact': 22, 'UNL:GLY:HBAcceptor': 99, 'UNL:GLY:VdWContact': 121, 'UNL:ILE:VdWContact': 55, 'UNL:LEU:VdWContact': 11, 'UNL:LYS:HBAcceptor': 44, 'UNL:LYS:VdWContact': 44, 'UNL:PRO:Hydrophobic': 44, 'UNL:PRO:VdWContact': 55, 'UNL:THR:HBAcceptor': 88, 'UNL:THR:VdWContact': 231, 'UNL:TYR:VdWContact': 11}"
+23,DynamicBind,H1172v1,18.0,20.399999999999995,"{'UNL:ARG:HBAcceptor': 18, 'UNL:ARG:VdWContact': 36, 'UNL:ASP:VdWContact': 9, 'UNL:GLU:Hydrophobic': 9, 'UNL:GLU:VdWContact': 18, 'UNL:GLY:HBAcceptor': 36, 'UNL:GLY:HBDonor': 9, 'UNL:GLY:VdWContact': 36, 'UNL:ILE:HBDonor': 9, 'UNL:ILE:Hydrophobic': 18, 'UNL:ILE:VdWContact': 9, 'UNL:LEU:HBAcceptor': 9, 'UNL:LEU:HBDonor': 9, 'UNL:LEU:VdWContact': 18, 'UNL:LYS:HBAcceptor': 9, 'UNL:LYS:VdWContact': 18, 'UNL:PRO:Hydrophobic': 36, 'UNL:PRO:VdWContact': 27, 'UNL:THR:HBAcceptor': 18, 'UNL:THR:Hydrophobic': 9, 'UNL:THR:VdWContact': 45, 'UNL:TYR:HBDonor': 9, 'UNL:TYR:Hydrophobic': 27, 'UNL:TYR:VdWContact': 36}","{'UNL:ARG:HBAcceptor': 54, 'UNL:ARG:VdWContact': 63, 'UNL:GLY:HBAcceptor': 63, 'UNL:GLY:VdWContact': 90, 'UNL:ILE:VdWContact': 54, 'UNL:LEU:VdWContact': 18, 'UNL:LYS:HBAcceptor': 36, 'UNL:LYS:VdWContact': 36, 'UNL:PRO:Hydrophobic': 18, 'UNL:PRO:VdWContact': 45, 'UNL:THR:HBAcceptor': 72, 'UNL:THR:VdWContact': 144, 'UNL:TYR:HBAcceptor': 9, 'UNL:TYR:VdWContact': 9}"
+24,DynamicBind,T1158v4,5.5,4.571428571428572,"{'UNL:ALA:VdWContact': 4, 'UNL:ARG:VdWContact': 12, 'UNL:GLU:VdWContact': 4, 'UNL:GLY:HBAcceptor': 8, 'UNL:GLY:HBDonor': 4, 'UNL:GLY:VdWContact': 12, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:HBDonor': 4, 'UNL:LYS:VdWContact': 8, 'UNL:PHE:VdWContact': 4, 'UNL:SER:VdWContact': 8, 'UNL:THR:VdWContact': 4, 'UNL:TRP:VdWContact': 4, 'UNL:VAL:HBDonor': 4, 'UNL:VAL:VdWContact': 8}","{'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBAcceptor': 4, 'UNL:ASN:VdWContact': 8, 'UNL:ASP:VdWContact': 4, 'UNL:GLN:HBAcceptor': 12, 'UNL:GLN:VdWContact': 24, 'UNL:GLY:HBAcceptor': 24, 'UNL:GLY:VdWContact': 28, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:HBAcceptor': 8, 'UNL:LYS:VdWContact': 8, 'UNL:SER:HBAcceptor': 16, 'UNL:SER:VdWContact': 32}"
+25,DynamicBind,H1172v4,19.800000000000004,13.28571428571429,"{'UNL:ALA:Hydrophobic': 9, 'UNL:ARG:HBAcceptor': 9, 'UNL:ARG:HBDonor': 9, 'UNL:ARG:Hydrophobic': 18, 'UNL:ARG:VdWContact': 54, 'UNL:ASN:Hydrophobic': 9, 'UNL:ASN:VdWContact': 9, 'UNL:ASP:Hydrophobic': 9, 'UNL:ASP:VdWContact': 9, 'UNL:GLU:HBAcceptor': 9, 'UNL:GLU:HBDonor': 9, 'UNL:GLU:Hydrophobic': 9, 'UNL:GLU:VdWContact': 18, 'UNL:GLY:HBAcceptor': 36, 'UNL:GLY:VdWContact': 36, 'UNL:ILE:HBDonor': 9, 'UNL:ILE:Hydrophobic': 18, 'UNL:ILE:VdWContact': 9, 'UNL:LEU:VdWContact': 27, 'UNL:LYS:VdWContact': 27, 'UNL:PRO:Hydrophobic': 36, 'UNL:PRO:VdWContact': 18, 'UNL:SER:VdWContact': 9, 'UNL:THR:HBAcceptor': 54, 'UNL:THR:Hydrophobic': 9, 'UNL:THR:VdWContact': 63, 'UNL:TYR:HBDonor': 9, 'UNL:TYR:Hydrophobic': 36, 'UNL:TYR:VdWContact': 36}","{'UNL:ARG:HBAcceptor': 63, 'UNL:ARG:VdWContact': 63, 'UNL:GLY:HBAcceptor': 99, 'UNL:GLY:VdWContact': 81, 'UNL:ILE:VdWContact': 45, 'UNL:LEU:HBAcceptor': 9, 'UNL:LEU:VdWContact': 27, 'UNL:LYS:HBAcceptor': 45, 'UNL:LYS:VdWContact': 45, 'UNL:PRO:Hydrophobic': 27, 'UNL:PRO:VdWContact': 36, 'UNL:THR:HBAcceptor': 72, 'UNL:THR:VdWContact': 135, 'UNL:TYR:VdWContact': 18}"
+26,DynamicBind,H1172v2,25.714285714285715,17.4375,"{'UNL:ARG:HBAcceptor': 18, 'UNL:ARG:Hydrophobic': 18, 'UNL:ARG:VdWContact': 63, 'UNL:ASP:VdWContact': 18, 'UNL:GLU:VdWContact': 18, 'UNL:GLY:HBAcceptor': 18, 'UNL:GLY:VdWContact': 36, 'UNL:ILE:HBDonor': 9, 'UNL:ILE:Hydrophobic': 9, 'UNL:ILE:VdWContact': 18, 'UNL:LEU:HBDonor': 9, 'UNL:LEU:VdWContact': 18, 'UNL:LYS:VdWContact': 18, 'UNL:PHE:VdWContact': 9, 'UNL:PRO:Hydrophobic': 36, 'UNL:PRO:VdWContact': 27, 'UNL:THR:HBAcceptor': 27, 'UNL:THR:Hydrophobic': 18, 'UNL:THR:VdWContact': 54, 'UNL:TYR:HBDonor': 9, 'UNL:TYR:Hydrophobic': 18, 'UNL:TYR:VdWContact': 18}","{'UNL:ARG:HBAcceptor': 63, 'UNL:ARG:VdWContact': 63, 'UNL:GLY:HBAcceptor': 72, 'UNL:GLY:VdWContact': 81, 'UNL:ILE:VdWContact': 45, 'UNL:LEU:VdWContact': 9, 'UNL:LYS:HBAcceptor': 27, 'UNL:LYS:VdWContact': 45, 'UNL:PRO:Hydrophobic': 18, 'UNL:PRO:VdWContact': 27, 'UNL:THR:HBAcceptor': 72, 'UNL:THR:VdWContact': 135, 'UNL:TYR:VdWContact': 18}"
+27,DynamicBind,T1186,0.75,0.7,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 3, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 3, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 4, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+28,DynamicBind,T1187,2.666666666666667,1.2857142857142856,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 4, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:TRP:HBAcceptor': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 4, 'UNL:ALA:VdWContact': 4, 'UNL:ASP:VdWContact': 4, 'UNL:LYS:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:HBAcceptor': 8, 'UNL:TRP:VdWContact': 8, 'UNL:VAL:VdWContact': 2}"
+29,DynamicBind,T1127v2,5.454545454545454,2.115384615384616,"{'UNL:ARG:HBAcceptor': 5, 'UNL:ARG:HBDonor': 5, 'UNL:ARG:Hydrophobic': 5, 'UNL:ARG:VdWContact': 15, 'UNL:ASP:Hydrophobic': 5, 'UNL:ASP:VdWContact': 5, 'UNL:GLU:HBDonor': 10, 'UNL:GLU:Hydrophobic': 20, 'UNL:GLU:VdWContact': 20, 'UNL:ILE:Hydrophobic': 10, 'UNL:ILE:VdWContact': 15, 'UNL:LEU:Hydrophobic': 15, 'UNL:LEU:VdWContact': 25, 'UNL:MET:Hydrophobic': 5, 'UNL:MET:VdWContact': 5, 'UNL:PHE:Hydrophobic': 5, 'UNL:PHE:VdWContact': 5, 'UNL:SER:VdWContact': 5, 'UNL:TRP:HBAcceptor': 5, 'UNL:TRP:Hydrophobic': 10, 'UNL:TRP:VdWContact': 15, 'UNL:TYR:HBAcceptor': 5, 'UNL:TYR:Hydrophobic': 10, 'UNL:TYR:VdWContact': 10}","{'UNL:ALA:VdWContact': 5, 'UNL:ARG:HBAcceptor': 30, 'UNL:ARG:VdWContact': 35, 'UNL:ASN:HBAcceptor': 10, 'UNL:ASN:Hydrophobic': 10, 'UNL:ASN:VdWContact': 25, 'UNL:ASP:VdWContact': 5, 'UNL:GLN:VdWContact': 10, 'UNL:GLU:VdWContact': 20, 'UNL:GLY:HBAcceptor': 20, 'UNL:GLY:VdWContact': 20, 'UNL:ILE:HBAcceptor': 5, 'UNL:ILE:VdWContact': 5, 'UNL:LEU:VdWContact': 10, 'UNL:LYS:HBAcceptor': 10, 'UNL:LYS:VdWContact': 10, 'UNL:MET:HBAcceptor': 10, 'UNL:MET:VdWContact': 15, 'UNL:PHE:VdWContact': 20, 'UNL:TRP:VdWContact': 5, 'UNL:VAL:HBAcceptor': 5, 'UNL:VAL:VdWContact': 5}"
+30,DynamicBind,H1172v3,18.666666666666668,14.588235294117649,"{'UNL:ARG:HBAcceptor': 8, 'UNL:ARG:Hydrophobic': 16, 'UNL:ARG:VdWContact': 40, 'UNL:ASP:VdWContact': 16, 'UNL:GLU:Hydrophobic': 8, 'UNL:GLU:VdWContact': 24, 'UNL:GLY:HBAcceptor': 32, 'UNL:GLY:HBDonor': 8, 'UNL:GLY:VdWContact': 40, 'UNL:ILE:HBDonor': 8, 'UNL:ILE:Hydrophobic': 16, 'UNL:ILE:VdWContact': 8, 'UNL:LEU:HBDonor': 8, 'UNL:LEU:VdWContact': 24, 'UNL:LYS:HBAcceptor': 16, 'UNL:LYS:HBDonor': 8, 'UNL:LYS:Hydrophobic': 8, 'UNL:LYS:VdWContact': 16, 'UNL:PRO:Hydrophobic': 56, 'UNL:PRO:VdWContact': 48, 'UNL:THR:HBAcceptor': 24, 'UNL:THR:Hydrophobic': 24, 'UNL:THR:VdWContact': 40, 'UNL:TYR:HBDonor': 16, 'UNL:TYR:Hydrophobic': 32, 'UNL:TYR:VdWContact': 24}","{'UNL:ARG:HBAcceptor': 56, 'UNL:ARG:VdWContact': 64, 'UNL:GLY:HBAcceptor': 64, 'UNL:GLY:VdWContact': 72, 'UNL:ILE:VdWContact': 32, 'UNL:LEU:VdWContact': 24, 'UNL:LYS:HBAcceptor': 40, 'UNL:LYS:VdWContact': 48, 'UNL:PRO:Hydrophobic': 16, 'UNL:PRO:VdWContact': 24, 'UNL:THR:HBAcceptor': 56, 'UNL:THR:VdWContact': 88}"
+31,NeuralPLexer,H1171v2,22.0,21.315789473684212,"{'UNL:ALA:Hydrophobic': 18, 'UNL:ALA:VdWContact': 9, 'UNL:ARG:HBDonor': 18, 'UNL:ARG:Hydrophobic': 36, 'UNL:ARG:VdWContact': 117, 'UNL:ASN:HBAcceptor': 27, 'UNL:ASN:HBDonor': 27, 'UNL:ASN:VdWContact': 36, 'UNL:GLU:HBDonor': 18, 'UNL:GLU:VdWContact': 18, 'UNL:GLY:HBAcceptor': 27, 'UNL:GLY:VdWContact': 90, 'UNL:ILE:Hydrophobic': 45, 'UNL:ILE:VdWContact': 36, 'UNL:LEU:Hydrophobic': 18, 'UNL:LEU:VdWContact': 90, 'UNL:LYS:HBAcceptor': 27, 'UNL:LYS:Hydrophobic': 9, 'UNL:LYS:VdWContact': 45, 'UNL:PRO:Hydrophobic': 63, 'UNL:PRO:VdWContact': 63, 'UNL:THR:HBAcceptor': 9, 'UNL:THR:VdWContact': 81, 'UNL:TYR:HBAcceptor': 9, 'UNL:TYR:Hydrophobic': 27, 'UNL:TYR:VdWContact': 36}","{'UNL:ARG:HBAcceptor': 72, 'UNL:ARG:VdWContact': 81, 'UNL:GLY:HBAcceptor': 72, 'UNL:GLY:VdWContact': 81, 'UNL:ILE:VdWContact': 36, 'UNL:LEU:VdWContact': 27, 'UNL:LYS:HBAcceptor': 45, 'UNL:LYS:VdWContact': 54, 'UNL:PRO:Hydrophobic': 27, 'UNL:PRO:VdWContact': 45, 'UNL:THR:HBAcceptor': 63, 'UNL:THR:Hydrophobic': 9, 'UNL:THR:VdWContact': 162}"
+32,NeuralPLexer,T1158v2,1.0,0.6153846153846154,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1}"
+33,NeuralPLexer,T1152,524.6999999999999,1606.5555555555557,"{'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:VdWContact': 384, 'UNL:ASN:HBAcceptor': 1152, 'UNL:ASN:VdWContact': 3584, 'UNL:ASP:VdWContact': 1536, 'UNL:GLN:HBAcceptor': 896, 'UNL:GLN:VdWContact': 2560, 'UNL:GLU:HBAcceptor': 128, 'UNL:GLU:VdWContact': 896, 'UNL:GLY:HBAcceptor': 640, 'UNL:GLY:VdWContact': 1920, 'UNL:ILE:HBAcceptor': 512, 'UNL:ILE:VdWContact': 3072, 'UNL:LEU:VdWContact': 1280, 'UNL:LYS:HBAcceptor': 512, 'UNL:LYS:VdWContact': 4224, 'UNL:MET:VdWContact': 1280, 'UNL:PRO:VdWContact': 2432, 'UNL:SER:HBAcceptor': 128, 'UNL:SER:VdWContact': 512, 'UNL:THR:HBAcceptor': 768, 'UNL:THR:VdWContact': 2048, 'UNL:TRP:HBAcceptor': 512, 'UNL:TRP:VdWContact': 768, 'UNL:TYR:VdWContact': 1024, 'UNL:VAL:VdWContact': 1408}"
+34,NeuralPLexer,T1158v1,1.3333333333333335,0.6666666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2}"
+35,NeuralPLexer,H1171v1,25.666666666666664,22.550000000000004,"{'UNL:ALA:Hydrophobic': 11, 'UNL:ARG:HBDonor': 22, 'UNL:ARG:Hydrophobic': 33, 'UNL:ARG:VdWContact': 121, 'UNL:ASN:HBAcceptor': 44, 'UNL:ASN:Hydrophobic': 22, 'UNL:ASN:VdWContact': 55, 'UNL:ASP:VdWContact': 11, 'UNL:GLU:HBDonor': 22, 'UNL:GLU:VdWContact': 22, 'UNL:GLY:VdWContact': 99, 'UNL:ILE:Hydrophobic': 33, 'UNL:ILE:VdWContact': 33, 'UNL:LEU:HBAcceptor': 11, 'UNL:LEU:HBDonor': 11, 'UNL:LEU:Hydrophobic': 11, 'UNL:LEU:VdWContact': 77, 'UNL:LYS:HBAcceptor': 22, 'UNL:LYS:Hydrophobic': 33, 'UNL:LYS:VdWContact': 55, 'UNL:MET:HBAcceptor': 11, 'UNL:MET:VdWContact': 22, 'UNL:PRO:HBDonor': 11, 'UNL:PRO:Hydrophobic': 44, 'UNL:PRO:VdWContact': 44, 'UNL:THR:HBAcceptor': 22, 'UNL:THR:VdWContact': 132, 'UNL:TYR:HBDonor': 11, 'UNL:TYR:Hydrophobic': 44, 'UNL:TYR:VdWContact': 55}","{'UNL:ARG:HBAcceptor': 110, 'UNL:ARG:VdWContact': 99, 'UNL:ASN:VdWContact': 11, 'UNL:ASP:VdWContact': 22, 'UNL:GLY:HBAcceptor': 99, 'UNL:GLY:VdWContact': 121, 'UNL:ILE:VdWContact': 55, 'UNL:LEU:VdWContact': 11, 'UNL:LYS:HBAcceptor': 44, 'UNL:LYS:VdWContact': 44, 'UNL:PRO:Hydrophobic': 44, 'UNL:PRO:VdWContact': 55, 'UNL:THR:HBAcceptor': 88, 'UNL:THR:VdWContact': 231, 'UNL:TYR:VdWContact': 11}"
+36,NeuralPLexer,H1172v1,15.0,30.705882352941178,"{'UNL:ALA:Hydrophobic': 9, 'UNL:ALA:VdWContact': 9, 'UNL:ARG:HBDonor': 36, 'UNL:ARG:Hydrophobic': 18, 'UNL:ARG:VdWContact': 99, 'UNL:ASN:HBAcceptor': 18, 'UNL:ASN:HBDonor': 18, 'UNL:ASN:VdWContact': 54, 'UNL:GLU:HBDonor': 18, 'UNL:GLU:VdWContact': 18, 'UNL:GLY:HBAcceptor': 36, 'UNL:GLY:VdWContact': 99, 'UNL:ILE:Hydrophobic': 63, 'UNL:ILE:VdWContact': 54, 'UNL:LEU:HBAcceptor': 9, 'UNL:LEU:VdWContact': 99, 'UNL:LYS:HBAcceptor': 27, 'UNL:LYS:Hydrophobic': 18, 'UNL:LYS:VdWContact': 54, 'UNL:MET:HBAcceptor': 9, 'UNL:PRO:HBDonor': 9, 'UNL:PRO:Hydrophobic': 81, 'UNL:PRO:VdWContact': 81, 'UNL:THR:HBAcceptor': 18, 'UNL:THR:VdWContact': 81, 'UNL:TYR:Hydrophobic': 45, 'UNL:TYR:VdWContact': 27}","{'UNL:ARG:HBAcceptor': 54, 'UNL:ARG:VdWContact': 63, 'UNL:GLY:HBAcceptor': 63, 'UNL:GLY:VdWContact': 90, 'UNL:ILE:VdWContact': 54, 'UNL:LEU:VdWContact': 18, 'UNL:LYS:HBAcceptor': 36, 'UNL:LYS:VdWContact': 36, 'UNL:PRO:Hydrophobic': 18, 'UNL:PRO:VdWContact': 45, 'UNL:THR:HBAcceptor': 72, 'UNL:THR:VdWContact': 144, 'UNL:TYR:HBAcceptor': 9, 'UNL:TYR:VdWContact': 9}"
+37,NeuralPLexer,T1158v4,4.571428571428571,3.9999999999999996,"{'UNL:ASP:HBDonor': 4, 'UNL:ASP:Hydrophobic': 4, 'UNL:ASP:VdWContact': 4, 'UNL:GLY:HBAcceptor': 12, 'UNL:GLY:VdWContact': 16, 'UNL:LYS:HBAcceptor': 4, 'UNL:LYS:VdWContact': 8, 'UNL:SER:HBAcceptor': 8, 'UNL:SER:VdWContact': 16, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 4, 'UNL:TYR:HBAcceptor': 4, 'UNL:TYR:Hydrophobic': 4, 'UNL:TYR:VdWContact': 4, 'UNL:VAL:VdWContact': 8}","{'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBAcceptor': 4, 'UNL:ASN:VdWContact': 8, 'UNL:ASP:VdWContact': 4, 'UNL:GLN:HBAcceptor': 12, 'UNL:GLN:VdWContact': 24, 'UNL:GLY:HBAcceptor': 24, 'UNL:GLY:VdWContact': 28, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:HBAcceptor': 8, 'UNL:LYS:VdWContact': 8, 'UNL:SER:HBAcceptor': 16, 'UNL:SER:VdWContact': 32}"
+38,NeuralPLexer,H1172v4,19.5,18.473684210526315,"{'UNL:ALA:Hydrophobic': 9, 'UNL:ALA:VdWContact': 9, 'UNL:ARG:HBDonor': 27, 'UNL:ARG:Hydrophobic': 18, 'UNL:ARG:VdWContact': 126, 'UNL:ASN:HBAcceptor': 27, 'UNL:ASN:HBDonor': 9, 'UNL:ASN:VdWContact': 27, 'UNL:ASP:VdWContact': 9, 'UNL:GLU:HBDonor': 27, 'UNL:GLU:VdWContact': 27, 'UNL:GLY:HBAcceptor': 9, 'UNL:GLY:VdWContact': 90, 'UNL:ILE:Hydrophobic': 27, 'UNL:ILE:VdWContact': 9, 'UNL:LEU:HBAcceptor': 9, 'UNL:LEU:HBDonor': 9, 'UNL:LEU:Hydrophobic': 9, 'UNL:LEU:VdWContact': 81, 'UNL:LYS:HBAcceptor': 36, 'UNL:LYS:HBDonor': 9, 'UNL:LYS:Hydrophobic': 18, 'UNL:LYS:VdWContact': 45, 'UNL:PRO:HBDonor': 18, 'UNL:PRO:Hydrophobic': 54, 'UNL:PRO:VdWContact': 90, 'UNL:THR:HBAcceptor': 18, 'UNL:THR:VdWContact': 90, 'UNL:TYR:Hydrophobic': 45, 'UNL:TYR:VdWContact': 27}","{'UNL:ARG:HBAcceptor': 63, 'UNL:ARG:VdWContact': 63, 'UNL:GLY:HBAcceptor': 99, 'UNL:GLY:VdWContact': 81, 'UNL:ILE:VdWContact': 45, 'UNL:LEU:HBAcceptor': 9, 'UNL:LEU:VdWContact': 27, 'UNL:LYS:HBAcceptor': 45, 'UNL:LYS:VdWContact': 45, 'UNL:PRO:Hydrophobic': 27, 'UNL:PRO:VdWContact': 36, 'UNL:THR:HBAcceptor': 72, 'UNL:THR:VdWContact': 135, 'UNL:TYR:VdWContact': 18}"
+39,NeuralPLexer,T1146,0.0,0.4444444444444445,"{'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1}"
+40,NeuralPLexer,H1172v2,13.909090909090907,23.57142857142857,"{'UNL:ALA:Hydrophobic': 9, 'UNL:ALA:VdWContact': 9, 'UNL:ARG:HBDonor': 27, 'UNL:ARG:Hydrophobic': 27, 'UNL:ARG:VdWContact': 90, 'UNL:ASN:HBAcceptor': 54, 'UNL:ASN:HBDonor': 27, 'UNL:ASN:VdWContact': 63, 'UNL:ASP:VdWContact': 9, 'UNL:GLU:HBDonor': 27, 'UNL:GLU:VdWContact': 27, 'UNL:GLY:HBAcceptor': 9, 'UNL:GLY:HBDonor': 9, 'UNL:GLY:VdWContact': 99, 'UNL:ILE:Hydrophobic': 45, 'UNL:ILE:VdWContact': 45, 'UNL:LEU:Hydrophobic': 9, 'UNL:LEU:VdWContact': 54, 'UNL:LYS:HBAcceptor': 9, 'UNL:LYS:Hydrophobic': 9, 'UNL:LYS:VdWContact': 54, 'UNL:MET:HBAcceptor': 9, 'UNL:MET:Hydrophobic': 9, 'UNL:MET:VdWContact': 18, 'UNL:PRO:HBDonor': 9, 'UNL:PRO:Hydrophobic': 63, 'UNL:PRO:VdWContact': 81, 'UNL:THR:HBAcceptor': 9, 'UNL:THR:VdWContact': 117, 'UNL:TYR:Hydrophobic': 36, 'UNL:TYR:VdWContact': 27}","{'UNL:ARG:HBAcceptor': 63, 'UNL:ARG:VdWContact': 63, 'UNL:GLY:HBAcceptor': 72, 'UNL:GLY:VdWContact': 81, 'UNL:ILE:VdWContact': 45, 'UNL:LEU:VdWContact': 9, 'UNL:LYS:HBAcceptor': 27, 'UNL:LYS:VdWContact': 45, 'UNL:PRO:Hydrophobic': 18, 'UNL:PRO:VdWContact': 27, 'UNL:THR:HBAcceptor': 72, 'UNL:THR:VdWContact': 135, 'UNL:TYR:VdWContact': 18}"
+41,NeuralPLexer,T1186,1.0,0.375,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 3, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 4, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+42,NeuralPLexer,T1187,2.0,1.4444444444444446,"{'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 10, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:MET:VdWContact': 2, 'UNL:SER:HBDonor': 2, 'UNL:SER:VdWContact': 4, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 4, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 4, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 4, 'UNL:ALA:VdWContact': 4, 'UNL:ASP:VdWContact': 4, 'UNL:LYS:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:HBAcceptor': 8, 'UNL:TRP:VdWContact': 8, 'UNL:VAL:VdWContact': 2}"
+43,NeuralPLexer,T1127v2,2.727272727272727,3.571428571428572,"{'UNL:ALA:VdWContact': 5, 'UNL:ARG:HBAcceptor': 20, 'UNL:ARG:HBDonor': 5, 'UNL:ARG:Hydrophobic': 10, 'UNL:ARG:VdWContact': 25, 'UNL:ASN:HBDonor': 5, 'UNL:ASN:Hydrophobic': 10, 'UNL:ASN:VdWContact': 15, 'UNL:GLN:VdWContact': 15, 'UNL:GLU:VdWContact': 25, 'UNL:GLY:HBAcceptor': 10, 'UNL:GLY:HBDonor': 5, 'UNL:GLY:VdWContact': 20, 'UNL:ILE:VdWContact': 5, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 5, 'UNL:LYS:HBAcceptor': 10, 'UNL:LYS:HBDonor': 5, 'UNL:LYS:VdWContact': 10, 'UNL:MET:Hydrophobic': 10, 'UNL:MET:VdWContact': 10, 'UNL:PHE:Hydrophobic': 30, 'UNL:PHE:VdWContact': 40, 'UNL:TRP:Hydrophobic': 10, 'UNL:TRP:VdWContact': 10, 'UNL:TYR:VdWContact': 10, 'UNL:VAL:VdWContact': 5}","{'UNL:ALA:VdWContact': 5, 'UNL:ARG:HBAcceptor': 30, 'UNL:ARG:VdWContact': 35, 'UNL:ASN:HBAcceptor': 10, 'UNL:ASN:Hydrophobic': 10, 'UNL:ASN:VdWContact': 25, 'UNL:ASP:VdWContact': 5, 'UNL:GLN:VdWContact': 10, 'UNL:GLU:VdWContact': 20, 'UNL:GLY:HBAcceptor': 20, 'UNL:GLY:VdWContact': 20, 'UNL:ILE:HBAcceptor': 5, 'UNL:ILE:VdWContact': 5, 'UNL:LEU:VdWContact': 10, 'UNL:LYS:HBAcceptor': 10, 'UNL:LYS:VdWContact': 10, 'UNL:MET:HBAcceptor': 10, 'UNL:MET:VdWContact': 15, 'UNL:PHE:VdWContact': 20, 'UNL:TRP:VdWContact': 5, 'UNL:VAL:HBAcceptor': 5, 'UNL:VAL:VdWContact': 5}"
+44,NeuralPLexer,T1124,1.6,2.7692307692307696,"{'UNL:ALA:Hydrophobic': 4, 'UNL:ALA:VdWContact': 4, 'UNL:ASN:Hydrophobic': 8, 'UNL:ASN:VdWContact': 8, 'UNL:ASP:HBDonor': 4, 'UNL:ASP:Hydrophobic': 4, 'UNL:ASP:VdWContact': 16, 'UNL:CYS:VdWContact': 8, 'UNL:GLN:VdWContact': 4, 'UNL:GLY:VdWContact': 12, 'UNL:HIS:VdWContact': 4, 'UNL:ILE:Hydrophobic': 8, 'UNL:ILE:VdWContact': 4, 'UNL:LEU:Hydrophobic': 12, 'UNL:PHE:HBAcceptor': 4, 'UNL:PHE:Hydrophobic': 16, 'UNL:PHE:VdWContact': 24, 'UNL:PRO:Hydrophobic': 4, 'UNL:PRO:VdWContact': 4, 'UNL:TRP:Hydrophobic': 8, 'UNL:TRP:VdWContact': 16, 'UNL:TYR:HBAcceptor': 4, 'UNL:TYR:VdWContact': 24, 'UNL:VAL:Hydrophobic': 8}","{'UNL:ALA:VdWContact': 8, 'UNL:ASN:HBAcceptor': 8, 'UNL:ASN:VdWContact': 8, 'UNL:ASP:VdWContact': 16, 'UNL:GLY:VdWContact': 8, 'UNL:HIS:HBAcceptor': 4, 'UNL:HIS:VdWContact': 8, 'UNL:ILE:Hydrophobic': 8, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 8, 'UNL:LYS:VdWContact': 8, 'UNL:PHE:HBAcceptor': 8, 'UNL:PHE:Hydrophobic': 8, 'UNL:PHE:VdWContact': 8, 'UNL:SER:VdWContact': 8, 'UNL:TYR:Hydrophobic': 8, 'UNL:TYR:VdWContact': 20, 'UNL:VAL:Hydrophobic': 8, 'UNL:VAL:VdWContact': 4}"
+45,NeuralPLexer,H1172v3,18.909090909090907,25.71428571428572,"{'UNL:ARG:HBAcceptor': 8, 'UNL:ARG:HBDonor': 8, 'UNL:ARG:VdWContact': 88, 'UNL:ASN:HBAcceptor': 16, 'UNL:ASN:HBDonor': 8, 'UNL:ASN:VdWContact': 40, 'UNL:GLU:HBDonor': 16, 'UNL:GLU:VdWContact': 24, 'UNL:GLY:HBAcceptor': 24, 'UNL:GLY:VdWContact': 88, 'UNL:ILE:Hydrophobic': 48, 'UNL:ILE:VdWContact': 32, 'UNL:LEU:HBDonor': 8, 'UNL:LEU:VdWContact': 64, 'UNL:LYS:HBAcceptor': 16, 'UNL:LYS:Hydrophobic': 8, 'UNL:LYS:VdWContact': 32, 'UNL:PRO:HBDonor': 16, 'UNL:PRO:Hydrophobic': 64, 'UNL:PRO:VdWContact': 80, 'UNL:THR:HBAcceptor': 24, 'UNL:THR:HBDonor': 8, 'UNL:THR:VdWContact': 72, 'UNL:TYR:Hydrophobic': 48, 'UNL:TYR:VdWContact': 40}","{'UNL:ARG:HBAcceptor': 56, 'UNL:ARG:VdWContact': 64, 'UNL:GLY:HBAcceptor': 64, 'UNL:GLY:VdWContact': 72, 'UNL:ILE:VdWContact': 32, 'UNL:LEU:VdWContact': 24, 'UNL:LYS:HBAcceptor': 40, 'UNL:LYS:VdWContact': 48, 'UNL:PRO:Hydrophobic': 16, 'UNL:PRO:VdWContact': 24, 'UNL:THR:HBAcceptor': 56, 'UNL:THR:VdWContact': 88}"
+46,RFAA,T1158v2,0.49999999999999994,0.6428571428571429,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1}"
+47,RFAA,T1152,582.8888888888889,1807.3125,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 2}","{'UNL:ALA:VdWContact': 384, 'UNL:ASN:HBAcceptor': 1152, 'UNL:ASN:VdWContact': 3584, 'UNL:ASP:VdWContact': 1536, 'UNL:GLN:HBAcceptor': 896, 'UNL:GLN:VdWContact': 2560, 'UNL:GLU:HBAcceptor': 128, 'UNL:GLU:VdWContact': 896, 'UNL:GLY:HBAcceptor': 640, 'UNL:GLY:VdWContact': 1920, 'UNL:ILE:HBAcceptor': 512, 'UNL:ILE:VdWContact': 3072, 'UNL:LEU:VdWContact': 1280, 'UNL:LYS:HBAcceptor': 512, 'UNL:LYS:VdWContact': 4224, 'UNL:MET:VdWContact': 1280, 'UNL:PRO:VdWContact': 2432, 'UNL:SER:HBAcceptor': 128, 'UNL:SER:VdWContact': 512, 'UNL:THR:HBAcceptor': 768, 'UNL:THR:VdWContact': 2048, 'UNL:TRP:HBAcceptor': 512, 'UNL:TRP:VdWContact': 768, 'UNL:TYR:VdWContact': 1024, 'UNL:VAL:VdWContact': 1408}"
+48,RFAA,T1146,0.5,0.5999999999999999,"{'UNL:ALA:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1}"
+49,RFAA,T1187,2.5,2.0,"{'UNL:ALA:VdWContact': 2, 'UNL:ASP:VdWContact': 6, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 4, 'UNL:TRP:HBAcceptor': 2, 'UNL:TRP:HBDonor': 2, 'UNL:TRP:Hydrophobic': 6, 'UNL:TRP:VdWContact': 10, 'UNL:TYR:Hydrophobic': 4, 'UNL:TYR:VdWContact': 4, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 4, 'UNL:ALA:VdWContact': 4, 'UNL:ASP:VdWContact': 4, 'UNL:LYS:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:HBAcceptor': 8, 'UNL:TRP:VdWContact': 8, 'UNL:VAL:VdWContact': 2}"
+50,RFAA,T1127v2,4.0,3.125,"{'UNL:ALA:HBAcceptor': 5, 'UNL:ALA:HBDonor': 5, 'UNL:ALA:VdWContact': 10, 'UNL:ARG:HBDonor': 5, 'UNL:ARG:VdWContact': 20, 'UNL:ASN:VdWContact': 15, 'UNL:CYS:VdWContact': 5, 'UNL:GLN:VdWContact': 10, 'UNL:GLU:HBDonor': 10, 'UNL:GLU:VdWContact': 30, 'UNL:GLY:VdWContact': 5, 'UNL:HIS:VdWContact': 5, 'UNL:ILE:HBAcceptor': 5, 'UNL:ILE:HBDonor': 5, 'UNL:ILE:Hydrophobic': 5, 'UNL:ILE:VdWContact': 20, 'UNL:LEU:Hydrophobic': 10, 'UNL:LEU:VdWContact': 20, 'UNL:MET:HBAcceptor': 10, 'UNL:MET:VdWContact': 10, 'UNL:PHE:HBDonor': 5, 'UNL:PHE:Hydrophobic': 5, 'UNL:PHE:VdWContact': 25, 'UNL:THR:HBDonor': 5, 'UNL:THR:VdWContact': 5, 'UNL:TRP:Hydrophobic': 10, 'UNL:TRP:VdWContact': 15, 'UNL:TYR:HBDonor': 5, 'UNL:TYR:Hydrophobic': 15, 'UNL:TYR:VdWContact': 15, 'UNL:VAL:VdWContact': 10}","{'UNL:ALA:VdWContact': 5, 'UNL:ARG:HBAcceptor': 30, 'UNL:ARG:VdWContact': 35, 'UNL:ASN:HBAcceptor': 10, 'UNL:ASN:Hydrophobic': 10, 'UNL:ASN:VdWContact': 25, 'UNL:ASP:VdWContact': 5, 'UNL:GLN:VdWContact': 10, 'UNL:GLU:VdWContact': 20, 'UNL:GLY:HBAcceptor': 20, 'UNL:GLY:VdWContact': 20, 'UNL:ILE:HBAcceptor': 5, 'UNL:ILE:VdWContact': 5, 'UNL:LEU:VdWContact': 10, 'UNL:LYS:HBAcceptor': 10, 'UNL:LYS:VdWContact': 10, 'UNL:MET:HBAcceptor': 10, 'UNL:MET:VdWContact': 15, 'UNL:PHE:VdWContact': 20, 'UNL:TRP:VdWContact': 5, 'UNL:VAL:HBAcceptor': 5, 'UNL:VAL:VdWContact': 5}"
+51,Chai-1-Single-Seq,T1152,436.83333333333337,1521.2105263157894,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 5, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 384, 'UNL:ASN:HBAcceptor': 1152, 'UNL:ASN:VdWContact': 3584, 'UNL:ASP:VdWContact': 1536, 'UNL:GLN:HBAcceptor': 896, 'UNL:GLN:VdWContact': 2560, 'UNL:GLU:HBAcceptor': 128, 'UNL:GLU:VdWContact': 896, 'UNL:GLY:HBAcceptor': 640, 'UNL:GLY:VdWContact': 1920, 'UNL:ILE:HBAcceptor': 512, 'UNL:ILE:VdWContact': 3072, 'UNL:LEU:VdWContact': 1280, 'UNL:LYS:HBAcceptor': 512, 'UNL:LYS:VdWContact': 4224, 'UNL:MET:VdWContact': 1280, 'UNL:PRO:VdWContact': 2432, 'UNL:SER:HBAcceptor': 128, 'UNL:SER:VdWContact': 512, 'UNL:THR:HBAcceptor': 768, 'UNL:THR:VdWContact': 2048, 'UNL:TRP:HBAcceptor': 512, 'UNL:TRP:VdWContact': 768, 'UNL:TYR:VdWContact': 1024, 'UNL:VAL:VdWContact': 1408}"
+52,Chai-1-Single-Seq,T1158v4,2.0,4.266666666666667,"{'UNL:ALA:HBDonor': 4, 'UNL:ALA:VdWContact': 4, 'UNL:ASN:HBDonor': 4, 'UNL:ASN:VdWContact': 4, 'UNL:ASP:HBDonor': 4, 'UNL:ASP:VdWContact': 12, 'UNL:GLN:HBAcceptor': 12, 'UNL:GLN:HBDonor': 4, 'UNL:GLN:VdWContact': 12, 'UNL:GLY:HBAcceptor': 24, 'UNL:GLY:HBDonor': 4, 'UNL:GLY:VdWContact': 24, 'UNL:HIS:HBDonor': 4, 'UNL:HIS:VdWContact': 4, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:HBAcceptor': 8, 'UNL:LYS:VdWContact': 8, 'UNL:PHE:VdWContact': 4, 'UNL:SER:HBAcceptor': 16, 'UNL:SER:HBDonor': 4, 'UNL:SER:VdWContact': 28, 'UNL:THR:VdWContact': 12, 'UNL:TRP:VdWContact': 4, 'UNL:TYR:VdWContact': 4, 'UNL:VAL:VdWContact': 12}","{'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBAcceptor': 4, 'UNL:ASN:VdWContact': 8, 'UNL:ASP:VdWContact': 4, 'UNL:GLN:HBAcceptor': 12, 'UNL:GLN:VdWContact': 24, 'UNL:GLY:HBAcceptor': 24, 'UNL:GLY:VdWContact': 28, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:HBAcceptor': 8, 'UNL:LYS:VdWContact': 8, 'UNL:SER:HBAcceptor': 16, 'UNL:SER:VdWContact': 32}"
+53,Chai-1-Single-Seq,T1146,0.3333333333333333,1.076923076923077,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1}"
+54,Chai-1-Single-Seq,T1186,0.75,0.8571428571428572,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 3, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 4, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+55,Chai-1-Single-Seq,T1187,2.0,1.1764705882352944,"{'UNL:ALA:VdWContact': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 4, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:PHE:HBAcceptor': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 4, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 4, 'UNL:ALA:VdWContact': 4, 'UNL:ASP:VdWContact': 4, 'UNL:LYS:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:HBAcceptor': 8, 'UNL:TRP:VdWContact': 8, 'UNL:VAL:VdWContact': 2}"
+56,Chai-1-Single-Seq,T1127v2,4.6875,6.379310344827586,"{'UNL:ALA:HBAcceptor': 5, 'UNL:ALA:Hydrophobic': 10, 'UNL:ALA:VdWContact': 20, 'UNL:ARG:HBAcceptor': 5, 'UNL:ARG:VdWContact': 10, 'UNL:ASN:HBAcceptor': 5, 'UNL:ASN:Hydrophobic': 5, 'UNL:ASN:VdWContact': 5, 'UNL:ASP:VdWContact': 5, 'UNL:GLN:HBAcceptor': 5, 'UNL:GLN:HBDonor': 5, 'UNL:GLN:Hydrophobic': 5, 'UNL:GLN:VdWContact': 15, 'UNL:GLU:VdWContact': 5, 'UNL:GLY:HBAcceptor': 5, 'UNL:GLY:VdWContact': 10, 'UNL:ILE:HBDonor': 5, 'UNL:ILE:Hydrophobic': 5, 'UNL:ILE:VdWContact': 15, 'UNL:LEU:HBAcceptor': 5, 'UNL:LEU:HBDonor': 5, 'UNL:LEU:Hydrophobic': 25, 'UNL:LEU:VdWContact': 40, 'UNL:LYS:HBDonor': 5, 'UNL:LYS:VdWContact': 5, 'UNL:MET:Hydrophobic': 5, 'UNL:PHE:HBAcceptor': 5, 'UNL:PHE:Hydrophobic': 35, 'UNL:PHE:VdWContact': 50, 'UNL:PRO:Hydrophobic': 5, 'UNL:PRO:VdWContact': 15, 'UNL:SER:VdWContact': 15, 'UNL:THR:HBDonor': 10, 'UNL:THR:Hydrophobic': 5, 'UNL:THR:VdWContact': 15, 'UNL:TYR:Hydrophobic': 5, 'UNL:TYR:VdWContact': 10, 'UNL:VAL:Hydrophobic': 20, 'UNL:VAL:VdWContact': 25}","{'UNL:ALA:VdWContact': 5, 'UNL:ARG:HBAcceptor': 30, 'UNL:ARG:VdWContact': 35, 'UNL:ASN:HBAcceptor': 10, 'UNL:ASN:Hydrophobic': 10, 'UNL:ASN:VdWContact': 25, 'UNL:ASP:VdWContact': 5, 'UNL:GLN:VdWContact': 10, 'UNL:GLU:VdWContact': 20, 'UNL:GLY:HBAcceptor': 20, 'UNL:GLY:VdWContact': 20, 'UNL:ILE:HBAcceptor': 5, 'UNL:ILE:VdWContact': 5, 'UNL:LEU:VdWContact': 10, 'UNL:LYS:HBAcceptor': 10, 'UNL:LYS:VdWContact': 10, 'UNL:MET:HBAcceptor': 10, 'UNL:MET:VdWContact': 15, 'UNL:PHE:VdWContact': 20, 'UNL:TRP:VdWContact': 5, 'UNL:VAL:HBAcceptor': 5, 'UNL:VAL:VdWContact': 5}"
+57,Chai-1-Single-Seq,T1124,0.666666666666667,3.8260869565217397,"{'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 4, 'UNL:GLN:VdWContact': 4, 'UNL:HIS:VdWContact': 4, 'UNL:ILE:HBAcceptor': 4, 'UNL:ILE:VdWContact': 4, 'UNL:LEU:VdWContact': 4, 'UNL:PRO:Hydrophobic': 4, 'UNL:PRO:VdWContact': 4, 'UNL:SER:VdWContact': 4, 'UNL:THR:HBDonor': 8, 'UNL:THR:Hydrophobic': 4, 'UNL:THR:VdWContact': 12, 'UNL:TYR:HBDonor': 4, 'UNL:TYR:VdWContact': 4}","{'UNL:ALA:VdWContact': 8, 'UNL:ASN:HBAcceptor': 8, 'UNL:ASN:VdWContact': 8, 'UNL:ASP:VdWContact': 16, 'UNL:GLY:VdWContact': 8, 'UNL:HIS:HBAcceptor': 4, 'UNL:HIS:VdWContact': 8, 'UNL:ILE:Hydrophobic': 8, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 8, 'UNL:LYS:VdWContact': 8, 'UNL:PHE:HBAcceptor': 8, 'UNL:PHE:Hydrophobic': 8, 'UNL:PHE:VdWContact': 8, 'UNL:SER:VdWContact': 8, 'UNL:TYR:Hydrophobic': 8, 'UNL:TYR:VdWContact': 20, 'UNL:VAL:Hydrophobic': 8, 'UNL:VAL:VdWContact': 4}"
+58,Chai-1-Single-Seq,T1158v3,0.5,0.909090909090909,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}"
+59,Chai-1,T1152,476.9090909090909,1445.65,"{'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:VdWContact': 384, 'UNL:ASN:HBAcceptor': 1152, 'UNL:ASN:VdWContact': 3584, 'UNL:ASP:VdWContact': 1536, 'UNL:GLN:HBAcceptor': 896, 'UNL:GLN:VdWContact': 2560, 'UNL:GLU:HBAcceptor': 128, 'UNL:GLU:VdWContact': 896, 'UNL:GLY:HBAcceptor': 640, 'UNL:GLY:VdWContact': 1920, 'UNL:ILE:HBAcceptor': 512, 'UNL:ILE:VdWContact': 3072, 'UNL:LEU:VdWContact': 1280, 'UNL:LYS:HBAcceptor': 512, 'UNL:LYS:VdWContact': 4224, 'UNL:MET:VdWContact': 1280, 'UNL:PRO:VdWContact': 2432, 'UNL:SER:HBAcceptor': 128, 'UNL:SER:VdWContact': 512, 'UNL:THR:HBAcceptor': 768, 'UNL:THR:VdWContact': 2048, 'UNL:TRP:HBAcceptor': 512, 'UNL:TRP:VdWContact': 768, 'UNL:TYR:VdWContact': 1024, 'UNL:VAL:VdWContact': 1408}"
+60,Chai-1,T1158v1,0.25,0.5454545454545454,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2}"
+61,Chai-1,T1158v4,2.1818181818181817,1.846153846153846,"{'UNL:ASN:HBDonor': 4, 'UNL:ASN:VdWContact': 4, 'UNL:GLN:HBAcceptor': 8, 'UNL:GLN:VdWContact': 16, 'UNL:GLY:HBAcceptor': 24, 'UNL:GLY:HBDonor': 12, 'UNL:GLY:VdWContact': 32, 'UNL:HIS:HBAcceptor': 4, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:HBAcceptor': 8, 'UNL:LYS:HBDonor': 4, 'UNL:LYS:VdWContact': 8, 'UNL:PHE:VdWContact': 4, 'UNL:SER:HBAcceptor': 16, 'UNL:SER:HBDonor': 4, 'UNL:SER:VdWContact': 28, 'UNL:THR:VdWContact': 8, 'UNL:TRP:VdWContact': 4, 'UNL:TYR:VdWContact': 4, 'UNL:VAL:HBDonor': 4, 'UNL:VAL:VdWContact': 8}","{'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBAcceptor': 4, 'UNL:ASN:VdWContact': 8, 'UNL:ASP:VdWContact': 4, 'UNL:GLN:HBAcceptor': 12, 'UNL:GLN:VdWContact': 24, 'UNL:GLY:HBAcceptor': 24, 'UNL:GLY:VdWContact': 28, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:HBAcceptor': 8, 'UNL:LYS:VdWContact': 8, 'UNL:SER:HBAcceptor': 16, 'UNL:SER:VdWContact': 32}"
+62,Chai-1,T1146,0.5,0.75,"{'UNL:ALA:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1}"
+63,Chai-1,T1186,0.6666666666666667,0.8095238095238094,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 4, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 3, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 4, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+64,Chai-1,T1187,2.0,1.25,"{'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 4, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:HBAcceptor': 2, 'UNL:LYS:Hydrophobic': 4, 'UNL:LYS:VdWContact': 10, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 6, 'UNL:THR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 4, 'UNL:ALA:VdWContact': 4, 'UNL:ASP:VdWContact': 4, 'UNL:LYS:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:HBAcceptor': 8, 'UNL:TRP:VdWContact': 8, 'UNL:VAL:VdWContact': 2}"
+65,Chai-1,T1127v2,4.23076923076923,2.678571428571429,"{'UNL:ALA:HBDonor': 5, 'UNL:ALA:Hydrophobic': 5, 'UNL:ALA:VdWContact': 5, 'UNL:ARG:HBDonor': 10, 'UNL:ARG:Hydrophobic': 10, 'UNL:ARG:VdWContact': 20, 'UNL:CYS:Hydrophobic': 5, 'UNL:CYS:VdWContact': 5, 'UNL:GLN:Hydrophobic': 5, 'UNL:GLN:VdWContact': 10, 'UNL:GLU:HBDonor': 5, 'UNL:GLU:VdWContact': 10, 'UNL:GLY:VdWContact': 10, 'UNL:HIS:HBAcceptor': 5, 'UNL:HIS:HBDonor': 5, 'UNL:HIS:Hydrophobic': 5, 'UNL:HIS:VdWContact': 5, 'UNL:ILE:VdWContact': 10, 'UNL:LEU:Hydrophobic': 15, 'UNL:LEU:VdWContact': 20, 'UNL:LYS:Hydrophobic': 5, 'UNL:LYS:VdWContact': 5, 'UNL:PHE:HBAcceptor': 5, 'UNL:PHE:Hydrophobic': 15, 'UNL:PHE:VdWContact': 25, 'UNL:THR:VdWContact': 15, 'UNL:TRP:Hydrophobic': 5, 'UNL:TRP:VdWContact': 10, 'UNL:VAL:Hydrophobic': 20, 'UNL:VAL:VdWContact': 35}","{'UNL:ALA:VdWContact': 5, 'UNL:ARG:HBAcceptor': 30, 'UNL:ARG:VdWContact': 35, 'UNL:ASN:HBAcceptor': 10, 'UNL:ASN:Hydrophobic': 10, 'UNL:ASN:VdWContact': 25, 'UNL:ASP:VdWContact': 5, 'UNL:GLN:VdWContact': 10, 'UNL:GLU:VdWContact': 20, 'UNL:GLY:HBAcceptor': 20, 'UNL:GLY:VdWContact': 20, 'UNL:ILE:HBAcceptor': 5, 'UNL:ILE:VdWContact': 5, 'UNL:LEU:VdWContact': 10, 'UNL:LYS:HBAcceptor': 10, 'UNL:LYS:VdWContact': 10, 'UNL:MET:HBAcceptor': 10, 'UNL:MET:VdWContact': 15, 'UNL:PHE:VdWContact': 20, 'UNL:TRP:VdWContact': 5, 'UNL:VAL:HBAcceptor': 5, 'UNL:VAL:VdWContact': 5}"
+66,Boltz-1-Single-Seq,T1158v2,0.25,0.9166666666666667,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1}"
+67,Boltz-1-Single-Seq,T1152,476.9090909090909,1522.0526315789473,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 384, 'UNL:ASN:HBAcceptor': 1152, 'UNL:ASN:VdWContact': 3584, 'UNL:ASP:VdWContact': 1536, 'UNL:GLN:HBAcceptor': 896, 'UNL:GLN:VdWContact': 2560, 'UNL:GLU:HBAcceptor': 128, 'UNL:GLU:VdWContact': 896, 'UNL:GLY:HBAcceptor': 640, 'UNL:GLY:VdWContact': 1920, 'UNL:ILE:HBAcceptor': 512, 'UNL:ILE:VdWContact': 3072, 'UNL:LEU:VdWContact': 1280, 'UNL:LYS:HBAcceptor': 512, 'UNL:LYS:VdWContact': 4224, 'UNL:MET:VdWContact': 1280, 'UNL:PRO:VdWContact': 2432, 'UNL:SER:HBAcceptor': 128, 'UNL:SER:VdWContact': 512, 'UNL:THR:HBAcceptor': 768, 'UNL:THR:VdWContact': 2048, 'UNL:TRP:HBAcceptor': 512, 'UNL:TRP:VdWContact': 768, 'UNL:TYR:VdWContact': 1024, 'UNL:VAL:VdWContact': 1408}"
+68,Boltz-1-Single-Seq,T1158v1,0.4,1.0,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2}"
+69,Boltz-1-Single-Seq,T1158v4,4.0,2.6666666666666674,"{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBDonor': 4, 'UNL:ASN:VdWContact': 4, 'UNL:ASP:HBDonor': 4, 'UNL:ASP:VdWContact': 4, 'UNL:GLN:HBAcceptor': 12, 'UNL:GLN:VdWContact': 8, 'UNL:GLY:HBAcceptor': 28, 'UNL:GLY:HBDonor': 12, 'UNL:GLY:VdWContact': 28, 'UNL:LYS:HBAcceptor': 8, 'UNL:LYS:HBDonor': 8, 'UNL:LYS:VdWContact': 8, 'UNL:SER:HBAcceptor': 16, 'UNL:SER:HBDonor': 12, 'UNL:SER:VdWContact': 28, 'UNL:THR:HBAcceptor': 4, 'UNL:THR:HBDonor': 4, 'UNL:THR:VdWContact': 12, 'UNL:TRP:VdWContact': 4, 'UNL:TYR:VdWContact': 4, 'UNL:VAL:HBDonor': 4, 'UNL:VAL:VdWContact': 8}","{'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBAcceptor': 4, 'UNL:ASN:VdWContact': 8, 'UNL:ASP:VdWContact': 4, 'UNL:GLN:HBAcceptor': 12, 'UNL:GLN:VdWContact': 24, 'UNL:GLY:HBAcceptor': 24, 'UNL:GLY:VdWContact': 28, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:HBAcceptor': 8, 'UNL:LYS:VdWContact': 8, 'UNL:SER:HBAcceptor': 16, 'UNL:SER:VdWContact': 32}"
+70,Boltz-1-Single-Seq,T1146,0.0,0.7142857142857142,"{'UNL:GLN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1}"
+71,Boltz-1-Single-Seq,T1186,1.0,0.4545454545454546,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 3, 'UNL:SER:HBDonor': 3, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 3, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 4, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+72,Boltz-1-Single-Seq,T1187,1.3333333333333333,2.2222222222222223,"{'UNL:ALA:HBAcceptor': 4, 'UNL:ALA:VdWContact': 4, 'UNL:LYS:VdWContact': 4, 'UNL:THR:VdWContact': 4, 'UNL:TRP:HBAcceptor': 8, 'UNL:TRP:HBDonor': 4, 'UNL:TRP:Hydrophobic': 6, 'UNL:TRP:VdWContact': 12, 'UNL:TYR:Hydrophobic': 4, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 4}","{'UNL:ALA:HBAcceptor': 4, 'UNL:ALA:VdWContact': 4, 'UNL:ASP:VdWContact': 4, 'UNL:LYS:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:HBAcceptor': 8, 'UNL:TRP:VdWContact': 8, 'UNL:VAL:VdWContact': 2}"
+73,Boltz-1-Single-Seq,T1127v2,4.583333333333335,5.208333333333334,"{'UNL:ALA:Hydrophobic': 10, 'UNL:ARG:HBAcceptor': 20, 'UNL:ARG:HBDonor': 15, 'UNL:ARG:VdWContact': 30, 'UNL:ASN:HBAcceptor': 10, 'UNL:ASN:HBDonor': 15, 'UNL:ASN:VdWContact': 20, 'UNL:ASP:VdWContact': 10, 'UNL:GLN:VdWContact': 10, 'UNL:GLU:HBDonor': 10, 'UNL:GLU:VdWContact': 20, 'UNL:GLY:HBAcceptor': 20, 'UNL:GLY:VdWContact': 20, 'UNL:ILE:Hydrophobic': 20, 'UNL:ILE:VdWContact': 25, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 5, 'UNL:LYS:HBAcceptor': 10, 'UNL:LYS:VdWContact': 10, 'UNL:MET:HBAcceptor': 10, 'UNL:MET:HBDonor': 5, 'UNL:MET:Hydrophobic': 10, 'UNL:MET:VdWContact': 10, 'UNL:PHE:HBAcceptor': 10, 'UNL:PHE:Hydrophobic': 40, 'UNL:PHE:VdWContact': 35, 'UNL:PRO:VdWContact': 5, 'UNL:TRP:Hydrophobic': 5, 'UNL:TRP:VdWContact': 10, 'UNL:TYR:VdWContact': 10, 'UNL:VAL:Hydrophobic': 5, 'UNL:VAL:VdWContact': 10}","{'UNL:ALA:VdWContact': 5, 'UNL:ARG:HBAcceptor': 30, 'UNL:ARG:VdWContact': 35, 'UNL:ASN:HBAcceptor': 10, 'UNL:ASN:Hydrophobic': 10, 'UNL:ASN:VdWContact': 25, 'UNL:ASP:VdWContact': 5, 'UNL:GLN:VdWContact': 10, 'UNL:GLU:VdWContact': 20, 'UNL:GLY:HBAcceptor': 20, 'UNL:GLY:VdWContact': 20, 'UNL:ILE:HBAcceptor': 5, 'UNL:ILE:VdWContact': 5, 'UNL:LEU:VdWContact': 10, 'UNL:LYS:HBAcceptor': 10, 'UNL:LYS:VdWContact': 10, 'UNL:MET:HBAcceptor': 10, 'UNL:MET:VdWContact': 15, 'UNL:PHE:VdWContact': 20, 'UNL:TRP:VdWContact': 5, 'UNL:VAL:HBAcceptor': 5, 'UNL:VAL:VdWContact': 5}"
+74,Boltz-1-Single-Seq,T1124,1.3333333333333333,0.8695652173913038,"{'UNL:ASN:VdWContact': 8, 'UNL:CYS:VdWContact': 8, 'UNL:GLN:HBAcceptor': 12, 'UNL:GLN:HBDonor': 8, 'UNL:GLN:VdWContact': 12, 'UNL:GLU:HBDonor': 4, 'UNL:GLU:VdWContact': 8, 'UNL:HIS:HBAcceptor': 4, 'UNL:HIS:VdWContact': 8, 'UNL:ILE:Hydrophobic': 8, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 24, 'UNL:MET:Hydrophobic': 8, 'UNL:MET:VdWContact': 8, 'UNL:PHE:Hydrophobic': 12, 'UNL:PHE:VdWContact': 12, 'UNL:TRP:Hydrophobic': 8, 'UNL:TRP:VdWContact': 8, 'UNL:TYR:Hydrophobic': 8, 'UNL:TYR:VdWContact': 16}","{'UNL:ALA:VdWContact': 8, 'UNL:ASN:HBAcceptor': 8, 'UNL:ASN:VdWContact': 8, 'UNL:ASP:VdWContact': 16, 'UNL:GLY:VdWContact': 8, 'UNL:HIS:HBAcceptor': 4, 'UNL:HIS:VdWContact': 8, 'UNL:ILE:Hydrophobic': 8, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 8, 'UNL:LYS:VdWContact': 8, 'UNL:PHE:HBAcceptor': 8, 'UNL:PHE:Hydrophobic': 8, 'UNL:PHE:VdWContact': 8, 'UNL:SER:VdWContact': 8, 'UNL:TYR:Hydrophobic': 8, 'UNL:TYR:VdWContact': 20, 'UNL:VAL:Hydrophobic': 8, 'UNL:VAL:VdWContact': 4}"
+75,Boltz-1-Single-Seq,T1158v3,0.5,0.9999999999999999,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}"
+76,Boltz-1,T1158v2,0.33333333333333337,1.0,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1}"
+77,Boltz-1,T1152,524.6999999999999,1521.7894736842106,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:VdWContact': 384, 'UNL:ASN:HBAcceptor': 1152, 'UNL:ASN:VdWContact': 3584, 'UNL:ASP:VdWContact': 1536, 'UNL:GLN:HBAcceptor': 896, 'UNL:GLN:VdWContact': 2560, 'UNL:GLU:HBAcceptor': 128, 'UNL:GLU:VdWContact': 896, 'UNL:GLY:HBAcceptor': 640, 'UNL:GLY:VdWContact': 1920, 'UNL:ILE:HBAcceptor': 512, 'UNL:ILE:VdWContact': 3072, 'UNL:LEU:VdWContact': 1280, 'UNL:LYS:HBAcceptor': 512, 'UNL:LYS:VdWContact': 4224, 'UNL:MET:VdWContact': 1280, 'UNL:PRO:VdWContact': 2432, 'UNL:SER:HBAcceptor': 128, 'UNL:SER:VdWContact': 512, 'UNL:THR:HBAcceptor': 768, 'UNL:THR:VdWContact': 2048, 'UNL:TRP:HBAcceptor': 512, 'UNL:TRP:VdWContact': 768, 'UNL:TYR:VdWContact': 1024, 'UNL:VAL:VdWContact': 1408}"
+78,Boltz-1,T1158v4,3.0,3.0000000000000004,"{'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBDonor': 4, 'UNL:ASN:VdWContact': 4, 'UNL:ASP:HBDonor': 4, 'UNL:ASP:VdWContact': 4, 'UNL:GLN:HBAcceptor': 16, 'UNL:GLN:VdWContact': 12, 'UNL:GLY:HBAcceptor': 24, 'UNL:GLY:HBDonor': 4, 'UNL:GLY:VdWContact': 28, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:HBAcceptor': 8, 'UNL:LYS:HBDonor': 4, 'UNL:LYS:VdWContact': 8, 'UNL:SER:HBAcceptor': 16, 'UNL:SER:HBDonor': 12, 'UNL:SER:VdWContact': 28, 'UNL:THR:HBAcceptor': 4, 'UNL:THR:HBDonor': 4, 'UNL:THR:VdWContact': 12, 'UNL:TRP:VdWContact': 4, 'UNL:TYR:VdWContact': 4, 'UNL:VAL:VdWContact': 4}","{'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBAcceptor': 4, 'UNL:ASN:VdWContact': 8, 'UNL:ASP:VdWContact': 4, 'UNL:GLN:HBAcceptor': 12, 'UNL:GLN:VdWContact': 24, 'UNL:GLY:HBAcceptor': 24, 'UNL:GLY:VdWContact': 28, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:HBAcceptor': 8, 'UNL:LYS:VdWContact': 8, 'UNL:SER:HBAcceptor': 16, 'UNL:SER:VdWContact': 32}"
+79,Boltz-1,T1146,0.0,0.75,"{'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1}"
+80,Boltz-1,T1186,1.0,0.4545454545454546,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 3, 'UNL:SER:HBDonor': 3, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 3, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 4, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+81,Boltz-1,T1187,1.3333333333333333,2.0,"{'UNL:ALA:HBAcceptor': 4, 'UNL:ALA:VdWContact': 4, 'UNL:THR:VdWContact': 4, 'UNL:TRP:HBAcceptor': 8, 'UNL:TRP:HBDonor': 4, 'UNL:TRP:Hydrophobic': 8, 'UNL:TRP:VdWContact': 12, 'UNL:TYR:Hydrophobic': 4, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 4}","{'UNL:ALA:HBAcceptor': 4, 'UNL:ALA:VdWContact': 4, 'UNL:ASP:VdWContact': 4, 'UNL:LYS:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:HBAcceptor': 8, 'UNL:TRP:VdWContact': 8, 'UNL:VAL:VdWContact': 2}"
+82,Boltz-1,T1127v2,4.166666666666668,5.909090909090909,"{'UNL:ALA:Hydrophobic': 10, 'UNL:ARG:HBAcceptor': 20, 'UNL:ARG:HBDonor': 15, 'UNL:ARG:VdWContact': 30, 'UNL:ASN:HBAcceptor': 10, 'UNL:ASN:HBDonor': 15, 'UNL:ASN:VdWContact': 20, 'UNL:ASP:VdWContact': 10, 'UNL:GLN:HBDonor': 5, 'UNL:GLN:VdWContact': 10, 'UNL:GLU:HBDonor': 5, 'UNL:GLU:VdWContact': 20, 'UNL:GLY:HBAcceptor': 20, 'UNL:GLY:VdWContact': 20, 'UNL:ILE:Hydrophobic': 20, 'UNL:ILE:VdWContact': 25, 'UNL:LEU:Hydrophobic': 10, 'UNL:LEU:VdWContact': 5, 'UNL:LYS:HBAcceptor': 10, 'UNL:LYS:VdWContact': 20, 'UNL:MET:HBAcceptor': 10, 'UNL:MET:Hydrophobic': 15, 'UNL:MET:VdWContact': 10, 'UNL:PHE:HBAcceptor': 10, 'UNL:PHE:Hydrophobic': 40, 'UNL:PHE:VdWContact': 40, 'UNL:TRP:Hydrophobic': 10, 'UNL:TRP:VdWContact': 5, 'UNL:TYR:VdWContact': 10}","{'UNL:ALA:VdWContact': 5, 'UNL:ARG:HBAcceptor': 30, 'UNL:ARG:VdWContact': 35, 'UNL:ASN:HBAcceptor': 10, 'UNL:ASN:Hydrophobic': 10, 'UNL:ASN:VdWContact': 25, 'UNL:ASP:VdWContact': 5, 'UNL:GLN:VdWContact': 10, 'UNL:GLU:VdWContact': 20, 'UNL:GLY:HBAcceptor': 20, 'UNL:GLY:VdWContact': 20, 'UNL:ILE:HBAcceptor': 5, 'UNL:ILE:VdWContact': 5, 'UNL:LEU:VdWContact': 10, 'UNL:LYS:HBAcceptor': 10, 'UNL:LYS:VdWContact': 10, 'UNL:MET:HBAcceptor': 10, 'UNL:MET:VdWContact': 15, 'UNL:PHE:VdWContact': 20, 'UNL:TRP:VdWContact': 5, 'UNL:VAL:HBAcceptor': 5, 'UNL:VAL:VdWContact': 5}"
+83,Boltz-1,T1124,1.3333333333333333,1.6000000000000008,"{'UNL:ASN:HBAcceptor': 8, 'UNL:ASN:HBDonor': 8, 'UNL:ASN:VdWContact': 16, 'UNL:CYS:Hydrophobic': 8, 'UNL:CYS:VdWContact': 8, 'UNL:GLN:HBDonor': 8, 'UNL:GLN:VdWContact': 8, 'UNL:GLU:VdWContact': 4, 'UNL:GLY:VdWContact': 8, 'UNL:HIS:VdWContact': 8, 'UNL:ILE:Hydrophobic': 8, 'UNL:ILE:VdWContact': 8, 'UNL:LEU:VdWContact': 32, 'UNL:MET:Hydrophobic': 8, 'UNL:MET:VdWContact': 8, 'UNL:PHE:Hydrophobic': 16, 'UNL:PHE:VdWContact': 12, 'UNL:TRP:Hydrophobic': 8, 'UNL:TRP:VdWContact': 8, 'UNL:TYR:HBDonor': 4, 'UNL:TYR:VdWContact': 8, 'UNL:VAL:Hydrophobic': 8}","{'UNL:ALA:VdWContact': 8, 'UNL:ASN:HBAcceptor': 8, 'UNL:ASN:VdWContact': 8, 'UNL:ASP:VdWContact': 16, 'UNL:GLY:VdWContact': 8, 'UNL:HIS:HBAcceptor': 4, 'UNL:HIS:VdWContact': 8, 'UNL:ILE:Hydrophobic': 8, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 8, 'UNL:LYS:VdWContact': 8, 'UNL:PHE:HBAcceptor': 8, 'UNL:PHE:Hydrophobic': 8, 'UNL:PHE:VdWContact': 8, 'UNL:SER:VdWContact': 8, 'UNL:TYR:Hydrophobic': 8, 'UNL:TYR:VdWContact': 20, 'UNL:VAL:Hydrophobic': 8, 'UNL:VAL:VdWContact': 4}"
+84,Boltz-1,T1158v3,0.3333333333333333,1.0,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}"
+85,AF3-Single-Seq,H1171v2,18.000000000000004,8.999999999999998,"{'UNL:ARG:HBAcceptor': 27, 'UNL:ARG:HBDonor': 18, 'UNL:ARG:VdWContact': 45, 'UNL:ASP:VdWContact': 27, 'UNL:GLN:HBAcceptor': 9, 'UNL:GLN:HBDonor': 18, 'UNL:GLN:VdWContact': 27, 'UNL:GLY:HBAcceptor': 90, 'UNL:GLY:HBDonor': 27, 'UNL:GLY:VdWContact': 90, 'UNL:ILE:VdWContact': 9, 'UNL:LEU:HBDonor': 18, 'UNL:LEU:VdWContact': 27, 'UNL:LYS:HBAcceptor': 45, 'UNL:LYS:HBDonor': 27, 'UNL:LYS:VdWContact': 45, 'UNL:MET:VdWContact': 9, 'UNL:PHE:VdWContact': 54, 'UNL:PRO:VdWContact': 18, 'UNL:THR:HBAcceptor': 81, 'UNL:THR:HBDonor': 18, 'UNL:THR:VdWContact': 126}","{'UNL:ARG:HBAcceptor': 72, 'UNL:ARG:VdWContact': 81, 'UNL:GLY:HBAcceptor': 72, 'UNL:GLY:VdWContact': 81, 'UNL:ILE:VdWContact': 36, 'UNL:LEU:VdWContact': 27, 'UNL:LYS:HBAcceptor': 45, 'UNL:LYS:VdWContact': 54, 'UNL:PRO:Hydrophobic': 27, 'UNL:PRO:VdWContact': 45, 'UNL:THR:HBAcceptor': 63, 'UNL:THR:Hydrophobic': 9, 'UNL:THR:VdWContact': 162}"
+86,AF3-Single-Seq,T1152,476.81818181818176,1257.0000000000002,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 384, 'UNL:ASN:HBAcceptor': 1152, 'UNL:ASN:VdWContact': 3584, 'UNL:ASP:VdWContact': 1536, 'UNL:GLN:HBAcceptor': 896, 'UNL:GLN:VdWContact': 2560, 'UNL:GLU:HBAcceptor': 128, 'UNL:GLU:VdWContact': 896, 'UNL:GLY:HBAcceptor': 640, 'UNL:GLY:VdWContact': 1920, 'UNL:ILE:HBAcceptor': 512, 'UNL:ILE:VdWContact': 3072, 'UNL:LEU:VdWContact': 1280, 'UNL:LYS:HBAcceptor': 512, 'UNL:LYS:VdWContact': 4224, 'UNL:MET:VdWContact': 1280, 'UNL:PRO:VdWContact': 2432, 'UNL:SER:HBAcceptor': 128, 'UNL:SER:VdWContact': 512, 'UNL:THR:HBAcceptor': 768, 'UNL:THR:VdWContact': 2048, 'UNL:TRP:HBAcceptor': 512, 'UNL:TRP:VdWContact': 768, 'UNL:TYR:VdWContact': 1024, 'UNL:VAL:VdWContact': 1408}"
+87,AF3-Single-Seq,H1171v1,22.0,22.0,"{'UNL:ASP:VdWContact': 55, 'UNL:GLY:HBAcceptor': 132, 'UNL:GLY:HBDonor': 33, 'UNL:GLY:VdWContact': 187, 'UNL:LEU:HBDonor': 11, 'UNL:LEU:VdWContact': 11, 'UNL:LYS:HBAcceptor': 66, 'UNL:LYS:HBDonor': 44, 'UNL:LYS:VdWContact': 66, 'UNL:PRO:VdWContact': 33, 'UNL:THR:HBAcceptor': 132, 'UNL:THR:HBDonor': 55, 'UNL:THR:VdWContact': 132}","{'UNL:ARG:HBAcceptor': 110, 'UNL:ARG:VdWContact': 99, 'UNL:ASN:VdWContact': 11, 'UNL:ASP:VdWContact': 22, 'UNL:GLY:HBAcceptor': 99, 'UNL:GLY:VdWContact': 121, 'UNL:ILE:VdWContact': 55, 'UNL:LEU:VdWContact': 11, 'UNL:LYS:HBAcceptor': 44, 'UNL:LYS:VdWContact': 44, 'UNL:PRO:Hydrophobic': 44, 'UNL:PRO:VdWContact': 55, 'UNL:THR:HBAcceptor': 88, 'UNL:THR:VdWContact': 231, 'UNL:TYR:VdWContact': 11}"
+88,AF3-Single-Seq,H1172v1,13.0,9.69230769230769,"{'UNL:ALA:VdWContact': 9, 'UNL:ASP:VdWContact': 18, 'UNL:GLU:VdWContact': 9, 'UNL:GLY:HBAcceptor': 108, 'UNL:GLY:HBDonor': 36, 'UNL:GLY:VdWContact': 108, 'UNL:LEU:VdWContact': 45, 'UNL:LYS:HBAcceptor': 54, 'UNL:LYS:HBDonor': 27, 'UNL:LYS:VdWContact': 108, 'UNL:PRO:VdWContact': 45, 'UNL:THR:HBAcceptor': 90, 'UNL:THR:HBDonor': 27, 'UNL:THR:VdWContact': 99, 'UNL:VAL:HBDonor': 9, 'UNL:VAL:VdWContact': 18}","{'UNL:ARG:HBAcceptor': 54, 'UNL:ARG:VdWContact': 63, 'UNL:GLY:HBAcceptor': 63, 'UNL:GLY:VdWContact': 90, 'UNL:ILE:VdWContact': 54, 'UNL:LEU:VdWContact': 18, 'UNL:LYS:HBAcceptor': 36, 'UNL:LYS:VdWContact': 36, 'UNL:PRO:Hydrophobic': 18, 'UNL:PRO:VdWContact': 45, 'UNL:THR:HBAcceptor': 72, 'UNL:THR:VdWContact': 144, 'UNL:TYR:HBAcceptor': 9, 'UNL:TYR:VdWContact': 9}"
+89,AF3-Single-Seq,H1172v4,9.0,11.076923076923077,"{'UNL:ALA:VdWContact': 9, 'UNL:ASP:VdWContact': 18, 'UNL:GLU:VdWContact': 9, 'UNL:GLY:HBAcceptor': 108, 'UNL:GLY:HBDonor': 36, 'UNL:GLY:VdWContact': 108, 'UNL:LEU:VdWContact': 45, 'UNL:LYS:HBAcceptor': 54, 'UNL:LYS:HBDonor': 27, 'UNL:LYS:VdWContact': 108, 'UNL:PRO:VdWContact': 45, 'UNL:THR:HBAcceptor': 90, 'UNL:THR:HBDonor': 9, 'UNL:THR:VdWContact': 99, 'UNL:VAL:VdWContact': 18}","{'UNL:ARG:HBAcceptor': 63, 'UNL:ARG:VdWContact': 63, 'UNL:GLY:HBAcceptor': 99, 'UNL:GLY:VdWContact': 81, 'UNL:ILE:VdWContact': 45, 'UNL:LEU:HBAcceptor': 9, 'UNL:LEU:VdWContact': 27, 'UNL:LYS:HBAcceptor': 45, 'UNL:LYS:VdWContact': 45, 'UNL:PRO:Hydrophobic': 27, 'UNL:PRO:VdWContact': 36, 'UNL:THR:HBAcceptor': 72, 'UNL:THR:VdWContact': 135, 'UNL:TYR:VdWContact': 18}"
+90,AF3-Single-Seq,H1172v2,23.625,18.0,"{'UNL:ASP:VdWContact': 81, 'UNL:GLY:HBAcceptor': 108, 'UNL:GLY:HBDonor': 36, 'UNL:GLY:VdWContact': 108, 'UNL:LEU:HBDonor': 18, 'UNL:LEU:VdWContact': 90, 'UNL:LYS:HBAcceptor': 54, 'UNL:LYS:HBDonor': 18, 'UNL:LYS:VdWContact': 54, 'UNL:PRO:VdWContact': 36, 'UNL:THR:HBAcceptor': 135, 'UNL:THR:HBDonor': 36, 'UNL:THR:VdWContact': 162}","{'UNL:ARG:HBAcceptor': 63, 'UNL:ARG:VdWContact': 63, 'UNL:GLY:HBAcceptor': 72, 'UNL:GLY:VdWContact': 81, 'UNL:ILE:VdWContact': 45, 'UNL:LEU:VdWContact': 9, 'UNL:LYS:HBAcceptor': 27, 'UNL:LYS:VdWContact': 45, 'UNL:PRO:Hydrophobic': 18, 'UNL:PRO:VdWContact': 27, 'UNL:THR:HBAcceptor': 72, 'UNL:THR:VdWContact': 135, 'UNL:TYR:VdWContact': 18}"
+91,AF3-Single-Seq,T1187,2.666666666666667,1.2307692307692308,"{'UNL:ARG:VdWContact': 4, 'UNL:GLU:HBDonor': 4, 'UNL:GLU:Hydrophobic': 4, 'UNL:GLU:VdWContact': 4, 'UNL:GLY:VdWContact': 4, 'UNL:LYS:Hydrophobic': 2, 'UNL:THR:VdWContact': 4, 'UNL:TYR:VdWContact': 4, 'UNL:VAL:Hydrophobic': 8, 'UNL:VAL:VdWContact': 4}","{'UNL:ALA:HBAcceptor': 4, 'UNL:ALA:VdWContact': 4, 'UNL:ASP:VdWContact': 4, 'UNL:LYS:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:HBAcceptor': 8, 'UNL:TRP:VdWContact': 8, 'UNL:VAL:VdWContact': 2}"
+92,AF3-Single-Seq,T1127v2,3.333333333333333,2.5,"{'UNL:ALA:VdWContact': 15, 'UNL:ARG:HBAcceptor': 20, 'UNL:ARG:HBDonor': 5, 'UNL:ARG:Hydrophobic': 10, 'UNL:ARG:VdWContact': 30, 'UNL:ASN:HBAcceptor': 5, 'UNL:ASN:HBDonor': 5, 'UNL:ASN:Hydrophobic': 5, 'UNL:ASN:VdWContact': 10, 'UNL:GLU:Hydrophobic': 5, 'UNL:GLU:VdWContact': 5, 'UNL:GLY:HBAcceptor': 5, 'UNL:GLY:HBDonor': 10, 'UNL:GLY:VdWContact': 10, 'UNL:HIS:VdWContact': 5, 'UNL:LEU:Hydrophobic': 20, 'UNL:LEU:VdWContact': 15, 'UNL:LYS:VdWContact': 10, 'UNL:PHE:Hydrophobic': 25, 'UNL:PHE:VdWContact': 30, 'UNL:PRO:VdWContact': 5, 'UNL:SER:VdWContact': 10, 'UNL:THR:VdWContact': 5, 'UNL:TYR:HBAcceptor': 5, 'UNL:TYR:HBDonor': 5, 'UNL:TYR:Hydrophobic': 20, 'UNL:TYR:VdWContact': 15, 'UNL:VAL:Hydrophobic': 5}","{'UNL:ALA:VdWContact': 5, 'UNL:ARG:HBAcceptor': 30, 'UNL:ARG:VdWContact': 35, 'UNL:ASN:HBAcceptor': 10, 'UNL:ASN:Hydrophobic': 10, 'UNL:ASN:VdWContact': 25, 'UNL:ASP:VdWContact': 5, 'UNL:GLN:VdWContact': 10, 'UNL:GLU:VdWContact': 20, 'UNL:GLY:HBAcceptor': 20, 'UNL:GLY:VdWContact': 20, 'UNL:ILE:HBAcceptor': 5, 'UNL:ILE:VdWContact': 5, 'UNL:LEU:VdWContact': 10, 'UNL:LYS:HBAcceptor': 10, 'UNL:LYS:VdWContact': 10, 'UNL:MET:HBAcceptor': 10, 'UNL:MET:VdWContact': 15, 'UNL:PHE:VdWContact': 20, 'UNL:TRP:VdWContact': 5, 'UNL:VAL:HBAcceptor': 5, 'UNL:VAL:VdWContact': 5}"
+93,AF3-Single-Seq,T1124,2.4,1.6000000000000003,"{'UNL:ASN:VdWContact': 8, 'UNL:ASP:HBDonor': 4, 'UNL:ASP:Hydrophobic': 8, 'UNL:ASP:VdWContact': 16, 'UNL:GLU:Hydrophobic': 8, 'UNL:HIS:Hydrophobic': 8, 'UNL:HIS:VdWContact': 16, 'UNL:ILE:VdWContact': 8, 'UNL:LEU:VdWContact': 8, 'UNL:LYS:HBDonor': 4, 'UNL:LYS:VdWContact': 8, 'UNL:SER:VdWContact': 8, 'UNL:TYR:Hydrophobic': 8, 'UNL:TYR:VdWContact': 8}","{'UNL:ALA:VdWContact': 8, 'UNL:ASN:HBAcceptor': 8, 'UNL:ASN:VdWContact': 8, 'UNL:ASP:VdWContact': 16, 'UNL:GLY:VdWContact': 8, 'UNL:HIS:HBAcceptor': 4, 'UNL:HIS:VdWContact': 8, 'UNL:ILE:Hydrophobic': 8, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 8, 'UNL:LYS:VdWContact': 8, 'UNL:PHE:HBAcceptor': 8, 'UNL:PHE:Hydrophobic': 8, 'UNL:PHE:VdWContact': 8, 'UNL:SER:VdWContact': 8, 'UNL:TYR:Hydrophobic': 8, 'UNL:TYR:VdWContact': 20, 'UNL:VAL:Hydrophobic': 8, 'UNL:VAL:VdWContact': 4}"
+94,AF3-Single-Seq,H1172v3,17.0,13.09090909090909,"{'UNL:ARG:VdWContact': 8, 'UNL:ASP:VdWContact': 16, 'UNL:GLY:HBAcceptor': 96, 'UNL:GLY:HBDonor': 16, 'UNL:GLY:VdWContact': 96, 'UNL:LEU:VdWContact': 72, 'UNL:LYS:HBAcceptor': 48, 'UNL:LYS:HBDonor': 16, 'UNL:LYS:VdWContact': 48, 'UNL:PHE:HBDonor': 16, 'UNL:PHE:VdWContact': 40, 'UNL:PRO:VdWContact': 8, 'UNL:THR:HBAcceptor': 96, 'UNL:THR:HBDonor': 32, 'UNL:THR:VdWContact': 96, 'UNL:TYR:VdWContact': 96}","{'UNL:ARG:HBAcceptor': 56, 'UNL:ARG:VdWContact': 64, 'UNL:GLY:HBAcceptor': 64, 'UNL:GLY:VdWContact': 72, 'UNL:ILE:VdWContact': 32, 'UNL:LEU:VdWContact': 24, 'UNL:LYS:HBAcceptor': 40, 'UNL:LYS:VdWContact': 48, 'UNL:PRO:Hydrophobic': 16, 'UNL:PRO:VdWContact': 24, 'UNL:THR:HBAcceptor': 56, 'UNL:THR:VdWContact': 88}"
+95,AF3,H1171v2,39.0,28.5,"{'UNL:ARG:HBAcceptor': 81, 'UNL:ARG:HBDonor': 54, 'UNL:ARG:VdWContact': 135, 'UNL:ASP:VdWContact': 18, 'UNL:GLU:VdWContact': 9, 'UNL:GLY:HBAcceptor': 108, 'UNL:GLY:HBDonor': 72, 'UNL:GLY:VdWContact': 108, 'UNL:ILE:HBAcceptor': 54, 'UNL:ILE:VdWContact': 108, 'UNL:LEU:HBDonor': 54, 'UNL:LEU:VdWContact': 72, 'UNL:LYS:HBAcceptor': 54, 'UNL:LYS:HBDonor': 18, 'UNL:LYS:VdWContact': 54, 'UNL:PRO:VdWContact': 90, 'UNL:THR:HBAcceptor': 108, 'UNL:THR:VdWContact': 108, 'UNL:TYR:VdWContact': 108}","{'UNL:ARG:HBAcceptor': 72, 'UNL:ARG:VdWContact': 81, 'UNL:GLY:HBAcceptor': 72, 'UNL:GLY:VdWContact': 81, 'UNL:ILE:VdWContact': 36, 'UNL:LEU:VdWContact': 27, 'UNL:LYS:HBAcceptor': 45, 'UNL:LYS:VdWContact': 54, 'UNL:PRO:Hydrophobic': 27, 'UNL:PRO:VdWContact': 45, 'UNL:THR:HBAcceptor': 63, 'UNL:THR:Hydrophobic': 9, 'UNL:THR:VdWContact': 162}"
+96,AF3,T1152,524.6999999999999,1445.6,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:VdWContact': 384, 'UNL:ASN:HBAcceptor': 1152, 'UNL:ASN:VdWContact': 3584, 'UNL:ASP:VdWContact': 1536, 'UNL:GLN:HBAcceptor': 896, 'UNL:GLN:VdWContact': 2560, 'UNL:GLU:HBAcceptor': 128, 'UNL:GLU:VdWContact': 896, 'UNL:GLY:HBAcceptor': 640, 'UNL:GLY:VdWContact': 1920, 'UNL:ILE:HBAcceptor': 512, 'UNL:ILE:VdWContact': 3072, 'UNL:LEU:VdWContact': 1280, 'UNL:LYS:HBAcceptor': 512, 'UNL:LYS:VdWContact': 4224, 'UNL:MET:VdWContact': 1280, 'UNL:PRO:VdWContact': 2432, 'UNL:SER:HBAcceptor': 128, 'UNL:SER:VdWContact': 512, 'UNL:THR:HBAcceptor': 768, 'UNL:THR:VdWContact': 2048, 'UNL:TRP:HBAcceptor': 512, 'UNL:TRP:VdWContact': 768, 'UNL:TYR:VdWContact': 1024, 'UNL:VAL:VdWContact': 1408}"
+97,AF3,H1171v1,52.55555555555556,42.0,"{'UNL:ARG:HBAcceptor': 132, 'UNL:ARG:HBDonor': 77, 'UNL:ARG:VdWContact': 187, 'UNL:ASP:VdWContact': 55, 'UNL:GLY:HBAcceptor': 132, 'UNL:GLY:HBDonor': 77, 'UNL:GLY:VdWContact': 132, 'UNL:ILE:HBAcceptor': 66, 'UNL:ILE:VdWContact': 132, 'UNL:LEU:HBDonor': 66, 'UNL:LEU:VdWContact': 77, 'UNL:LYS:HBAcceptor': 66, 'UNL:LYS:HBDonor': 66, 'UNL:LYS:VdWContact': 66, 'UNL:PRO:VdWContact': 121, 'UNL:THR:HBAcceptor': 132, 'UNL:THR:VdWContact': 132, 'UNL:TYR:VdWContact': 132}","{'UNL:ARG:HBAcceptor': 110, 'UNL:ARG:VdWContact': 99, 'UNL:ASN:VdWContact': 11, 'UNL:ASP:VdWContact': 22, 'UNL:GLY:HBAcceptor': 99, 'UNL:GLY:VdWContact': 121, 'UNL:ILE:VdWContact': 55, 'UNL:LEU:VdWContact': 11, 'UNL:LYS:HBAcceptor': 44, 'UNL:LYS:VdWContact': 44, 'UNL:PRO:Hydrophobic': 44, 'UNL:PRO:VdWContact': 55, 'UNL:THR:HBAcceptor': 88, 'UNL:THR:VdWContact': 231, 'UNL:TYR:VdWContact': 11}"
+98,AF3,H1172v1,33.3,33.3,"{'UNL:ARG:HBAcceptor': 90, 'UNL:ARG:HBDonor': 27, 'UNL:ARG:VdWContact': 135, 'UNL:ASP:VdWContact': 9, 'UNL:GLY:HBAcceptor': 108, 'UNL:GLY:HBDonor': 63, 'UNL:GLY:VdWContact': 108, 'UNL:ILE:HBAcceptor': 54, 'UNL:ILE:VdWContact': 108, 'UNL:LEU:HBDonor': 54, 'UNL:LEU:VdWContact': 81, 'UNL:LYS:HBAcceptor': 54, 'UNL:LYS:HBDonor': 9, 'UNL:LYS:VdWContact': 54, 'UNL:PRO:VdWContact': 81, 'UNL:THR:HBAcceptor': 108, 'UNL:THR:VdWContact': 108, 'UNL:TYR:VdWContact': 108}","{'UNL:ARG:HBAcceptor': 54, 'UNL:ARG:VdWContact': 63, 'UNL:GLY:HBAcceptor': 63, 'UNL:GLY:VdWContact': 90, 'UNL:ILE:VdWContact': 54, 'UNL:LEU:VdWContact': 18, 'UNL:LYS:HBAcceptor': 36, 'UNL:LYS:VdWContact': 36, 'UNL:PRO:Hydrophobic': 18, 'UNL:PRO:VdWContact': 45, 'UNL:THR:HBAcceptor': 72, 'UNL:THR:VdWContact': 144, 'UNL:TYR:HBAcceptor': 9, 'UNL:TYR:VdWContact': 9}"
+99,AF3,H1172v4,29.7,33.3,"{'UNL:ARG:HBAcceptor': 90, 'UNL:ARG:HBDonor': 36, 'UNL:ARG:VdWContact': 135, 'UNL:ASP:VdWContact': 9, 'UNL:GLY:HBAcceptor': 108, 'UNL:GLY:HBDonor': 63, 'UNL:GLY:VdWContact': 108, 'UNL:ILE:HBAcceptor': 54, 'UNL:ILE:VdWContact': 108, 'UNL:LEU:HBDonor': 54, 'UNL:LEU:VdWContact': 81, 'UNL:LYS:HBAcceptor': 54, 'UNL:LYS:HBDonor': 18, 'UNL:LYS:VdWContact': 54, 'UNL:PRO:VdWContact': 81, 'UNL:THR:HBAcceptor': 108, 'UNL:THR:VdWContact': 108, 'UNL:TYR:VdWContact': 108}","{'UNL:ARG:HBAcceptor': 63, 'UNL:ARG:VdWContact': 63, 'UNL:GLY:HBAcceptor': 99, 'UNL:GLY:VdWContact': 81, 'UNL:ILE:VdWContact': 45, 'UNL:LEU:HBAcceptor': 9, 'UNL:LEU:VdWContact': 27, 'UNL:LYS:HBAcceptor': 45, 'UNL:LYS:VdWContact': 45, 'UNL:PRO:Hydrophobic': 27, 'UNL:PRO:VdWContact': 36, 'UNL:THR:HBAcceptor': 72, 'UNL:THR:VdWContact': 135, 'UNL:TYR:VdWContact': 18}"
+100,AF3,T1146,0.0,0.625,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1}"
+101,AF3,H1172v2,41.625,36.89999999999999,"{'UNL:ARG:HBAcceptor': 81, 'UNL:ARG:HBDonor': 54, 'UNL:ARG:VdWContact': 126, 'UNL:ASP:VdWContact': 18, 'UNL:GLY:HBAcceptor': 108, 'UNL:GLY:HBDonor': 63, 'UNL:GLY:VdWContact': 108, 'UNL:ILE:HBAcceptor': 54, 'UNL:ILE:VdWContact': 108, 'UNL:LEU:HBDonor': 45, 'UNL:LEU:VdWContact': 45, 'UNL:LYS:HBAcceptor': 54, 'UNL:LYS:VdWContact': 54, 'UNL:PRO:VdWContact': 117, 'UNL:THR:HBAcceptor': 108, 'UNL:THR:VdWContact': 108, 'UNL:TYR:VdWContact': 108}","{'UNL:ARG:HBAcceptor': 63, 'UNL:ARG:VdWContact': 63, 'UNL:GLY:HBAcceptor': 72, 'UNL:GLY:VdWContact': 81, 'UNL:ILE:VdWContact': 45, 'UNL:LEU:VdWContact': 9, 'UNL:LYS:HBAcceptor': 27, 'UNL:LYS:VdWContact': 45, 'UNL:PRO:Hydrophobic': 18, 'UNL:PRO:VdWContact': 27, 'UNL:THR:HBAcceptor': 72, 'UNL:THR:VdWContact': 135, 'UNL:TYR:VdWContact': 18}"
+102,AF3,T1187,0.0,1.0909090909090906,"{'UNL:ALA:HBAcceptor': 4, 'UNL:ALA:VdWContact': 4, 'UNL:PRO:Hydrophobic': 4, 'UNL:PRO:VdWContact': 2, 'UNL:TRP:HBAcceptor': 8, 'UNL:TRP:Hydrophobic': 8, 'UNL:TRP:VdWContact': 8, 'UNL:TYR:Hydrophobic': 4, 'UNL:VAL:Hydrophobic': 4}","{'UNL:ALA:HBAcceptor': 4, 'UNL:ALA:VdWContact': 4, 'UNL:ASP:VdWContact': 4, 'UNL:LYS:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:HBAcceptor': 8, 'UNL:TRP:VdWContact': 8, 'UNL:VAL:VdWContact': 2}"
+103,AF3,T1127v2,2.2727272727272725,6.739130434782608,"{'UNL:ALA:Hydrophobic': 10, 'UNL:ARG:HBAcceptor': 25, 'UNL:ARG:HBDonor': 10, 'UNL:ARG:VdWContact': 40, 'UNL:ASN:HBAcceptor': 10, 'UNL:ASN:VdWContact': 30, 'UNL:ASP:VdWContact': 10, 'UNL:GLN:HBDonor': 5, 'UNL:GLN:VdWContact': 5, 'UNL:GLU:VdWContact': 20, 'UNL:GLY:HBAcceptor': 20, 'UNL:GLY:VdWContact': 20, 'UNL:ILE:HBAcceptor': 5, 'UNL:ILE:Hydrophobic': 10, 'UNL:ILE:VdWContact': 20, 'UNL:LEU:VdWContact': 5, 'UNL:LYS:HBAcceptor': 10, 'UNL:LYS:Hydrophobic': 10, 'UNL:LYS:VdWContact': 20, 'UNL:MET:HBAcceptor': 10, 'UNL:MET:HBDonor': 5, 'UNL:MET:Hydrophobic': 10, 'UNL:MET:VdWContact': 20, 'UNL:PHE:Hydrophobic': 40, 'UNL:PHE:VdWContact': 45, 'UNL:THR:HBAcceptor': 5, 'UNL:THR:VdWContact': 5, 'UNL:TRP:Hydrophobic': 5, 'UNL:TRP:VdWContact': 10, 'UNL:TYR:VdWContact': 10, 'UNL:VAL:VdWContact': 10}","{'UNL:ALA:VdWContact': 5, 'UNL:ARG:HBAcceptor': 30, 'UNL:ARG:VdWContact': 35, 'UNL:ASN:HBAcceptor': 10, 'UNL:ASN:Hydrophobic': 10, 'UNL:ASN:VdWContact': 25, 'UNL:ASP:VdWContact': 5, 'UNL:GLN:VdWContact': 10, 'UNL:GLU:VdWContact': 20, 'UNL:GLY:HBAcceptor': 20, 'UNL:GLY:VdWContact': 20, 'UNL:ILE:HBAcceptor': 5, 'UNL:ILE:VdWContact': 5, 'UNL:LEU:VdWContact': 10, 'UNL:LYS:HBAcceptor': 10, 'UNL:LYS:VdWContact': 10, 'UNL:MET:HBAcceptor': 10, 'UNL:MET:VdWContact': 15, 'UNL:PHE:VdWContact': 20, 'UNL:TRP:VdWContact': 5, 'UNL:VAL:HBAcceptor': 5, 'UNL:VAL:VdWContact': 5}"
+104,AF3,T1124,3.6,4.695652173913043,"{'UNL:ALA:HBDonor': 4, 'UNL:ALA:VdWContact': 8, 'UNL:ASN:HBAcceptor': 8, 'UNL:ASN:Hydrophobic': 8, 'UNL:ASN:VdWContact': 8, 'UNL:ASP:HBDonor': 8, 'UNL:ASP:VdWContact': 16, 'UNL:CYS:VdWContact': 8, 'UNL:GLY:HBDonor': 4, 'UNL:GLY:VdWContact': 8, 'UNL:HIS:HBDonor': 4, 'UNL:HIS:VdWContact': 8, 'UNL:ILE:Hydrophobic': 24, 'UNL:ILE:VdWContact': 16, 'UNL:LEU:Hydrophobic': 16, 'UNL:LEU:VdWContact': 8, 'UNL:LYS:VdWContact': 8, 'UNL:MET:Hydrophobic': 8, 'UNL:MET:VdWContact': 8, 'UNL:PHE:HBAcceptor': 8, 'UNL:PHE:HBDonor': 8, 'UNL:PHE:Hydrophobic': 8, 'UNL:PHE:VdWContact': 16, 'UNL:SER:HBDonor': 4, 'UNL:SER:VdWContact': 8, 'UNL:TRP:Hydrophobic': 8, 'UNL:TRP:VdWContact': 8, 'UNL:TYR:HBAcceptor': 8, 'UNL:TYR:Hydrophobic': 8, 'UNL:TYR:VdWContact': 24, 'UNL:VAL:Hydrophobic': 8, 'UNL:VAL:VdWContact': 12}","{'UNL:ALA:VdWContact': 8, 'UNL:ASN:HBAcceptor': 8, 'UNL:ASN:VdWContact': 8, 'UNL:ASP:VdWContact': 16, 'UNL:GLY:VdWContact': 8, 'UNL:HIS:HBAcceptor': 4, 'UNL:HIS:VdWContact': 8, 'UNL:ILE:Hydrophobic': 8, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 8, 'UNL:LYS:VdWContact': 8, 'UNL:PHE:HBAcceptor': 8, 'UNL:PHE:Hydrophobic': 8, 'UNL:PHE:VdWContact': 8, 'UNL:SER:VdWContact': 8, 'UNL:TYR:Hydrophobic': 8, 'UNL:TYR:VdWContact': 20, 'UNL:VAL:Hydrophobic': 8, 'UNL:VAL:VdWContact': 4}"
+105,AF3,H1172v3,37.0,32.8,"{'UNL:ARG:HBAcceptor': 72, 'UNL:ARG:HBDonor': 48, 'UNL:ARG:VdWContact': 112, 'UNL:ASP:VdWContact': 8, 'UNL:GLY:HBAcceptor': 96, 'UNL:GLY:HBDonor': 64, 'UNL:GLY:VdWContact': 96, 'UNL:ILE:HBAcceptor': 48, 'UNL:ILE:VdWContact': 96, 'UNL:LEU:HBDonor': 40, 'UNL:LEU:VdWContact': 40, 'UNL:LYS:HBAcceptor': 48, 'UNL:LYS:VdWContact': 48, 'UNL:PRO:VdWContact': 104, 'UNL:THR:HBAcceptor': 96, 'UNL:THR:VdWContact': 96, 'UNL:TYR:VdWContact': 96}","{'UNL:ARG:HBAcceptor': 56, 'UNL:ARG:VdWContact': 64, 'UNL:GLY:HBAcceptor': 64, 'UNL:GLY:VdWContact': 72, 'UNL:ILE:VdWContact': 32, 'UNL:LEU:VdWContact': 24, 'UNL:LYS:HBAcceptor': 40, 'UNL:LYS:VdWContact': 48, 'UNL:PRO:Hydrophobic': 16, 'UNL:PRO:VdWContact': 24, 'UNL:THR:HBAcceptor': 56, 'UNL:THR:VdWContact': 88}"
diff --git a/notebooks/casp15_structured_vs_unstructured_emd_values.png b/notebooks/casp15_structured_vs_unstructured_emd_values.png
new file mode 100644
index 00000000..a4679a61
Binary files /dev/null and b/notebooks/casp15_structured_vs_unstructured_emd_values.png differ
diff --git a/notebooks/complexes_functional_keywords_1.png b/notebooks/complexes_functional_keywords_1.png
new file mode 100644
index 00000000..150b1bc5
Binary files /dev/null and b/notebooks/complexes_functional_keywords_1.png differ
diff --git a/notebooks/dataset_interaction_analysis_plotting.ipynb b/notebooks/dataset_interaction_analysis_plotting.ipynb
index d10ce466..43582cee 100644
--- a/notebooks/dataset_interaction_analysis_plotting.ipynb
+++ b/notebooks/dataset_interaction_analysis_plotting.ipynb
@@ -76,16 +76,16 @@
     ")\n",
     "assert os.path.exists(\n",
     "    ad_set_dir\n",
-    "), \"Please download the Astex Diverse set from `https://zenodo.org/records/14629652` before proceeding.\"\n",
+    "), \"Please download the Astex Diverse set from `https://zenodo.org/records/16791095` before proceeding.\"\n",
     "assert os.path.exists(\n",
     "    pb_set_dir\n",
-    "), \"Please download the PoseBusters Benchmark set from `https://zenodo.org/records/14629652` before proceeding.\"\n",
+    "), \"Please download the PoseBusters Benchmark set from `https://zenodo.org/records/16791095` before proceeding.\"\n",
     "assert os.path.exists(\n",
     "    dg_set_dir\n",
-    "), \"Please download the DockGen set from `https://zenodo.org/records/14629652` before proceeding.\"\n",
+    "), \"Please download the DockGen set from `https://zenodo.org/records/16791095` before proceeding.\"\n",
     "assert os.path.exists(\n",
     "    casp15_set_dir\n",
-    "), \"Please download the (public) CASP15 set from `https://zenodo.org/records/14629652` before proceeding.\"\n",
+    "), \"Please download the (public) CASP15 set from `https://zenodo.org/records/16791095` before proceeding.\"\n",
     "\n",
     "CASP15_ANALYSIS_TARGETS_TO_SKIP = [\n",
     "    \"T1170\"\n",
diff --git a/notebooks/dataset_interaction_analysis_plotting.py b/notebooks/dataset_interaction_analysis_plotting.py
index e650f2b6..34d60932 100644
--- a/notebooks/dataset_interaction_analysis_plotting.py
+++ b/notebooks/dataset_interaction_analysis_plotting.py
@@ -41,16 +41,16 @@
 )
 assert os.path.exists(
     ad_set_dir
-), "Please download the Astex Diverse set from `https://zenodo.org/records/14629652` before proceeding."
+), "Please download the Astex Diverse set from `https://zenodo.org/records/16791095` before proceeding."
 assert os.path.exists(
     pb_set_dir
-), "Please download the PoseBusters Benchmark set from `https://zenodo.org/records/14629652` before proceeding."
+), "Please download the PoseBusters Benchmark set from `https://zenodo.org/records/16791095` before proceeding."
 assert os.path.exists(
     dg_set_dir
-), "Please download the DockGen set from `https://zenodo.org/records/14629652` before proceeding."
+), "Please download the DockGen set from `https://zenodo.org/records/16791095` before proceeding."
 assert os.path.exists(
     casp15_set_dir
-), "Please download the (public) CASP15 set from `https://zenodo.org/records/14629652` before proceeding."
+), "Please download the (public) CASP15 set from `https://zenodo.org/records/16791095` before proceeding."
 
 CASP15_ANALYSIS_TARGETS_TO_SKIP = [
     "T1170"
diff --git a/notebooks/dockgen_inference_results_plotting.ipynb b/notebooks/dockgen_inference_results_plotting.ipynb
index 8b1567ae..a3962381 100644
--- a/notebooks/dockgen_inference_results_plotting.ipynb
+++ b/notebooks/dockgen_inference_results_plotting.ipynb
@@ -70,6 +70,8 @@
     "    \"rfaa\",\n",
     "    \"chai-lab_ss\",\n",
     "    \"chai-lab\",\n",
+    "    \"boltz_ss\",\n",
+    "    \"boltz\",\n",
     "    \"alphafold3_ss\",\n",
     "    \"alphafold3\",\n",
     "]\n",
@@ -84,6 +86,7 @@
     "globals()[\"neuralplexer_output_dir\"] = os.path.join(\"..\", \"forks\", \"NeuralPLexer\", \"inference\")\n",
     "globals()[\"rfaa_output_dir\"] = os.path.join(\"..\", \"forks\", \"RoseTTAFold-All-Atom\", \"inference\")\n",
     "globals()[\"chai-lab_output_dir\"] = os.path.join(\"..\", \"forks\", \"chai-lab\", \"inference\")\n",
+    "globals()[\"boltz_output_dir\"] = os.path.join(\"..\", \"forks\", \"boltz\", \"inference\")\n",
     "globals()[\"alphafold3_output_dir\"] = os.path.join(\"..\", \"forks\", \"alphafold3\", \"inference\")\n",
     "for repeat_index in range(1, max_num_repeats_per_method + 1):\n",
     "    # PLIF metrics\n",
@@ -181,6 +184,30 @@
     "        \"bust_results.csv\",\n",
     "    )\n",
     "\n",
+    "    # Boltz (Single-Seq) results\n",
+    "    globals()[f\"boltz_ss_dockgen_bust_results_csv_filepath_{repeat_index}\"] = os.path.join(\n",
+    "        globals()[\"boltz_output_dir\"],\n",
+    "        f\"boltz_ss_dockgen_outputs_{repeat_index}\",\n",
+    "        \"bust_results.csv\",\n",
+    "    )\n",
+    "    globals()[f\"boltz_ss_dockgen_relaxed_bust_results_csv_filepath_{repeat_index}\"] = os.path.join(\n",
+    "        globals()[\"boltz_output_dir\"],\n",
+    "        f\"boltz_ss_dockgen_outputs_{repeat_index}_relaxed\",\n",
+    "        \"bust_results.csv\",\n",
+    "    )\n",
+    "\n",
+    "    # Boltz results\n",
+    "    globals()[f\"boltz_dockgen_bust_results_csv_filepath_{repeat_index}\"] = os.path.join(\n",
+    "        globals()[\"boltz_output_dir\"],\n",
+    "        f\"boltz_dockgen_outputs_{repeat_index}\",\n",
+    "        \"bust_results.csv\",\n",
+    "    )\n",
+    "    globals()[f\"boltz_dockgen_relaxed_bust_results_csv_filepath_{repeat_index}\"] = os.path.join(\n",
+    "        globals()[\"boltz_output_dir\"],\n",
+    "        f\"boltz_dockgen_outputs_{repeat_index}_relaxed\",\n",
+    "        \"bust_results.csv\",\n",
+    "    )\n",
+    "\n",
     "    # AlphaFold 3 (Single-Seq) results\n",
     "    globals()[f\"alphafold3_ss_dockgen_bust_results_csv_filepath_{repeat_index}\"] = os.path.join(\n",
     "        globals()[\"alphafold3_output_dir\"],\n",
@@ -218,6 +245,8 @@
     "    \"rfaa\": \"RFAA\",\n",
     "    \"chai-lab_ss\": \"Chai-1-Single-Seq\",\n",
     "    \"chai-lab\": \"Chai-1\",\n",
+    "    \"boltz_ss\": \"Boltz-1-Single-Seq\",\n",
+    "    \"boltz\": \"Boltz-1\",\n",
     "    \"alphafold3_ss\": \"AF3-Single-Seq\",\n",
     "    \"alphafold3\": \"AF3\",\n",
     "}\n",
@@ -230,6 +259,8 @@
     "    \"rfaa\": \"DL-based blind\",\n",
     "    \"chai-lab_ss\": \"DL-based blind\",\n",
     "    \"chai-lab\": \"DL-based blind\",\n",
+    "    \"boltz_ss\": \"DL-based blind\",\n",
+    "    \"boltz\": \"DL-based blind\",\n",
     "    \"alphafold3_ss\": \"DL-based blind\",\n",
     "    \"alphafold3\": \"DL-based blind\",\n",
     "}"
@@ -509,7 +540,7 @@
     "colors = [\"#AB8042\", \"#FB8072\", \"#BEBADA\", \"#FCCDE5\"]\n",
     "\n",
     "bar_width = 0.5\n",
-    "r1 = [item - 0.5 for item in range(2, 20, 2)]\n",
+    "r1 = [item - 0.5 for item in range(2, 24, 2)]\n",
     "r2 = [x + bar_width for x in r1]\n",
     "r3 = [x + bar_width for x in r2]\n",
     "\n",
@@ -893,7 +924,7 @@
     "\n",
     "# add labels, titles, ticks, etc.\n",
     "axis.set_ylabel(\"Percentage of predictions\")\n",
-    "axis.set_xlim(1, 19 + 0.1)\n",
+    "axis.set_xlim(1, 23 + 0.1)\n",
     "axis.set_ylim(0, 125)\n",
     "\n",
     "assert all(\n",
@@ -1033,7 +1064,7 @@
     "axis.grid(axis=\"y\", color=\"#EAEFF8\")\n",
     "axis.set_axisbelow(True)\n",
     "\n",
-    "axis.set_xticks([2, 2 + 1e-3, 4, 6, 8, 10, 11, 12, 14, 16, 18])\n",
+    "axis.set_xticks([2, 2 + 1e-3, 4, 6, 8, 10, 12, 13, 14, 16, 18, 20, 22])\n",
     "axis.set_xticks([1 + 0.1], minor=True)\n",
     "axis.set_xticklabels(\n",
     "    [\n",
@@ -1043,9 +1074,11 @@
     "        \"DynamicBind\",\n",
     "        \"NeuralPLexer\",\n",
     "        \"RFAA\",\n",
-    "        \"DL-based blind\",\n",
     "        \"Chai-1-Single-Seq\",\n",
+    "        \"DL-based blind\",\n",
     "        \"Chai-1\",\n",
+    "        \"Boltz-1-Single-Seq\",\n",
+    "        \"Boltz-1\",\n",
     "        \"AF3-Single-Seq\",\n",
     "        \"AF3\",\n",
     "    ]\n",
@@ -1059,7 +1092,7 @@
     "axis.tick_params(axis=\"y\", which=\"major\", left=\"off\", right=\"on\", color=\"#EAEFF8\")\n",
     "\n",
     "# vertical alignment of xtick labels\n",
-    "vert_alignments = [0.0, -0.1, 0.0, 0.0, 0.0, 0.0, -0.1, 0.0, 0.0, 0.0, 0.0]\n",
+    "vert_alignments = [0.0, -0.1, 0.0, 0.0, 0.0, 0.0, 0.0, -0.1, 0.0, 0.0, 0.0, 0.0, 0.0]\n",
     "for tick, y in zip(axis.get_xticklabels(), vert_alignments):\n",
     "    tick.set_y(y)\n",
     "\n",
diff --git a/notebooks/dockgen_method_interaction_analysis.png b/notebooks/dockgen_method_interaction_analysis.png
new file mode 100644
index 00000000..bd36c4a2
Binary files /dev/null and b/notebooks/dockgen_method_interaction_analysis.png differ
diff --git a/notebooks/dockgen_method_interaction_analysis_plotting.ipynb b/notebooks/dockgen_method_interaction_analysis_plotting.ipynb
index eaac1623..f0d14fad 100644
--- a/notebooks/dockgen_method_interaction_analysis_plotting.ipynb
+++ b/notebooks/dockgen_method_interaction_analysis_plotting.ipynb
@@ -88,6 +88,8 @@
     "    \"rfaa\",\n",
     "    \"chai-lab_ss\",\n",
     "    \"chai-lab\",\n",
+    "    \"boltz_ss\",\n",
+    "    \"boltz\",\n",
     "    \"alphafold3_ss\",\n",
     "    \"alphafold3\",\n",
     "]\n",
@@ -102,7 +104,7 @@
     ")\n",
     "assert os.path.exists(\n",
     "    dg_set_dir\n",
-    "), \"Please download the DockGen set from `https://zenodo.org/records/14629652` before proceeding.\"\n",
+    "), \"Please download the DockGen set from `https://zenodo.org/records/16791095` before proceeding.\"\n",
     "\n",
     "# Mappings\n",
     "method_mapping = {\n",
@@ -113,6 +115,8 @@
     "    \"rfaa\": \"RFAA\",\n",
     "    \"chai-lab_ss\": \"Chai-1-Single-Seq\",\n",
     "    \"chai-lab\": \"Chai-1\",\n",
+    "    \"boltz_ss\": \"Boltz-1-Single-Seq\",\n",
+    "    \"boltz\": \"Boltz-1\",\n",
     "    \"alphafold3_ss\": \"AF3-Single-Seq\",\n",
     "    \"alphafold3\": \"AF3\",\n",
     "}\n",
diff --git a/notebooks/dockgen_method_interaction_analysis_plotting.py b/notebooks/dockgen_method_interaction_analysis_plotting.py
index 2e9a50de..68e77449 100644
--- a/notebooks/dockgen_method_interaction_analysis_plotting.py
+++ b/notebooks/dockgen_method_interaction_analysis_plotting.py
@@ -53,6 +53,8 @@
     "rfaa",
     "chai-lab_ss",
     "chai-lab",
+    "boltz_ss",
+    "boltz",
     "alphafold3_ss",
     "alphafold3",
 ]
@@ -67,7 +69,7 @@
 )
 assert os.path.exists(
     dg_set_dir
-), "Please download the DockGen set from `https://zenodo.org/records/14629652` before proceeding."
+), "Please download the DockGen set from `https://zenodo.org/records/16791095` before proceeding."
 
 # Mappings
 method_mapping = {
@@ -78,6 +80,8 @@
     "rfaa": "RFAA",
     "chai-lab_ss": "Chai-1-Single-Seq",
     "chai-lab": "Chai-1",
+    "boltz_ss": "Boltz-1-Single-Seq",
+    "boltz": "Boltz-1",
     "alphafold3_ss": "AF3-Single-Seq",
     "alphafold3": "AF3",
 }
diff --git a/notebooks/dockgen_plif_emd_values.png b/notebooks/dockgen_plif_emd_values.png
new file mode 100644
index 00000000..1ce2a8ee
Binary files /dev/null and b/notebooks/dockgen_plif_emd_values.png differ
diff --git a/notebooks/dockgen_plif_metrics.csv b/notebooks/dockgen_plif_metrics.csv
new file mode 100644
index 00000000..c788cfe9
--- /dev/null
+++ b/notebooks/dockgen_plif_metrics.csv
@@ -0,0 +1,1310 @@
+,Category,Target,EMD,WM,Method_Histogram,Reference_Histogram
+0,P2Rank-Vina,3s6a_1_ANP_0,0.4,0.84,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1}"
+1,P2Rank-Vina,2gf3_2_FOA_1,,0.0,,
+2,P2Rank-Vina,1v2g_1_OCA_0,,0.0,,
+3,P2Rank-Vina,2r4e_1_13P_0,,0.0,,
+4,P2Rank-Vina,3ub7_1_ACM_1,,0.0,,
+5,P2Rank-Vina,4cdn_2_FAD_0,,0.0,,
+6,P2Rank-Vina,6yaq_1_OHZ_0,,0.0,,
+7,P2Rank-Vina,4cnl_1_CHT_1,,0.0,,
+8,P2Rank-Vina,5k45_2_GLU_1,,0.0,,
+9,P2Rank-Vina,2zcz_2_TRP_3,,0.0,,
+10,P2Rank-Vina,5fxd_1_H7Y_1,,0.0,,
+11,P2Rank-Vina,5k3o_2_ASP_0,,0.0,,
+12,P2Rank-Vina,5fxe_1_CIY_1,,0.0,,
+13,P2Rank-Vina,5ida_1_BMA_0,,0.0,,
+14,P2Rank-Vina,4osy_1_GLY_3,,0.0,,
+15,P2Rank-Vina,5k62_1_ASN-VAL_0,,0.0,,
+16,P2Rank-Vina,5b5s_1_BOG_0,,0.0,,
+17,P2Rank-Vina,1tke_1_SER_0,,0.0,,
+18,P2Rank-Vina,6paa_1_ASP_2,,0.0,,
+19,P2Rank-Vina,2gag_1_NAD_0,,0.0,,
+20,P2Rank-Vina,6o6y_1_ACK_0,,0.0,,
+21,P2Rank-Vina,3zec_1_ANP_0,,0.0,,
+22,P2Rank-Vina,5mh1_1_BMA_0,,0.0,,
+23,P2Rank-Vina,5dnc_1_ASN_2,,0.0,,
+24,P2Rank-Vina,5u82_2_ZN0_0,,0.0,,
+25,P2Rank-Vina,3wrb_1_GDE_0,,0.0,,
+26,P2Rank-Vina,6ep5_1_ADP_1,,0.0,,
+27,P2Rank-Vina,2vfu_1_MTL_0,,0.0,,
+28,P2Rank-Vina,3zzs_1_TRP_3,,0.0,,
+29,P2Rank-Vina,6ryz_1_SAM_2,,0.0,,
+30,P2Rank-Vina,5hmr_1_FDZ_0,,0.0,,
+31,P2Rank-Vina,2hs3_1_FGR_0,,0.0,,
+32,P2Rank-Vina,6etf_1_AMP_0,,0.0,,
+33,P2Rank-Vina,3jqm_1_GTP_5,,0.0,,
+34,P2Rank-Vina,3eca_1_ASP_3,,0.0,,
+35,P2Rank-Vina,4osx_1_GLY_2,,0.0,,
+36,P2Rank-Vina,2ze9_1_PD7_0,,0.0,,
+37,P2Rank-Vina,5f52_1_ASP_2,,0.0,,
+38,P2Rank-Vina,6xug_1_O1Q_0,,0.0,,
+39,P2Rank-Vina,4fyv_1_DCP_2,,0.0,,
+40,P2Rank-Vina,2hk9_1_SKM_0,,0.0,,
+41,P2Rank-Vina,6v2a_1_ASN_3,,0.0,,
+42,P2Rank-Vina,1rqp_1_SAM_0,,0.0,,
+43,P2Rank-Vina,2wr8_1_SAH_1,,0.0,,
+44,P2Rank-Vina,5gqi_1_ATP_7,,0.0,,
+45,P2Rank-Vina,2vdf_1_OCT_0,,0.0,,
+46,P2Rank-Vina,4qa8_1_PJZ_0,,0.0,,
+47,P2Rank-Vina,5k66_1_ASN-GLU_0,,0.0,,
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+51,P2Rank-Vina,2xta_1_ACO_0,,0.0,,
+52,P2Rank-Vina,5hhz_1_ZME_0,,0.0,,
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+55,P2Rank-Vina,5k4h_2_GLU_3,,0.0,,
+56,P2Rank-Vina,4tvd_1_GLC_0,,0.0,,
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+66,P2Rank-Vina,2gah_1_NAD_0,,0.0,,
+67,P2Rank-Vina,6pa2_1_ASP_2,,0.0,,
+68,P2Rank-Vina,4h2f_1_ADN_0,,0.0,,
+69,P2Rank-Vina,4u63_1_FAD_0,,0.0,,
+70,P2Rank-Vina,4o0f_1_GLY_3,,0.0,,
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+77,P2Rank-Vina,3uni_1_SAL_0,,0.0,,
+78,P2Rank-Vina,3o7j_1_2AL_0,0.49999999999999994,0.8,"{'UNL:ALA:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+79,P2Rank-Vina,2v7v_1_5FD_0,,0.0,,
+80,P2Rank-Vina,4rhe_1_FMN_6,,0.0,,
+81,P2Rank-Vina,5fxf_1_BEZ_0,,0.0,,
+82,P2Rank-Vina,2wwc_1_CHT_2,,0.0,,
+83,P2Rank-Vina,6qkr_1_FAD_0,,0.0,,
+84,P2Rank-Vina,3inr_1_GDU_0,,0.0,,
+85,P2Rank-Vina,4idk_1_1FE_0,,0.0,,
+86,P2Rank-Vina,6yao_1_OJ2_0,,0.0,,
+87,P2Rank-Vina,6ea9_1_9BG_0,,0.0,,
+88,P2Rank-Vina,6ur1_2_AT3_0,,0.0,,
+89,P2Rank-Vina,4mig_1_G3F_2,,0.0,,
+90,P2Rank-Vina,6wyz_1_DGL_1,,0.0,,
+91,P2Rank-Vina,2v7t_1_SAH_4,,0.0,,
+92,P2Rank-Vina,3ad7_1_NAD_0,,0.0,,
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+95,P2Rank-Vina,2q37_1_3AL_0,0.41666666666666674,0.8333333333333333,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 2, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 4, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+96,P2Rank-Vina,6n19_2_K8V_0,,0.0,,
+97,P2Rank-Vina,2v7w_1_5FD_0,,0.0,,
+98,P2Rank-Vina,4phs_1_UDP_0,0.2727272727272727,0.8909090909090909,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+99,P2Rank-Vina,4ydx_1_TCE_0,,0.0,,
+100,P2Rank-Vina,4xfm_1_THE_0,0.4444444444444444,0.8222222222222222,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}"
+101,P2Rank-Vina,3ub9_1_NHY_1,,0.0,,
+102,P2Rank-Vina,1tkg_1_SSA_0,0.4000000000000001,0.84,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 2}"
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+120,DiffDock-L,2gf3_2_FOA_1,0.75,0.7,"{'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:GLN:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+121,DiffDock-L,1v2g_1_OCA_0,0.5625,0.775,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2}"
+122,DiffDock-L,2r4e_1_13P_0,,0.0,,
+123,DiffDock-L,3ub7_1_ACM_1,0.5555555555555556,0.7777777777777778,"{'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:VdWContact': 1}"
+124,DiffDock-L,4cdn_2_FAD_0,0.4782608695652175,0.808695652173913,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+125,DiffDock-L,6yaq_1_OHZ_0,0.823529411764706,0.6705882352941176,"{'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+126,DiffDock-L,4cnl_1_CHT_1,1.0,0.6,"{'UNL:ASP:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}",{}
+127,DiffDock-L,5k45_2_GLU_1,0.1538461538461538,0.9384615384615385,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+128,DiffDock-L,2zcz_2_TRP_3,,0.0,,
+129,DiffDock-L,5fxd_1_H7Y_1,0.6666666666666667,0.7333333333333333,"{'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+130,DiffDock-L,5k3o_2_ASP_0,0.7999999999999999,0.68,"{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 4, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}"
+131,DiffDock-L,5fxe_1_CIY_1,,0.0,,
+132,DiffDock-L,5ida_1_BMA_0,,0.0,,
+133,DiffDock-L,4osy_1_GLY_3,,0.0,,
+134,DiffDock-L,5k62_1_ASN-VAL_0,,0.0,,
+135,DiffDock-L,5b5s_1_BOG_0,0.6153846153846154,0.7538461538461538,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:VdWContact': 1}"
+136,DiffDock-L,1tke_1_SER_0,,0.0,,
+137,DiffDock-L,6paa_1_ASP_2,0.4615384615384614,0.8153846153846154,"{'UNL:ALA:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+138,DiffDock-L,2gag_1_NAD_0,0.4722222222222223,0.8111111111111111,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 4, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+139,DiffDock-L,6o6y_1_ACK_0,,0.0,,
+140,DiffDock-L,3zec_1_ANP_0,,0.0,,
+141,DiffDock-L,5mh1_1_BMA_0,,0.0,,
+142,DiffDock-L,5dnc_1_ASN_2,,0.0,,
+143,DiffDock-L,5u82_2_ZN0_0,,0.0,,
+144,DiffDock-L,3wrb_1_GDE_0,,0.0,,
+145,DiffDock-L,6ep5_1_ADP_1,0.4705882352941177,0.8117647058823529,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+146,DiffDock-L,2vfu_1_MTL_0,,0.0,,
+147,DiffDock-L,3zzs_1_TRP_3,,0.0,,
+148,DiffDock-L,6ryz_1_SAM_2,,0.0,,
+149,DiffDock-L,5hmr_1_FDZ_0,0.8999999999999999,0.64,"{'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}"
+150,DiffDock-L,2hs3_1_FGR_0,0.3157894736842105,0.8736842105263158,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1}"
+151,DiffDock-L,6etf_1_AMP_0,,0.0,,
+152,DiffDock-L,3jqm_1_GTP_5,,0.0,,
+153,DiffDock-L,3eca_1_ASP_3,,0.0,,
+154,DiffDock-L,4osx_1_GLY_2,,0.0,,
+155,DiffDock-L,2ze9_1_PD7_0,0.9411764705882353,0.6235294117647059,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+156,DiffDock-L,5f52_1_ASP_2,,0.0,,
+157,DiffDock-L,6xug_1_O1Q_0,,0.0,,
+158,DiffDock-L,4fyv_1_DCP_2,0.4166666666666667,0.8333333333333333,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+159,DiffDock-L,2hk9_1_SKM_0,,0.0,,
+160,DiffDock-L,6v2a_1_ASN_3,,0.0,,
+161,DiffDock-L,1rqp_1_SAM_0,,0.0,,
+162,DiffDock-L,2wr8_1_SAH_1,,0.0,,
+163,DiffDock-L,5gqi_1_ATP_7,,0.0,,
+164,DiffDock-L,2vdf_1_OCT_0,1.2857142857142858,0.48571428571428565,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}",{}
+165,DiffDock-L,4qa8_1_PJZ_0,,0.0,,
+166,DiffDock-L,5k66_1_ASN-GLU_0,,0.0,,
+167,DiffDock-L,3gf4_1_FAD_1,0.3666666666666666,0.8533333333333334,"{'UNL:ARG:VdWContact': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 2, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+168,DiffDock-L,4tvd_1_BGC_4,0.7777777777777779,0.6888888888888889,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:VdWContact': 2}","{'UNL:GLU:VdWContact': 2, 'UNL:TYR:VdWContact': 2}"
+169,DiffDock-L,1u8u_1_OCA_0,0.5714285714285714,0.7714285714285715,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2}"
+170,DiffDock-L,2xta_1_ACO_0,0.42857142857142855,0.8285714285714285,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1}"
+171,DiffDock-L,5hhz_1_ZME_0,0.7000000000000001,0.72,"{'UNL:ASN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ASP:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2}"
+172,DiffDock-L,4xdr_1_ADN_0,,0.0,,
+173,DiffDock-L,6uqy_2_AT3_0,0.14285714285714282,0.9428571428571428,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+174,DiffDock-L,5k4h_2_GLU_3,0.24999999999999994,0.9,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+175,DiffDock-L,4tvd_1_GLC_0,0.5714285714285714,0.7714285714285715,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:LYS:VdWContact': 2}"
+176,DiffDock-L,1pj2_1_FUM_0,,0.0,,
+177,DiffDock-L,6o70_1_ACK_1,0.11111111111111116,0.9555555555555555,"{'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+178,DiffDock-L,2zd0_1_TRP_9,0.4666666666666666,0.8133333333333334,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 4}"
+179,DiffDock-L,1uf5_1_CDT_0,,0.0,,
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+181,DiffDock-L,3ad9_1_NAD_0,0.4666666666666666,0.8133333333333334,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 8, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+182,DiffDock-L,5k63_1_ASN-GLY_0,,0.0,,
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+184,DiffDock-L,4pfx_1_UDP_0,0.23529411764705874,0.9058823529411765,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+185,DiffDock-L,2gah_1_NAD_0,,0.0,,
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+188,DiffDock-L,4u63_1_FAD_0,0.4838709677419356,0.8064516129032258,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+189,DiffDock-L,4o0f_1_GLY_3,,0.0,,
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+192,DiffDock-L,5f2t_1_PLM_0,1.1111111111111112,0.5555555555555556,"{'UNL:ALA:Hydrophobic': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:HIS:VdWContact': 1}"
+193,DiffDock-L,3ada_1_NAD_0,0.45454545454545436,0.8181818181818182,"{'UNL:ALA:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 5, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+194,DiffDock-L,4b4v_1_L34_0,0.20000000000000007,0.9199999999999999,"{'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+195,DiffDock-L,4uoc_1_NCN_1,0.4444444444444444,0.8222222222222222,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 4, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+196,DiffDock-L,3uni_1_SAL_0,,0.0,,
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+198,DiffDock-L,2v7v_1_5FD_0,0.2857142857142857,0.8857142857142857,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+199,DiffDock-L,4rhe_1_FMN_6,,0.0,,
+200,DiffDock-L,5fxf_1_BEZ_0,0.19999999999999996,0.92,"{'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:TYR:VdWContact': 1}","{'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+201,DiffDock-L,2wwc_1_CHT_2,1.0,0.6,"{'UNL:PHE:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}",{}
+202,DiffDock-L,6qkr_1_FAD_0,,0.0,,
+203,DiffDock-L,3inr_1_GDU_0,0.39999999999999997,0.8400000000000001,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+204,DiffDock-L,4idk_1_1FE_0,0.3999999999999999,0.8400000000000001,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1}","{'UNL:GLU:VdWContact': 1, 'UNL:THR:VdWContact': 2}"
+205,DiffDock-L,6yao_1_OJ2_0,,0.0,,
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+207,DiffDock-L,6ur1_2_AT3_0,0.8666666666666666,0.6533333333333333,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:HIS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+208,DiffDock-L,4mig_1_G3F_2,,0.0,,
+209,DiffDock-L,6wyz_1_DGL_1,0.46153846153846156,0.8153846153846154,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3}"
+210,DiffDock-L,2v7t_1_SAH_4,0.34782608695652173,0.8608695652173913,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+211,DiffDock-L,3ad7_1_NAD_0,0.4285714285714286,0.8285714285714285,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 6, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+212,DiffDock-L,5hw0_1_GLU_2,0.5555555555555556,0.7777777777777778,"{'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}"
+213,DiffDock-L,5hqx_1_EDZ_0,0.4615384615384614,0.8153846153846154,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+214,DiffDock-L,2q37_1_3AL_0,,0.0,,
+215,DiffDock-L,6n19_2_K8V_0,,0.0,,
+216,DiffDock-L,2v7w_1_5FD_0,0.38095238095238093,0.8476190476190476,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+217,DiffDock-L,4phs_1_UDP_0,,0.0,,
+218,DiffDock-L,4ydx_1_TCE_0,,0.0,,
+219,DiffDock-L,4xfm_1_THE_0,,0.0,,
+220,DiffDock-L,3ub9_1_NHY_1,0.888888888888889,0.6444444444444444,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:VdWContact': 2}"
+221,DiffDock-L,1tkg_1_SSA_0,,0.0,,
+222,DiffDock-L,4o0d_1_GLY_3,,0.0,,
+223,DiffDock-L,6yap_1_OHZ_0,0.7058823529411765,0.7176470588235294,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 4, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ASP:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+224,DiffDock-L,6xb3_3_9BG_1,,0.0,,
+225,DiffDock-L,4kgx_1_CTP_5,0.3333333333333333,0.8666666666666667,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+226,DiffDock-L,3se5_1_ANP_2,0.4666666666666667,0.8133333333333334,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+227,DiffDock-L,6gbf_1_AMP_0,,0.0,,
+228,DiffDock-L,2v7u_1_SAM_2,0.34782608695652173,0.8608695652173913,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+229,DiffDock-L,2gag_1_FOA_0,,0.0,,
+230,DiffDock-L,4uuw_1_AMP_0,0.5882352941176472,0.7647058823529411,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2}"
+231,DiffDock-L,4phr_1_UDP_0,0.375,0.85,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2}"
+232,DiffDock-L,1o72_2_PC_0,,0.0,,
+233,DiffDock-L,4oal_2_245_0,,0.0,,
+234,DiffDock-L,1hg0_1_SIN_1,0.5833333333333333,0.7666666666666667,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3}"
+235,DiffDock-L,3zjx_1_BOG_0,0.6666666666666667,0.7333333333333333,{'UNL:LYS:VdWContact': 1},"{'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+236,DiffDock-L,6pa6_2_ASN_0,,0.0,,
+237,DiffDock-L,1qaw_1_TRP_7,0.6666666666666667,0.7333333333333333,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 3}"
+238,DynamicBind,3s6a_1_ANP_0,0.25,0.9,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1}"
+239,DynamicBind,2gf3_2_FOA_1,0.75,0.7,"{'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:GLN:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+240,DynamicBind,1v2g_1_OCA_0,0.4,0.84,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2}"
+241,DynamicBind,2r4e_1_13P_0,0.6363636363636364,0.7454545454545455,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+242,DynamicBind,3ub7_1_ACM_1,0.49999999999999994,0.8,"{'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:VdWContact': 1}"
+243,DynamicBind,4cdn_2_FAD_0,0.40909090909090906,0.8363636363636364,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+244,DynamicBind,6yaq_1_OHZ_0,0.9285714285714287,0.6285714285714286,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+245,DynamicBind,4cnl_1_CHT_1,1.3333333333333335,0.46666666666666656,"{'UNL:ASP:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 2}",{}
+246,DynamicBind,5k45_2_GLU_1,0.08333333333333337,0.9666666666666667,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+247,DynamicBind,2zcz_2_TRP_3,0.55,0.78,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 3, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 6}"
+248,DynamicBind,5fxd_1_H7Y_1,0.44444444444444453,0.8222222222222222,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+249,DynamicBind,5k3o_2_ASP_0,1.0,0.6,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 4, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}"
+250,DynamicBind,5fxe_1_CIY_1,0.375,0.85,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+251,DynamicBind,5ida_1_BMA_0,0.3,0.88,"{'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+252,DynamicBind,4osy_1_GLY_3,,0.0,,
+253,DynamicBind,5k62_1_ASN-VAL_0,,0.0,,
+254,DynamicBind,5b5s_1_BOG_0,0.49999999999999994,0.8,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:VdWContact': 1}"
+255,DynamicBind,1tke_1_SER_0,0.8571428571428572,0.6571428571428571,"{'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PRO:VdWContact': 1}","{'UNL:CYS:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 3, 'UNL:MET:VdWContact': 1}"
+256,DynamicBind,6paa_1_ASP_2,0.19999999999999996,0.92,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+257,DynamicBind,2gag_1_NAD_0,0.2083333333333333,0.9166666666666667,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+258,DynamicBind,6o6y_1_ACK_0,0.846153846153846,0.6615384615384616,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:VdWContact': 4}"
+259,DynamicBind,3zec_1_ANP_0,0.5833333333333333,0.7666666666666667,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+260,DynamicBind,5mh1_1_BMA_0,,0.0,,
+261,DynamicBind,5dnc_1_ASN_2,,0.0,,
+262,DynamicBind,5u82_2_ZN0_0,,0.0,,
+263,DynamicBind,3wrb_1_GDE_0,0.3846153846153846,0.8461538461538461,"{'UNL:ASN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+264,DynamicBind,6ep5_1_ADP_1,0.46666666666666673,0.8133333333333332,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+265,DynamicBind,2vfu_1_MTL_0,0.1333333333333333,0.9466666666666667,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+266,DynamicBind,3zzs_1_TRP_3,,0.0,,
+267,DynamicBind,6ryz_1_SAM_2,0.20833333333333331,0.9166666666666666,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:CYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+268,DynamicBind,5hmr_1_FDZ_0,1.0,0.6,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}"
+269,DynamicBind,2hs3_1_FGR_0,0.7333333333333334,0.7066666666666667,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1}"
+270,DynamicBind,6etf_1_AMP_0,,0.0,,
+271,DynamicBind,3jqm_1_GTP_5,0.9333333333333333,0.6266666666666667,"{'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+272,DynamicBind,3eca_1_ASP_3,0.29411764705882343,0.8823529411764707,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}"
+273,DynamicBind,4osx_1_GLY_2,,0.0,,
+274,DynamicBind,2ze9_1_PD7_0,0.7272727272727274,0.709090909090909,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+275,DynamicBind,5f52_1_ASP_2,,0.0,,
+276,DynamicBind,6xug_1_O1Q_0,,0.0,,
+277,DynamicBind,4fyv_1_DCP_2,0.625,0.75,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 4, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 3}","{'UNL:ALA:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+278,DynamicBind,2hk9_1_SKM_0,0.4000000000000001,0.84,"{'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+279,DynamicBind,6v2a_1_ASN_3,,0.0,,
+280,DynamicBind,1rqp_1_SAM_0,0.37037037037037035,0.8518518518518519,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+281,DynamicBind,2wr8_1_SAH_1,0.30000000000000004,0.88,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+282,DynamicBind,5gqi_1_ATP_7,0.6111111111111112,0.7555555555555555,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+283,DynamicBind,2vdf_1_OCT_0,2.0,0.19999999999999996,"{'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3}",{}
+284,DynamicBind,4qa8_1_PJZ_0,2.1052631578947367,0.1578947368421053,"{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 5, 'UNL:ILE:VdWContact': 5, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 3, 'UNL:PRO:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 6, 'UNL:VAL:VdWContact': 4}","{'UNL:ALA:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+285,DynamicBind,5k66_1_ASN-GLU_0,,0.0,,
+286,DynamicBind,3gf4_1_FAD_1,0.3103448275862069,0.8758620689655172,"{'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 4, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+287,DynamicBind,4tvd_1_BGC_4,,0.0,,
+288,DynamicBind,1u8u_1_OCA_0,0.3571428571428572,0.8571428571428571,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2}"
+289,DynamicBind,2xta_1_ACO_0,0.375,0.85,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:VdWContact': 3}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1}"
+290,DynamicBind,5hhz_1_ZME_0,1.1666666666666665,0.5333333333333334,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ASP:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2}"
+291,DynamicBind,4xdr_1_ADN_0,,0.0,,
+292,DynamicBind,6uqy_2_AT3_0,0.19999999999999996,0.92,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+293,DynamicBind,5k4h_2_GLU_3,0.39999999999999997,0.8400000000000001,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+294,DynamicBind,4tvd_1_GLC_0,,0.0,,
+295,DynamicBind,1pj2_1_FUM_0,,0.0,,
+296,DynamicBind,6o70_1_ACK_1,0.23076923076923073,0.9076923076923077,"{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+297,DynamicBind,2zd0_1_TRP_9,0.6666666666666667,0.7333333333333333,"{'UNL:ARG:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 4}"
+298,DynamicBind,1uf5_1_CDT_0,0.125,0.95,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+299,DynamicBind,4o95_1_245_0,1.1666666666666665,0.5333333333333334,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}",{'UNL:ASP:VdWContact': 1}
+300,DynamicBind,3ad9_1_NAD_0,0.17241379310344818,0.9310344827586208,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+301,DynamicBind,5k63_1_ASN-GLY_0,,0.0,,
+302,DynamicBind,4rpm_1_HXC_0,,0.0,,
+303,DynamicBind,4pfx_1_UDP_0,,0.0,,
+304,DynamicBind,2gah_1_NAD_0,0.40625,0.8375,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 4, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 4, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+305,DynamicBind,6pa2_1_ASP_2,,0.0,,
+306,DynamicBind,4h2f_1_ADN_0,0.75,0.7,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 4, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:VdWContact': 1}"
+307,DynamicBind,4u63_1_FAD_0,,0.0,,
+308,DynamicBind,4o0f_1_GLY_3,,0.0,,
+309,DynamicBind,2q6k_1_ADN_1,0.26666666666666666,0.8933333333333333,"{'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}"
+310,DynamicBind,5fiu_1_Y3J_3,0.1111111111111111,0.9555555555555556,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}"
+311,DynamicBind,5f2t_1_PLM_0,1.2307692307692308,0.5076923076923077,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:HIS:VdWContact': 1}"
+312,DynamicBind,3ada_1_NAD_0,0.1111111111111111,0.9555555555555556,"{'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+313,DynamicBind,4b4v_1_L34_0,0.2608695652173912,0.8956521739130435,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+314,DynamicBind,4uoc_1_NCN_1,0.5882352941176471,0.7647058823529411,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+315,DynamicBind,3uni_1_SAL_0,,0.0,,
+316,DynamicBind,3o7j_1_2AL_0,0.27272727272727265,0.890909090909091,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 2, 'UNL:PRO:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+317,DynamicBind,2v7v_1_5FD_0,0.3157894736842105,0.8736842105263158,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+318,DynamicBind,4rhe_1_FMN_6,0.3333333333333333,0.8666666666666667,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 4, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 4, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+319,DynamicBind,5fxf_1_BEZ_0,0.27272727272727276,0.8909090909090909,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+320,DynamicBind,2wwc_1_CHT_2,1.6666666666666667,0.33333333333333326,"{'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 2, 'UNL:TYR:VdWContact': 1}",{}
+321,DynamicBind,6qkr_1_FAD_0,0.1071428571428571,0.9571428571428572,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 4, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 4, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1}"
+322,DynamicBind,3inr_1_GDU_0,0.42857142857142855,0.8285714285714285,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+323,DynamicBind,4idk_1_1FE_0,,0.0,,
+324,DynamicBind,6yao_1_OJ2_0,0.7333333333333333,0.7066666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:TYR:VdWContact': 2}"
+325,DynamicBind,6ea9_1_9BG_0,0.36,0.856,"{'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 2}"
+326,DynamicBind,6ur1_2_AT3_0,0.8333333333333333,0.6666666666666667,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:HIS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+327,DynamicBind,4mig_1_G3F_2,,0.0,,
+328,DynamicBind,6wyz_1_DGL_1,0.5833333333333334,0.7666666666666666,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3}"
+329,DynamicBind,2v7t_1_SAH_4,0.21739130434782616,0.9130434782608695,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 3, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+330,DynamicBind,3ad7_1_NAD_0,0.2,0.92,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+331,DynamicBind,5hw0_1_GLU_2,0.21428571428571427,0.9142857142857143,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 2}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}"
+332,DynamicBind,5hqx_1_EDZ_0,0.5333333333333333,0.7866666666666666,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+333,DynamicBind,2q37_1_3AL_0,0.2727272727272728,0.8909090909090909,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 4, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+334,DynamicBind,6n19_2_K8V_0,,0.0,,
+335,DynamicBind,2v7w_1_5FD_0,0.14999999999999997,0.9400000000000001,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+336,DynamicBind,4phs_1_UDP_0,0.35294117647058826,0.8588235294117648,"{'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+337,DynamicBind,4ydx_1_TCE_0,0.6666666666666666,0.7333333333333334,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:CYS:VdWContact': 2, 'UNL:LYS:VdWContact': 1}"
+338,DynamicBind,4xfm_1_THE_0,0.28571428571428564,0.8857142857142858,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:SER:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}"
+339,DynamicBind,3ub9_1_NHY_1,0.5,0.8,"{'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:VdWContact': 2}"
+340,DynamicBind,1tkg_1_SSA_0,0.6111111111111112,0.7555555555555555,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 2}"
+341,DynamicBind,4o0d_1_GLY_3,,0.0,,
+342,DynamicBind,6yap_1_OHZ_0,0.6470588235294117,0.7411764705882353,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+343,DynamicBind,6xb3_3_9BG_1,0.4500000000000002,0.82,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 3, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:VdWContact': 5, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 2}"
+344,DynamicBind,4kgx_1_CTP_5,0.55,0.78,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 3}","{'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+345,DynamicBind,3se5_1_ANP_2,0.3125,0.875,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+346,DynamicBind,6gbf_1_AMP_0,,0.0,,
+347,DynamicBind,2v7u_1_SAM_2,0.3749999999999999,0.8500000000000001,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+348,DynamicBind,2gag_1_FOA_0,0.5625,0.775,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ASN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+349,DynamicBind,4uuw_1_AMP_0,0.5,0.8,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2}"
+350,DynamicBind,4phr_1_UDP_0,0.4285714285714285,0.8285714285714286,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2}"
+351,DynamicBind,1o72_2_PC_0,,0.0,,
+352,DynamicBind,4oal_2_245_0,1.166666666666667,0.5333333333333332,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:LEU:VdWContact': 1}"
+353,DynamicBind,1hg0_1_SIN_1,0.7,0.72,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3}"
+354,DynamicBind,3zjx_1_BOG_0,0.16666666666666669,0.9333333333333333,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+355,DynamicBind,6pa6_2_ASN_0,,0.0,,
+356,DynamicBind,1qaw_1_TRP_7,0.26666666666666666,0.8933333333333333,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 3}"
+357,NeuralPLexer,3s6a_1_ANP_0,0.23076923076923067,0.9076923076923077,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1}"
+358,NeuralPLexer,2gf3_2_FOA_1,0.625,0.75,"{'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:GLN:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+359,NeuralPLexer,1v2g_1_OCA_0,0.33333333333333326,0.8666666666666667,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2}"
+360,NeuralPLexer,2r4e_1_13P_0,0.7000000000000001,0.72,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+361,NeuralPLexer,3ub7_1_ACM_1,0.4285714285714285,0.8285714285714286,"{'UNL:ASP:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:VdWContact': 1}"
+362,NeuralPLexer,4cdn_2_FAD_0,0.4615384615384615,0.8153846153846154,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+363,NeuralPLexer,6yaq_1_OHZ_0,0.7857142857142859,0.6857142857142856,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+364,NeuralPLexer,4cnl_1_CHT_1,1.5,0.4,"{'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 1}",{}
+365,NeuralPLexer,5k45_2_GLU_1,0.2,0.92,"{'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+366,NeuralPLexer,2zcz_2_TRP_3,0.7777777777777779,0.6888888888888889,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 6}"
+367,NeuralPLexer,5fxd_1_H7Y_1,0.7999999999999999,0.68,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+368,NeuralPLexer,5k3o_2_ASP_0,0.4615384615384615,0.8153846153846154,"{'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 4, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}"
+369,NeuralPLexer,5fxe_1_CIY_1,0.3333333333333333,0.8666666666666667,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+370,NeuralPLexer,5ida_1_BMA_0,0.33333333333333337,0.8666666666666667,"{'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+371,NeuralPLexer,4osy_1_GLY_3,,0.0,,
+372,NeuralPLexer,5k62_1_ASN-VAL_0,,0.0,,
+373,NeuralPLexer,5b5s_1_BOG_0,0.14285714285714285,0.9428571428571428,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:VdWContact': 1}"
+374,NeuralPLexer,1tke_1_SER_0,0.5,0.8,"{'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:CYS:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 3, 'UNL:MET:VdWContact': 1}"
+375,NeuralPLexer,6paa_1_ASP_2,0.2500000000000001,0.8999999999999999,"{'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+376,NeuralPLexer,2gag_1_NAD_0,0.3103448275862067,0.8758620689655173,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 7, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+377,NeuralPLexer,6o6y_1_ACK_0,0.6875,0.725,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:VdWContact': 4}"
+378,NeuralPLexer,3zec_1_ANP_0,0.5,0.8,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+379,NeuralPLexer,5mh1_1_BMA_0,,0.0,,
+380,NeuralPLexer,5dnc_1_ASN_2,,0.0,,
+381,NeuralPLexer,5u82_2_ZN0_0,,0.0,,
+382,NeuralPLexer,3wrb_1_GDE_0,0.4999999999999999,0.8,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+383,NeuralPLexer,6ep5_1_ADP_1,0.5263157894736843,0.7894736842105263,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+384,NeuralPLexer,2vfu_1_MTL_0,0.1333333333333333,0.9466666666666667,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+385,NeuralPLexer,3zzs_1_TRP_3,,0.0,,
+386,NeuralPLexer,6ryz_1_SAM_2,0.04999999999999993,0.98,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+387,NeuralPLexer,5hmr_1_FDZ_0,0.7000000000000001,0.72,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}"
+388,NeuralPLexer,2hs3_1_FGR_0,0.2666666666666667,0.8933333333333333,"{'UNL:ALA:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 3}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1}"
+389,NeuralPLexer,6etf_1_AMP_0,,0.0,,
+390,NeuralPLexer,3jqm_1_GTP_5,0.625,0.75,"{'UNL:ALA:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+391,NeuralPLexer,3eca_1_ASP_3,0.42857142857142855,0.8285714285714285,"{'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}"
+392,NeuralPLexer,4osx_1_GLY_2,,0.0,,
+393,NeuralPLexer,2ze9_1_PD7_0,0.25,0.9,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+394,NeuralPLexer,5f52_1_ASP_2,,0.0,,
+395,NeuralPLexer,6xug_1_O1Q_0,,0.0,,
+396,NeuralPLexer,4fyv_1_DCP_2,0.3846153846153846,0.8461538461538461,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+397,NeuralPLexer,2hk9_1_SKM_0,0.09090909090909094,0.9636363636363636,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+398,NeuralPLexer,6v2a_1_ASN_3,,0.0,,
+399,NeuralPLexer,1rqp_1_SAM_0,0.39130434782608703,0.8434782608695652,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+400,NeuralPLexer,2wr8_1_SAH_1,0.4375,0.825,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+401,NeuralPLexer,5gqi_1_ATP_7,0.25,0.9,"{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+402,NeuralPLexer,2vdf_1_OCT_0,1.0,0.6,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1}",{}
+403,NeuralPLexer,4qa8_1_PJZ_0,1.3333333333333333,0.4666666666666667,"{'UNL:ILE:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 4}","{'UNL:ALA:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+404,NeuralPLexer,5k66_1_ASN-GLU_0,,0.0,,
+405,NeuralPLexer,3gf4_1_FAD_1,0.3103448275862068,0.8758620689655173,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+406,NeuralPLexer,4tvd_1_BGC_4,0.6000000000000001,0.76,"{'UNL:GLU:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:VdWContact': 1}","{'UNL:GLU:VdWContact': 2, 'UNL:TYR:VdWContact': 2}"
+407,NeuralPLexer,1u8u_1_OCA_0,0.38461538461538464,0.8461538461538461,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2}"
+408,NeuralPLexer,2xta_1_ACO_0,0.7222222222222222,0.7111111111111111,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 3, 'UNL:SER:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1}"
+409,NeuralPLexer,5hhz_1_ZME_0,1.0,0.6,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2}"
+410,NeuralPLexer,4xdr_1_ADN_0,,0.0,,
+411,NeuralPLexer,6uqy_2_AT3_0,0.3076923076923077,0.8769230769230769,"{'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+412,NeuralPLexer,5k4h_2_GLU_3,0.09090909090909094,0.9636363636363636,"{'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+413,NeuralPLexer,4tvd_1_GLC_0,0.8333333333333334,0.6666666666666666,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2}","{'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:LYS:VdWContact': 2}"
+414,NeuralPLexer,1pj2_1_FUM_0,,0.0,,
+415,NeuralPLexer,6o70_1_ACK_1,0.09090909090909094,0.9636363636363636,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+416,NeuralPLexer,2zd0_1_TRP_9,0.4615384615384614,0.8153846153846154,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 4}"
+417,NeuralPLexer,1uf5_1_CDT_0,0.4285714285714287,0.8285714285714285,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+418,NeuralPLexer,4o95_1_245_0,1.1428571428571428,0.5428571428571429,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}",{'UNL:ASP:VdWContact': 1}
+419,NeuralPLexer,3ad9_1_NAD_0,0.3333333333333334,0.8666666666666667,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+420,NeuralPLexer,5k63_1_ASN-GLY_0,,0.0,,
+421,NeuralPLexer,4rpm_1_HXC_0,,0.0,,
+422,NeuralPLexer,4pfx_1_UDP_0,0.19047619047619035,0.9238095238095239,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+423,NeuralPLexer,2gah_1_NAD_0,0.1428571428571429,0.9428571428571428,"{'UNL:ALA:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 4, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 3}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 4, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+424,NeuralPLexer,6pa2_1_ASP_2,,0.0,,
+425,NeuralPLexer,4h2f_1_ADN_0,0.375,0.85,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:VdWContact': 1}"
+426,NeuralPLexer,4u63_1_FAD_0,0.3999999999999999,0.8400000000000001,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 3, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+427,NeuralPLexer,4o0f_1_GLY_3,,0.0,,
+428,NeuralPLexer,2q6k_1_ADN_1,0.4545454545454545,0.8181818181818182,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}"
+429,NeuralPLexer,5fiu_1_Y3J_3,0.3333333333333334,0.8666666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}"
+430,NeuralPLexer,5f2t_1_PLM_0,1.4117647058823528,0.43529411764705883,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:HIS:VdWContact': 1}"
+431,NeuralPLexer,3ada_1_NAD_0,0.33333333333333337,0.8666666666666667,"{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+432,NeuralPLexer,4b4v_1_L34_0,0.23529411764705882,0.9058823529411765,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+433,NeuralPLexer,4uoc_1_NCN_1,0.4,0.84,"{'UNL:ALA:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+434,NeuralPLexer,3uni_1_SAL_0,,0.0,,
+435,NeuralPLexer,3o7j_1_2AL_0,0.25,0.9,"{'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+436,NeuralPLexer,2v7v_1_5FD_0,0.5,0.8,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+437,NeuralPLexer,4rhe_1_FMN_6,0.33333333333333326,0.8666666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 4, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 4, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+438,NeuralPLexer,5fxf_1_BEZ_0,0.4285714285714286,0.8285714285714285,"{'UNL:ASP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+439,NeuralPLexer,2wwc_1_CHT_2,1.5,0.4,"{'UNL:GLY:VdWContact': 1, 'UNL:TYR:VdWContact': 2}",{}
+440,NeuralPLexer,6qkr_1_FAD_0,0.3,0.88,"{'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 6, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 4, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1}"
+441,NeuralPLexer,3inr_1_GDU_0,0.5000000000000001,0.7999999999999999,"{'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 4}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+442,NeuralPLexer,4idk_1_1FE_0,0.5714285714285715,0.7714285714285714,"{'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLU:VdWContact': 1, 'UNL:THR:VdWContact': 2}"
+443,NeuralPLexer,6yao_1_OJ2_0,0.7999999999999999,0.68,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:TYR:VdWContact': 2}"
+444,NeuralPLexer,6ea9_1_9BG_0,0.3888888888888889,0.8444444444444444,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 2}"
+445,NeuralPLexer,6ur1_2_AT3_0,0.75,0.7,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:HIS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+446,NeuralPLexer,4mig_1_G3F_2,,0.0,,
+447,NeuralPLexer,6wyz_1_DGL_1,1.375,0.44999999999999996,"{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3}"
+448,NeuralPLexer,2v7t_1_SAH_4,0.29166666666666674,0.8833333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+449,NeuralPLexer,3ad7_1_NAD_0,0.47619047619047616,0.8095238095238095,"{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 5, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 2, 'UNL:GLY:VdWContact': 4, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 3}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+450,NeuralPLexer,5hw0_1_GLU_2,0.6666666666666666,0.7333333333333334,"{'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}"
+451,NeuralPLexer,5hqx_1_EDZ_0,0.6923076923076923,0.7230769230769231,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+452,NeuralPLexer,2q37_1_3AL_0,0.36363636363636376,0.8545454545454545,"{'UNL:ALA:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 4, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+453,NeuralPLexer,6n19_2_K8V_0,,0.0,,
+454,NeuralPLexer,2v7w_1_5FD_0,0.40909090909090906,0.8363636363636364,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+455,NeuralPLexer,4phs_1_UDP_0,0.23529411764705876,0.9058823529411765,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+456,NeuralPLexer,4ydx_1_TCE_0,0.75,0.7,"{'UNL:ALA:VdWContact': 1, 'UNL:CYS:Hydrophobic': 2, 'UNL:CYS:VdWContact': 2, 'UNL:LYS:VdWContact': 1}","{'UNL:CYS:VdWContact': 2, 'UNL:LYS:VdWContact': 1}"
+457,NeuralPLexer,4xfm_1_THE_0,0.33333333333333326,0.8666666666666667,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}"
+458,NeuralPLexer,3ub9_1_NHY_1,0.8333333333333333,0.6666666666666667,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:VdWContact': 2}"
+459,NeuralPLexer,1tkg_1_SSA_0,0.7,0.72,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 2}"
+460,NeuralPLexer,4o0d_1_GLY_3,,0.0,,
+461,NeuralPLexer,6yap_1_OHZ_0,0.5882352941176471,0.7647058823529411,"{'UNL:ARG:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:SER:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+462,NeuralPLexer,6xb3_3_9BG_1,0.5217391304347828,0.7913043478260868,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 4, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:VdWContact': 5, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 2}"
+463,NeuralPLexer,4kgx_1_CTP_5,0.17647058823529416,0.9294117647058824,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+464,NeuralPLexer,3se5_1_ANP_2,0.1333333333333333,0.9466666666666667,"{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+465,NeuralPLexer,6gbf_1_AMP_0,,0.0,,
+466,NeuralPLexer,2v7u_1_SAM_2,0.4583333333333334,0.8166666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+467,NeuralPLexer,2gag_1_FOA_0,0.4166666666666667,0.8333333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+468,NeuralPLexer,4uuw_1_AMP_0,0.22222222222222227,0.9111111111111111,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2}"
+469,NeuralPLexer,4phr_1_UDP_0,0.16666666666666669,0.9333333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2}"
+470,NeuralPLexer,1o72_2_PC_0,1.0,0.6,"{'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 4, 'UNL:VAL:VdWContact': 1}","{'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}"
+471,NeuralPLexer,4oal_2_245_0,0.7777777777777779,0.6888888888888889,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:LEU:VdWContact': 1}"
+472,NeuralPLexer,1hg0_1_SIN_1,0.5,0.8,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3}"
+473,NeuralPLexer,3zjx_1_BOG_0,0.33333333333333337,0.8666666666666667,"{'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2}","{'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+474,NeuralPLexer,6pa6_2_ASN_0,,0.0,,
+475,NeuralPLexer,1qaw_1_TRP_7,0.6666666666666667,0.7333333333333333,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 3}"
+476,RFAA,3s6a_1_ANP_0,,0.0,,
+477,RFAA,2gf3_2_FOA_1,,0.0,,
+478,RFAA,1v2g_1_OCA_0,0.16666666666666663,0.9333333333333333,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2}"
+479,RFAA,2r4e_1_13P_0,,0.0,,
+480,RFAA,3ub7_1_ACM_1,0.42857142857142855,0.8285714285714285,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3}","{'UNL:ASP:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:VdWContact': 1}"
+481,RFAA,4cdn_2_FAD_0,,0.0,,
+482,RFAA,6yaq_1_OHZ_0,,0.0,,
+483,RFAA,4cnl_1_CHT_1,1.5714285714285714,0.37142857142857144,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 3, 'UNL:TYR:VdWContact': 3}",{}
+484,RFAA,5k45_2_GLU_1,,0.0,,
+485,RFAA,2zcz_2_TRP_3,,0.0,,
+486,RFAA,5fxd_1_H7Y_1,0.5,0.8,"{'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ASP:VdWContact': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+487,RFAA,5k3o_2_ASP_0,,0.0,,
+488,RFAA,5fxe_1_CIY_1,,0.0,,
+489,RFAA,5ida_1_BMA_0,,0.0,,
+490,RFAA,4osy_1_GLY_3,,0.0,,
+491,RFAA,5k62_1_ASN-VAL_0,,0.0,,
+492,RFAA,5b5s_1_BOG_0,,0.0,,
+493,RFAA,1tke_1_SER_0,,0.0,,
+494,RFAA,6paa_1_ASP_2,,0.0,,
+495,RFAA,2gag_1_NAD_0,,0.0,,
+496,RFAA,6o6y_1_ACK_0,,0.0,,
+497,RFAA,3zec_1_ANP_0,,0.0,,
+498,RFAA,5mh1_1_BMA_0,,0.0,,
+499,RFAA,5dnc_1_ASN_2,,0.0,,
+500,RFAA,5u82_2_ZN0_0,,0.0,,
+501,RFAA,3wrb_1_GDE_0,,0.0,,
+502,RFAA,6ep5_1_ADP_1,,0.0,,
+503,RFAA,2vfu_1_MTL_0,,0.0,,
+504,RFAA,3zzs_1_TRP_3,,0.0,,
+505,RFAA,6ryz_1_SAM_2,,0.0,,
+506,RFAA,5hmr_1_FDZ_0,,0.0,,
+507,RFAA,2hs3_1_FGR_0,0.1428571428571429,0.9428571428571428,"{'UNL:ALA:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1}"
+508,RFAA,6etf_1_AMP_0,,0.0,,
+509,RFAA,3jqm_1_GTP_5,,0.0,,
+510,RFAA,3eca_1_ASP_3,,0.0,,
+511,RFAA,4osx_1_GLY_2,,0.0,,
+512,RFAA,2ze9_1_PD7_0,,0.0,,
+513,RFAA,5f52_1_ASP_2,,0.0,,
+514,RFAA,6xug_1_O1Q_0,,0.0,,
+515,RFAA,4fyv_1_DCP_2,0.6000000000000001,0.76,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+516,RFAA,2hk9_1_SKM_0,,0.0,,
+517,RFAA,6v2a_1_ASN_3,,0.0,,
+518,RFAA,1rqp_1_SAM_0,,0.0,,
+519,RFAA,2wr8_1_SAH_1,,0.0,,
+520,RFAA,5gqi_1_ATP_7,0.7647058823529413,0.6941176470588235,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 3, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+521,RFAA,2vdf_1_OCT_0,,0.0,,
+522,RFAA,4qa8_1_PJZ_0,,0.0,,
+523,RFAA,5k66_1_ASN-GLU_0,,0.0,,
+524,RFAA,3gf4_1_FAD_1,0.2,0.92,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+525,RFAA,4tvd_1_BGC_4,,0.0,,
+526,RFAA,1u8u_1_OCA_0,0.3571428571428571,0.8571428571428572,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2}"
+527,RFAA,2xta_1_ACO_0,,0.0,,
+528,RFAA,5hhz_1_ZME_0,,0.0,,
+529,RFAA,4xdr_1_ADN_0,,0.0,,
+530,RFAA,6uqy_2_AT3_0,,0.0,,
+531,RFAA,5k4h_2_GLU_3,,0.0,,
+532,RFAA,4tvd_1_GLC_0,,0.0,,
+533,RFAA,1pj2_1_FUM_0,,0.0,,
+534,RFAA,6o70_1_ACK_1,,0.0,,
+535,RFAA,2zd0_1_TRP_9,,0.0,,
+536,RFAA,1uf5_1_CDT_0,,0.0,,
+537,RFAA,4o95_1_245_0,,0.0,,
+538,RFAA,3ad9_1_NAD_0,,0.0,,
+539,RFAA,5k63_1_ASN-GLY_0,,0.0,,
+540,RFAA,4rpm_1_HXC_0,,0.0,,
+541,RFAA,4pfx_1_UDP_0,0.5882352941176471,0.7647058823529411,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+542,RFAA,2gah_1_NAD_0,,0.0,,
+543,RFAA,6pa2_1_ASP_2,,0.0,,
+544,RFAA,4h2f_1_ADN_0,,0.0,,
+545,RFAA,4u63_1_FAD_0,,0.0,,
+546,RFAA,4o0f_1_GLY_3,,0.0,,
+547,RFAA,2q6k_1_ADN_1,,0.0,,
+548,RFAA,5fiu_1_Y3J_3,,0.0,,
+549,RFAA,5f2t_1_PLM_0,,0.0,,
+550,RFAA,3ada_1_NAD_0,,0.0,,
+551,RFAA,4b4v_1_L34_0,,0.0,,
+552,RFAA,4uoc_1_NCN_1,,0.0,,
+553,RFAA,3uni_1_SAL_0,,0.0,,
+554,RFAA,3o7j_1_2AL_0,0.23076923076923078,0.9076923076923077,"{'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+555,RFAA,2v7v_1_5FD_0,,0.0,,
+556,RFAA,4rhe_1_FMN_6,,0.0,,
+557,RFAA,5fxf_1_BEZ_0,,0.0,,
+558,RFAA,2wwc_1_CHT_2,,0.0,,
+559,RFAA,6qkr_1_FAD_0,,0.0,,
+560,RFAA,3inr_1_GDU_0,,0.0,,
+561,RFAA,4idk_1_1FE_0,,0.0,,
+562,RFAA,6yao_1_OJ2_0,,0.0,,
+563,RFAA,6ea9_1_9BG_0,,0.0,,
+564,RFAA,6ur1_2_AT3_0,0.5999999999999999,0.76,"{'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:HIS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+565,RFAA,4mig_1_G3F_2,,0.0,,
+566,RFAA,6wyz_1_DGL_1,,0.0,,
+567,RFAA,2v7t_1_SAH_4,,0.0,,
+568,RFAA,3ad7_1_NAD_0,,0.0,,
+569,RFAA,5hw0_1_GLU_2,,0.0,,
+570,RFAA,5hqx_1_EDZ_0,0.5,0.8,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+571,RFAA,2q37_1_3AL_0,,0.0,,
+572,RFAA,6n19_2_K8V_0,,0.0,,
+573,RFAA,2v7w_1_5FD_0,,0.0,,
+574,RFAA,4phs_1_UDP_0,0.4375,0.825,"{'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+575,RFAA,4ydx_1_TCE_0,,0.0,,
+576,RFAA,4xfm_1_THE_0,,0.0,,
+577,RFAA,3ub9_1_NHY_1,,0.0,,
+578,RFAA,1tkg_1_SSA_0,0.4285714285714286,0.8285714285714285,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 2}"
+579,RFAA,4o0d_1_GLY_3,,0.0,,
+580,RFAA,6yap_1_OHZ_0,0.16666666666666674,0.9333333333333333,"{'UNL:ALA:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 3, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+581,RFAA,6xb3_3_9BG_1,,0.0,,
+582,RFAA,4kgx_1_CTP_5,0.25000000000000006,0.9,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+583,RFAA,3se5_1_ANP_2,,0.0,,
+584,RFAA,6gbf_1_AMP_0,,0.0,,
+585,RFAA,2v7u_1_SAM_2,0.24999999999999992,0.9,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+586,RFAA,2gag_1_FOA_0,,0.0,,
+587,RFAA,4uuw_1_AMP_0,,0.0,,
+588,RFAA,4phr_1_UDP_0,,0.0,,
+589,RFAA,1o72_2_PC_0,,0.0,,
+590,RFAA,4oal_2_245_0,,0.0,,
+591,RFAA,1hg0_1_SIN_1,,0.0,,
+592,RFAA,3zjx_1_BOG_0,,0.0,,
+593,RFAA,6pa6_2_ASN_0,,0.0,,
+594,RFAA,1qaw_1_TRP_7,,0.0,,
+595,Chai-1-Single-Seq,3s6a_1_ANP_0,0.39999999999999997,0.8400000000000001,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1}"
+596,Chai-1-Single-Seq,2gf3_2_FOA_1,0.7000000000000001,0.72,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:GLN:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+597,Chai-1-Single-Seq,1v2g_1_OCA_0,0.6470588235294118,0.7411764705882353,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2}"
+598,Chai-1-Single-Seq,2r4e_1_13P_0,0.7999999999999999,0.68,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+599,Chai-1-Single-Seq,3ub7_1_ACM_1,1.2000000000000002,0.5199999999999999,{'UNL:TYR:VdWContact': 1},"{'UNL:ASP:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:VdWContact': 1}"
+600,Chai-1-Single-Seq,4cdn_2_FAD_0,0.48000000000000004,0.808,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+601,Chai-1-Single-Seq,6yaq_1_OHZ_0,0.9333333333333333,0.6266666666666667,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+602,Chai-1-Single-Seq,4cnl_1_CHT_1,1.0,0.6,{'UNL:MET:VdWContact': 1},{}
+603,Chai-1-Single-Seq,5k45_2_GLU_1,0.5714285714285714,0.7714285714285715,"{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+604,Chai-1-Single-Seq,2zcz_2_TRP_3,0.33333333333333326,0.8666666666666667,"{'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 6}"
+605,Chai-1-Single-Seq,5fxd_1_H7Y_1,1.25,0.5,{},"{'UNL:ASP:VdWContact': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+606,Chai-1-Single-Seq,5k3o_2_ASP_0,0.5384615384615384,0.7846153846153846,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}","{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 4, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}"
+607,Chai-1-Single-Seq,5fxe_1_CIY_1,1.2,0.52,{},"{'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+608,Chai-1-Single-Seq,5ida_1_BMA_0,0.375,0.85,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+609,Chai-1-Single-Seq,4osy_1_GLY_3,,0.0,,
+610,Chai-1-Single-Seq,5k62_1_ASN-VAL_0,,0.0,,
+611,Chai-1-Single-Seq,5b5s_1_BOG_0,1.0,0.6,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:VdWContact': 1}"
+612,Chai-1-Single-Seq,1tke_1_SER_0,0.6000000000000001,0.76,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1}","{'UNL:CYS:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 3, 'UNL:MET:VdWContact': 1}"
+613,Chai-1-Single-Seq,6paa_1_ASP_2,,0.0,,
+614,Chai-1-Single-Seq,2gag_1_NAD_0,0.6086956521739131,0.7565217391304347,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 4, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+615,Chai-1-Single-Seq,6o6y_1_ACK_0,0.6875,0.725,"{'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:VdWContact': 4}"
+616,Chai-1-Single-Seq,3zec_1_ANP_0,0.4666666666666668,0.8133333333333332,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+617,Chai-1-Single-Seq,5mh1_1_BMA_0,,0.0,,
+618,Chai-1-Single-Seq,5dnc_1_ASN_2,,0.0,,
+619,Chai-1-Single-Seq,5u82_2_ZN0_0,,0.0,,
+620,Chai-1-Single-Seq,3wrb_1_GDE_0,0.8571428571428571,0.6571428571428571,"{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+621,Chai-1-Single-Seq,6ep5_1_ADP_1,0.35294117647058826,0.8588235294117648,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+622,Chai-1-Single-Seq,2vfu_1_MTL_0,0.23076923076923078,0.9076923076923077,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+623,Chai-1-Single-Seq,3zzs_1_TRP_3,,0.0,,
+624,Chai-1-Single-Seq,6ryz_1_SAM_2,0.08000000000000002,0.968,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+625,Chai-1-Single-Seq,5hmr_1_FDZ_0,0.7,0.72,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}"
+626,Chai-1-Single-Seq,2hs3_1_FGR_0,0.13333333333333333,0.9466666666666667,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:SER:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1}"
+627,Chai-1-Single-Seq,6etf_1_AMP_0,,0.0,,
+628,Chai-1-Single-Seq,3jqm_1_GTP_5,1.0,0.6,{},"{'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+629,Chai-1-Single-Seq,3eca_1_ASP_3,0.18181818181818188,0.9272727272727272,"{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}"
+630,Chai-1-Single-Seq,4osx_1_GLY_2,,0.0,,
+631,Chai-1-Single-Seq,2ze9_1_PD7_0,0.75,0.7,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PRO:Hydrophobic': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+632,Chai-1-Single-Seq,5f52_1_ASP_2,,0.0,,
+633,Chai-1-Single-Seq,6xug_1_O1Q_0,,0.0,,
+634,Chai-1-Single-Seq,4fyv_1_DCP_2,0.5833333333333333,0.7666666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+635,Chai-1-Single-Seq,2hk9_1_SKM_0,0.6428571428571429,0.7428571428571429,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+636,Chai-1-Single-Seq,6v2a_1_ASN_3,,0.0,,
+637,Chai-1-Single-Seq,1rqp_1_SAM_0,0.15000000000000008,0.94,"{'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+638,Chai-1-Single-Seq,2wr8_1_SAH_1,0.4375,0.825,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+639,Chai-1-Single-Seq,5gqi_1_ATP_7,0.0,1.0,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+640,Chai-1-Single-Seq,2vdf_1_OCT_0,1.0,0.6,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}",{}
+641,Chai-1-Single-Seq,4qa8_1_PJZ_0,1.7058823529411766,0.3176470588235294,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 6, 'UNL:VAL:VdWContact': 4}","{'UNL:ALA:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+642,Chai-1-Single-Seq,5k66_1_ASN-GLU_0,,0.0,,
+643,Chai-1-Single-Seq,3gf4_1_FAD_1,0.2592592592592592,0.8962962962962964,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+644,Chai-1-Single-Seq,4tvd_1_BGC_4,,0.0,,
+645,Chai-1-Single-Seq,1u8u_1_OCA_0,0.7368421052631579,0.7052631578947368,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2}"
+646,Chai-1-Single-Seq,2xta_1_ACO_0,0.4615384615384615,0.8153846153846154,"{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1}"
+647,Chai-1-Single-Seq,5hhz_1_ZME_0,1.0,0.6,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2}"
+648,Chai-1-Single-Seq,4xdr_1_ADN_0,,0.0,,
+649,Chai-1-Single-Seq,6uqy_2_AT3_0,0.18181818181818185,0.9272727272727272,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+650,Chai-1-Single-Seq,5k4h_2_GLU_3,0.1428571428571429,0.9428571428571428,"{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+651,Chai-1-Single-Seq,4tvd_1_GLC_0,,0.0,,
+652,Chai-1-Single-Seq,1pj2_1_FUM_0,0.6666666666666667,0.7333333333333333,"{'UNL:ARG:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2}"
+653,Chai-1-Single-Seq,6o70_1_ACK_1,0.411764705882353,0.8352941176470587,"{'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+654,Chai-1-Single-Seq,2zd0_1_TRP_9,0.22222222222222227,0.9111111111111111,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 4}"
+655,Chai-1-Single-Seq,1uf5_1_CDT_0,0.4,0.84,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+656,Chai-1-Single-Seq,4o95_1_245_0,1.1,0.5599999999999999,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}",{'UNL:ASP:VdWContact': 1}
+657,Chai-1-Single-Seq,3ad9_1_NAD_0,0.4545454545454546,0.8181818181818181,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 5, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+658,Chai-1-Single-Seq,5k63_1_ASN-GLY_0,,0.0,,
+659,Chai-1-Single-Seq,4rpm_1_HXC_0,,0.0,,
+660,Chai-1-Single-Seq,4pfx_1_UDP_0,,0.0,,
+661,Chai-1-Single-Seq,2gah_1_NAD_0,0.49999999999999994,0.8,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 4, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+662,Chai-1-Single-Seq,6pa2_1_ASP_2,,0.0,,
+663,Chai-1-Single-Seq,4h2f_1_ADN_0,0.29999999999999993,0.88,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:VdWContact': 1}"
+664,Chai-1-Single-Seq,4u63_1_FAD_0,0.5862068965517241,0.7655172413793103,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 2, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+665,Chai-1-Single-Seq,4o0f_1_GLY_3,,0.0,,
+666,Chai-1-Single-Seq,2q6k_1_ADN_1,0.11764705882352944,0.9529411764705882,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2}","{'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}"
+667,Chai-1-Single-Seq,5fiu_1_Y3J_3,0.25,0.9,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}"
+668,Chai-1-Single-Seq,5f2t_1_PLM_0,1.375,0.44999999999999996,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ARG:VdWContact': 1, 'UNL:HIS:VdWContact': 1}"
+669,Chai-1-Single-Seq,3ada_1_NAD_0,0.5217391304347827,0.7913043478260869,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 4, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 5, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+670,Chai-1-Single-Seq,4b4v_1_L34_0,0.375,0.85,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+671,Chai-1-Single-Seq,4uoc_1_NCN_1,0.30434782608695654,0.8782608695652174,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+672,Chai-1-Single-Seq,3uni_1_SAL_0,,0.0,,
+673,Chai-1-Single-Seq,3o7j_1_2AL_0,0.49999999999999994,0.8,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+674,Chai-1-Single-Seq,2v7v_1_5FD_0,0.4347826086956521,0.8260869565217391,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 3, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+675,Chai-1-Single-Seq,4rhe_1_FMN_6,0.875,0.65,"{'UNL:ARG:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 4, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 4, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+676,Chai-1-Single-Seq,5fxf_1_BEZ_0,0.25,0.9,"{'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+677,Chai-1-Single-Seq,2wwc_1_CHT_2,1.3333333333333335,0.46666666666666656,"{'UNL:GLY:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 2}",{}
+678,Chai-1-Single-Seq,6qkr_1_FAD_0,0.4146341463414634,0.8341463414634147,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 4, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1}"
+679,Chai-1-Single-Seq,3inr_1_GDU_0,0.6111111111111112,0.7555555555555555,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 3, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+680,Chai-1-Single-Seq,4idk_1_1FE_0,0.5,0.8,"{'UNL:GLN:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2}","{'UNL:GLU:VdWContact': 1, 'UNL:THR:VdWContact': 2}"
+681,Chai-1-Single-Seq,6yao_1_OJ2_0,1.0,0.6,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:TYR:VdWContact': 2}"
+682,Chai-1-Single-Seq,6ea9_1_9BG_0,0.5714285714285713,0.7714285714285715,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 2}"
+683,Chai-1-Single-Seq,6ur1_2_AT3_0,0.8333333333333334,0.6666666666666666,"{'UNL:ASN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:HIS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+684,Chai-1-Single-Seq,4mig_1_G3F_2,0.8,0.6799999999999999,"{'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+685,Chai-1-Single-Seq,6wyz_1_DGL_1,0.5833333333333334,0.7666666666666666,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3}"
+686,Chai-1-Single-Seq,2v7t_1_SAH_4,0.4210526315789474,0.831578947368421,"{'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+687,Chai-1-Single-Seq,3ad7_1_NAD_0,0.4761904761904761,0.8095238095238095,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 4, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 4, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+688,Chai-1-Single-Seq,5hw0_1_GLU_2,0.8,0.6799999999999999,"{'UNL:ALA:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}"
+689,Chai-1-Single-Seq,5hqx_1_EDZ_0,0.3333333333333334,0.8666666666666667,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+690,Chai-1-Single-Seq,2q37_1_3AL_0,0.36363636363636365,0.8545454545454545,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 4, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+691,Chai-1-Single-Seq,6n19_2_K8V_0,,0.0,,
+692,Chai-1-Single-Seq,2v7w_1_5FD_0,0.2631578947368421,0.8947368421052632,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+693,Chai-1-Single-Seq,4phs_1_UDP_0,0.3529411764705882,0.8588235294117648,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+694,Chai-1-Single-Seq,4ydx_1_TCE_0,0.33333333333333337,0.8666666666666667,"{'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1}","{'UNL:CYS:VdWContact': 2, 'UNL:LYS:VdWContact': 1}"
+695,Chai-1-Single-Seq,4xfm_1_THE_0,0.375,0.85,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}"
+696,Chai-1-Single-Seq,3ub9_1_NHY_1,0.5,0.8,"{'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:VdWContact': 2}"
+697,Chai-1-Single-Seq,1tkg_1_SSA_0,0.3076923076923077,0.8769230769230769,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:PRO:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 2}"
+698,Chai-1-Single-Seq,4o0d_1_GLY_3,,0.0,,
+699,Chai-1-Single-Seq,6yap_1_OHZ_0,0.5833333333333334,0.7666666666666666,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+700,Chai-1-Single-Seq,6xb3_3_9BG_1,0.40000000000000013,0.84,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:VdWContact': 5, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 2}"
+701,Chai-1-Single-Seq,4kgx_1_CTP_5,0.23076923076923078,0.9076923076923077,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+702,Chai-1-Single-Seq,3se5_1_ANP_2,0.38888888888888895,0.8444444444444444,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+703,Chai-1-Single-Seq,6gbf_1_AMP_0,,0.0,,
+704,Chai-1-Single-Seq,2v7u_1_SAM_2,0.3333333333333333,0.8666666666666667,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+705,Chai-1-Single-Seq,2gag_1_FOA_0,0.36363636363636365,0.8545454545454545,"{'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+706,Chai-1-Single-Seq,4uuw_1_AMP_0,0.7142857142857144,0.7142857142857142,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2}"
+707,Chai-1-Single-Seq,4phr_1_UDP_0,0.4444444444444445,0.8222222222222222,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2}"
+708,Chai-1-Single-Seq,1o72_2_PC_0,0.25,0.9,"{'UNL:ARG:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}"
+709,Chai-1-Single-Seq,4oal_2_245_0,0.8888888888888891,0.6444444444444444,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:LEU:VdWContact': 1}"
+710,Chai-1-Single-Seq,1hg0_1_SIN_1,0.5454545454545454,0.7818181818181819,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3}"
+711,Chai-1-Single-Seq,3zjx_1_BOG_0,0.8,0.6799999999999999,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+712,Chai-1-Single-Seq,6pa6_2_ASN_0,,0.0,,
+713,Chai-1-Single-Seq,1qaw_1_TRP_7,0.4285714285714285,0.8285714285714286,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 3}"
+714,Chai-1,3s6a_1_ANP_0,0.38461538461538464,0.8461538461538461,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1}"
+715,Chai-1,2gf3_2_FOA_1,,0.0,,
+716,Chai-1,1v2g_1_OCA_0,0.6666666666666667,0.7333333333333333,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2}"
+717,Chai-1,2r4e_1_13P_0,0.3333333333333333,0.8666666666666667,"{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+718,Chai-1,3ub7_1_ACM_1,,0.0,,
+719,Chai-1,4cdn_2_FAD_0,0.5200000000000001,0.7919999999999999,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 4, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+720,Chai-1,6yaq_1_OHZ_0,0.8125,0.675,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+721,Chai-1,4cnl_1_CHT_1,1.3333333333333335,0.46666666666666656,"{'UNL:MET:VdWContact': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 1}",{}
+722,Chai-1,5k45_2_GLU_1,0.5714285714285714,0.7714285714285715,"{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+723,Chai-1,2zcz_2_TRP_3,0.4375,0.825,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 6}"
+724,Chai-1,5fxd_1_H7Y_1,1.25,0.5,{},"{'UNL:ASP:VdWContact': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+725,Chai-1,5k3o_2_ASP_0,0.49999999999999994,0.8,"{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 4, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}"
+726,Chai-1,5fxe_1_CIY_1,1.2,0.52,{},"{'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+727,Chai-1,5ida_1_BMA_0,0.375,0.85,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+728,Chai-1,4osy_1_GLY_3,,0.0,,
+729,Chai-1,5k62_1_ASN-VAL_0,,0.0,,
+730,Chai-1,5b5s_1_BOG_0,0.625,0.75,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:VdWContact': 1}"
+731,Chai-1,1tke_1_SER_0,0.5454545454545454,0.7818181818181819,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:CYS:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 3, 'UNL:MET:VdWContact': 1}"
+732,Chai-1,6paa_1_ASP_2,0.33333333333333326,0.8666666666666667,"{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+733,Chai-1,2gag_1_NAD_0,0.17391304347826086,0.9304347826086956,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 3, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+734,Chai-1,6o6y_1_ACK_0,0.9090909090909091,0.6363636363636364,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:VdWContact': 4}"
+735,Chai-1,3zec_1_ANP_0,,0.0,,
+736,Chai-1,5mh1_1_BMA_0,,0.0,,
+737,Chai-1,5dnc_1_ASN_2,,0.0,,
+738,Chai-1,5u82_2_ZN0_0,,0.0,,
+739,Chai-1,3wrb_1_GDE_0,0.7142857142857142,0.7142857142857143,"{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+740,Chai-1,6ep5_1_ADP_1,,0.0,,
+741,Chai-1,2vfu_1_MTL_0,0.1538461538461539,0.9384615384615385,"{'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+742,Chai-1,3zzs_1_TRP_3,,0.0,,
+743,Chai-1,6ryz_1_SAM_2,,0.0,,
+744,Chai-1,5hmr_1_FDZ_0,0.7999999999999999,0.68,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}"
+745,Chai-1,2hs3_1_FGR_0,,0.0,,
+746,Chai-1,6etf_1_AMP_0,,0.0,,
+747,Chai-1,3jqm_1_GTP_5,,0.0,,
+748,Chai-1,3eca_1_ASP_3,1.5,0.4,{},"{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}"
+749,Chai-1,4osx_1_GLY_2,,0.0,,
+750,Chai-1,2ze9_1_PD7_0,0.5,0.8,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+751,Chai-1,5f52_1_ASP_2,,0.0,,
+752,Chai-1,6xug_1_O1Q_0,,0.0,,
+753,Chai-1,4fyv_1_DCP_2,0.35714285714285715,0.8571428571428572,"{'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PRO:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+754,Chai-1,2hk9_1_SKM_0,0.5,0.8,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+755,Chai-1,6v2a_1_ASN_3,,0.0,,
+756,Chai-1,1rqp_1_SAM_0,0.11111111111111116,0.9555555555555555,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+757,Chai-1,2wr8_1_SAH_1,0.2857142857142857,0.8857142857142857,"{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+758,Chai-1,5gqi_1_ATP_7,0.4,0.84,"{'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+759,Chai-1,2vdf_1_OCT_0,1.4,0.44000000000000006,"{'UNL:ALA:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2}",{}
+760,Chai-1,4qa8_1_PJZ_0,1.4705882352941178,0.4117647058823529,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 6, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+761,Chai-1,5k66_1_ASN-GLU_0,,0.0,,
+762,Chai-1,3gf4_1_FAD_1,0.37037037037037046,0.8518518518518519,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 4}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+763,Chai-1,4tvd_1_BGC_4,0.6666666666666667,0.7333333333333333,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:LYS:VdWContact': 1}","{'UNL:GLU:VdWContact': 2, 'UNL:TYR:VdWContact': 2}"
+764,Chai-1,1u8u_1_OCA_0,0.4117647058823529,0.8352941176470589,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2}"
+765,Chai-1,2xta_1_ACO_0,0.33333333333333337,0.8666666666666667,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1}"
+766,Chai-1,5hhz_1_ZME_0,0.875,0.65,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2}"
+767,Chai-1,4xdr_1_ADN_0,,0.0,,
+768,Chai-1,6uqy_2_AT3_0,,0.0,,
+769,Chai-1,5k4h_2_GLU_3,,0.0,,
+770,Chai-1,4tvd_1_GLC_0,,0.0,,
+771,Chai-1,1pj2_1_FUM_0,0.5999999999999999,0.76,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2}"
+772,Chai-1,6o70_1_ACK_1,0.5263157894736843,0.7894736842105263,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+773,Chai-1,2zd0_1_TRP_9,0.47058823529411764,0.8117647058823529,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 3, 'UNL:THR:VdWContact': 4}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 4}"
+774,Chai-1,1uf5_1_CDT_0,0.3125,0.875,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+775,Chai-1,4o95_1_245_0,1.2000000000000002,0.5199999999999999,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}",{'UNL:ASP:VdWContact': 1}
+776,Chai-1,3ad9_1_NAD_0,0.3636363636363637,0.8545454545454545,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+777,Chai-1,5k63_1_ASN-GLY_0,,0.0,,
+778,Chai-1,4rpm_1_HXC_0,,0.0,,
+779,Chai-1,4pfx_1_UDP_0,0.10526315789473678,0.9578947368421052,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+780,Chai-1,2gah_1_NAD_0,1.0588235294117647,0.5764705882352941,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 4, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+781,Chai-1,6pa2_1_ASP_2,,0.0,,
+782,Chai-1,4h2f_1_ADN_0,0.5454545454545454,0.7818181818181819,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:VdWContact': 1}"
+783,Chai-1,4u63_1_FAD_0,0.5185185185185185,0.7925925925925926,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 2, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+784,Chai-1,4o0f_1_GLY_3,,0.0,,
+785,Chai-1,2q6k_1_ADN_1,0.4166666666666666,0.8333333333333334,"{'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}"
+786,Chai-1,5fiu_1_Y3J_3,0.3,0.88,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}"
+787,Chai-1,5f2t_1_PLM_0,1.2352941176470589,0.5058823529411764,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 3}","{'UNL:ARG:VdWContact': 1, 'UNL:HIS:VdWContact': 1}"
+788,Chai-1,3ada_1_NAD_0,0.4090909090909091,0.8363636363636364,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+789,Chai-1,4b4v_1_L34_0,0.45833333333333337,0.8166666666666667,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+790,Chai-1,4uoc_1_NCN_1,0.17647058823529405,0.9294117647058824,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+791,Chai-1,3uni_1_SAL_0,,0.0,,
+792,Chai-1,3o7j_1_2AL_0,0.49999999999999994,0.8,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+793,Chai-1,2v7v_1_5FD_0,0.5454545454545454,0.7818181818181819,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+794,Chai-1,4rhe_1_FMN_6,,0.0,,
+795,Chai-1,5fxf_1_BEZ_0,0.4,0.84,"{'UNL:ARG:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+796,Chai-1,2wwc_1_CHT_2,1.0,0.6,{'UNL:TRP:VdWContact': 1},{}
+797,Chai-1,6qkr_1_FAD_0,0.32258064516129026,0.8709677419354839,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 3, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 4, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1}"
+798,Chai-1,3inr_1_GDU_0,0.11764705882352944,0.9529411764705882,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+799,Chai-1,4idk_1_1FE_0,0.6666666666666666,0.7333333333333334,"{'UNL:GLN:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:GLU:VdWContact': 1, 'UNL:THR:VdWContact': 2}"
+800,Chai-1,6yao_1_OJ2_0,0.8333333333333334,0.6666666666666666,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:TYR:VdWContact': 2}"
+801,Chai-1,6ea9_1_9BG_0,0.5,0.8,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 2}"
+802,Chai-1,6ur1_2_AT3_0,0.9375,0.625,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:HIS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+803,Chai-1,4mig_1_G3F_2,0.7272727272727273,0.7090909090909091,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+804,Chai-1,6wyz_1_DGL_1,,0.0,,
+805,Chai-1,2v7t_1_SAH_4,0.10526315789473684,0.9578947368421052,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+806,Chai-1,3ad7_1_NAD_0,0.5000000000000001,0.7999999999999999,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 4, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+807,Chai-1,5hw0_1_GLU_2,0.36363636363636365,0.8545454545454545,"{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}"
+808,Chai-1,5hqx_1_EDZ_0,0.4444444444444445,0.8222222222222222,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+809,Chai-1,2q37_1_3AL_0,0.4166666666666667,0.8333333333333333,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 3, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 4, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+810,Chai-1,6n19_2_K8V_0,,0.0,,
+811,Chai-1,2v7w_1_5FD_0,0.5238095238095237,0.7904761904761906,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+812,Chai-1,4phs_1_UDP_0,0.05882352941176469,0.9764705882352941,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+813,Chai-1,4ydx_1_TCE_0,0.0,1.0,"{'UNL:CYS:VdWContact': 2, 'UNL:LYS:VdWContact': 1}","{'UNL:CYS:VdWContact': 2, 'UNL:LYS:VdWContact': 1}"
+814,Chai-1,4xfm_1_THE_0,0.28571428571428575,0.8857142857142857,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}"
+815,Chai-1,3ub9_1_NHY_1,,0.0,,
+816,Chai-1,1tkg_1_SSA_0,0.7058823529411765,0.7176470588235294,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 2}"
+817,Chai-1,4o0d_1_GLY_3,,0.0,,
+818,Chai-1,6yap_1_OHZ_0,0.6,0.76,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+819,Chai-1,6xb3_3_9BG_1,0.6818181818181818,0.7272727272727273,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:VdWContact': 5, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 2}"
+820,Chai-1,4kgx_1_CTP_5,0.3125,0.875,"{'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+821,Chai-1,3se5_1_ANP_2,1.6363636363636362,0.34545454545454546,{},"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+822,Chai-1,6gbf_1_AMP_0,,0.0,,
+823,Chai-1,2v7u_1_SAM_2,0.11111111111111105,0.9555555555555556,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+824,Chai-1,2gag_1_FOA_0,0.28571428571428575,0.8857142857142857,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1}","{'UNL:ASN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+825,Chai-1,4uuw_1_AMP_0,0.7692307692307693,0.6923076923076923,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2}"
+826,Chai-1,4phr_1_UDP_0,0.3999999999999999,0.8400000000000001,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2}"
+827,Chai-1,1o72_2_PC_0,0.5999999999999999,0.76,"{'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}"
+828,Chai-1,4oal_2_245_0,0.9090909090909092,0.6363636363636364,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:LEU:VdWContact': 1}"
+829,Chai-1,1hg0_1_SIN_1,1.0909090909090908,0.5636363636363637,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1}","{'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3}"
+830,Chai-1,3zjx_1_BOG_0,0.8571428571428572,0.6571428571428571,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 3}","{'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+831,Chai-1,6pa6_2_ASN_0,,0.0,,
+832,Chai-1,1qaw_1_TRP_7,0.9090909090909092,0.6363636363636364,"{'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 3}"
+833,Boltz-1-Single-Seq,3s6a_1_ANP_0,0.3571428571428572,0.8571428571428571,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1}"
+834,Boltz-1-Single-Seq,2gf3_2_FOA_1,1.0,0.6,"{'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:GLN:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+835,Boltz-1-Single-Seq,1v2g_1_OCA_0,0.5714285714285714,0.7714285714285715,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2}"
+836,Boltz-1-Single-Seq,2r4e_1_13P_0,0.25,0.9,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+837,Boltz-1-Single-Seq,3ub7_1_ACM_1,0.44444444444444436,0.8222222222222222,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:VdWContact': 1}"
+838,Boltz-1-Single-Seq,4cdn_2_FAD_0,0.48000000000000004,0.808,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+839,Boltz-1-Single-Seq,6yaq_1_OHZ_0,0.85,0.66,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+840,Boltz-1-Single-Seq,4cnl_1_CHT_1,1.0,0.6,"{'UNL:GLY:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}",{}
+841,Boltz-1-Single-Seq,5k45_2_GLU_1,0.41666666666666663,0.8333333333333334,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+842,Boltz-1-Single-Seq,2zcz_2_TRP_3,0.6470588235294118,0.7411764705882353,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 3, 'UNL:THR:VdWContact': 4, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 6}"
+843,Boltz-1-Single-Seq,5fxd_1_H7Y_1,0.6666666666666667,0.7333333333333333,"{'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+844,Boltz-1-Single-Seq,5k3o_2_ASP_0,0.5333333333333334,0.7866666666666666,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 4, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}"
+845,Boltz-1-Single-Seq,5fxe_1_CIY_1,0.5833333333333333,0.7666666666666667,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+846,Boltz-1-Single-Seq,5ida_1_BMA_0,0.25,0.9,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+847,Boltz-1-Single-Seq,4osy_1_GLY_3,,0.0,,
+848,Boltz-1-Single-Seq,5k62_1_ASN-VAL_0,,0.0,,
+849,Boltz-1-Single-Seq,5b5s_1_BOG_0,0.4,0.84,"{'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:VdWContact': 1}"
+850,Boltz-1-Single-Seq,1tke_1_SER_0,0.5555555555555556,0.7777777777777778,"{'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:CYS:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 3, 'UNL:MET:VdWContact': 1}"
+851,Boltz-1-Single-Seq,6paa_1_ASP_2,0.39999999999999997,0.8400000000000001,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+852,Boltz-1-Single-Seq,2gag_1_NAD_0,,0.0,,
+853,Boltz-1-Single-Seq,6o6y_1_ACK_0,0.9285714285714286,0.6285714285714286,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:VdWContact': 4}"
+854,Boltz-1-Single-Seq,3zec_1_ANP_0,0.5,0.8,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+855,Boltz-1-Single-Seq,5mh1_1_BMA_0,,0.0,,
+856,Boltz-1-Single-Seq,5dnc_1_ASN_2,,0.0,,
+857,Boltz-1-Single-Seq,5u82_2_ZN0_0,,0.0,,
+858,Boltz-1-Single-Seq,3wrb_1_GDE_0,0.6428571428571428,0.7428571428571429,"{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+859,Boltz-1-Single-Seq,6ep5_1_ADP_1,0.13333333333333333,0.9466666666666667,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+860,Boltz-1-Single-Seq,2vfu_1_MTL_0,0.0,1.0,"{'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+861,Boltz-1-Single-Seq,3zzs_1_TRP_3,,0.0,,
+862,Boltz-1-Single-Seq,6ryz_1_SAM_2,0.5599999999999999,0.776,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+863,Boltz-1-Single-Seq,5hmr_1_FDZ_0,1.0,0.6,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}"
+864,Boltz-1-Single-Seq,2hs3_1_FGR_0,0.5555555555555556,0.7777777777777778,"{'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1}"
+865,Boltz-1-Single-Seq,6etf_1_AMP_0,,0.0,,
+866,Boltz-1-Single-Seq,3jqm_1_GTP_5,1.0,0.6,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+867,Boltz-1-Single-Seq,3eca_1_ASP_3,0.4375,0.825,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}"
+868,Boltz-1-Single-Seq,4osx_1_GLY_2,,0.0,,
+869,Boltz-1-Single-Seq,2ze9_1_PD7_0,0.4375,0.825,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+870,Boltz-1-Single-Seq,5f52_1_ASP_2,,0.0,,
+871,Boltz-1-Single-Seq,6xug_1_O1Q_0,,0.0,,
+872,Boltz-1-Single-Seq,4fyv_1_DCP_2,0.7692307692307692,0.6923076923076923,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+873,Boltz-1-Single-Seq,2hk9_1_SKM_0,0.4545454545454546,0.8181818181818181,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+874,Boltz-1-Single-Seq,6v2a_1_ASN_3,,0.0,,
+875,Boltz-1-Single-Seq,1rqp_1_SAM_0,0.5555555555555555,0.7777777777777778,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+876,Boltz-1-Single-Seq,2wr8_1_SAH_1,0.5,0.8,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+877,Boltz-1-Single-Seq,5gqi_1_ATP_7,,0.0,,
+878,Boltz-1-Single-Seq,2vdf_1_OCT_0,1.2857142857142856,0.48571428571428577,"{'UNL:ALA:Hydrophobic': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:VdWContact': 1}",{}
+879,Boltz-1-Single-Seq,4qa8_1_PJZ_0,1.4705882352941175,0.41176470588235303,"{'UNL:ALA:Hydrophobic': 3, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 5, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+880,Boltz-1-Single-Seq,5k66_1_ASN-GLU_0,,0.0,,
+881,Boltz-1-Single-Seq,3gf4_1_FAD_1,0.46875,0.8125,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+882,Boltz-1-Single-Seq,4tvd_1_BGC_4,0.4,0.84,"{'UNL:ASP:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:GLU:VdWContact': 2, 'UNL:TYR:VdWContact': 2}"
+883,Boltz-1-Single-Seq,1u8u_1_OCA_0,0.6875,0.725,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2}"
+884,Boltz-1-Single-Seq,2xta_1_ACO_0,,0.0,,
+885,Boltz-1-Single-Seq,5hhz_1_ZME_0,1.0909090909090908,0.5636363636363637,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2}"
+886,Boltz-1-Single-Seq,4xdr_1_ADN_0,,0.0,,
+887,Boltz-1-Single-Seq,6uqy_2_AT3_0,0.5333333333333332,0.7866666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 3}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+888,Boltz-1-Single-Seq,5k4h_2_GLU_3,0.46153846153846156,0.8153846153846154,"{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+889,Boltz-1-Single-Seq,4tvd_1_GLC_0,0.8,0.6799999999999999,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:LYS:VdWContact': 2}"
+890,Boltz-1-Single-Seq,1pj2_1_FUM_0,,0.0,,
+891,Boltz-1-Single-Seq,6o70_1_ACK_1,,0.0,,
+892,Boltz-1-Single-Seq,2zd0_1_TRP_9,0.6470588235294118,0.7411764705882353,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 2, 'UNL:THR:Hydrophobic': 3, 'UNL:THR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 4}"
+893,Boltz-1-Single-Seq,1uf5_1_CDT_0,0.23076923076923078,0.9076923076923077,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+894,Boltz-1-Single-Seq,4o95_1_245_0,1.2,0.52,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}",{'UNL:ASP:VdWContact': 1}
+895,Boltz-1-Single-Seq,3ad9_1_NAD_0,,0.0,,
+896,Boltz-1-Single-Seq,5k63_1_ASN-GLY_0,,0.0,,
+897,Boltz-1-Single-Seq,4rpm_1_HXC_0,,0.0,,
+898,Boltz-1-Single-Seq,4pfx_1_UDP_0,0.21052631578947367,0.9157894736842105,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+899,Boltz-1-Single-Seq,2gah_1_NAD_0,,0.0,,
+900,Boltz-1-Single-Seq,6pa2_1_ASP_2,,0.0,,
+901,Boltz-1-Single-Seq,4h2f_1_ADN_0,0.6666666666666666,0.7333333333333334,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:VdWContact': 1}"
+902,Boltz-1-Single-Seq,4u63_1_FAD_0,0.6206896551724137,0.7517241379310345,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 2, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+903,Boltz-1-Single-Seq,4o0f_1_GLY_3,,0.0,,
+904,Boltz-1-Single-Seq,2q6k_1_ADN_1,0.1818181818181817,0.9272727272727274,"{'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}"
+905,Boltz-1-Single-Seq,5fiu_1_Y3J_3,0.4761904761904763,0.8095238095238095,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}"
+906,Boltz-1-Single-Seq,5f2t_1_PLM_0,1.2000000000000002,0.5199999999999999,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:HIS:VdWContact': 1}"
+907,Boltz-1-Single-Seq,3ada_1_NAD_0,,0.0,,
+908,Boltz-1-Single-Seq,4b4v_1_L34_0,0.48000000000000004,0.808,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+909,Boltz-1-Single-Seq,4uoc_1_NCN_1,0.10526315789473689,0.9578947368421052,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+910,Boltz-1-Single-Seq,3uni_1_SAL_0,,0.0,,
+911,Boltz-1-Single-Seq,3o7j_1_2AL_0,0.5714285714285714,0.7714285714285715,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+912,Boltz-1-Single-Seq,2v7v_1_5FD_0,0.45833333333333326,0.8166666666666667,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+913,Boltz-1-Single-Seq,4rhe_1_FMN_6,0.42105263157894746,0.831578947368421,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 3, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 4, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 4, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+914,Boltz-1-Single-Seq,5fxf_1_BEZ_0,0.2,0.92,"{'UNL:ARG:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+915,Boltz-1-Single-Seq,2wwc_1_CHT_2,1.6666666666666667,0.33333333333333326,"{'UNL:PHE:VdWContact': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 2}",{}
+916,Boltz-1-Single-Seq,6qkr_1_FAD_0,0.6,0.76,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 3, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:VdWContact': 4, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 4, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1}"
+917,Boltz-1-Single-Seq,3inr_1_GDU_0,0.5,0.8,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 4}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+918,Boltz-1-Single-Seq,4idk_1_1FE_0,0.8666666666666667,0.6533333333333333,"{'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:GLU:VdWContact': 1, 'UNL:THR:VdWContact': 2}"
+919,Boltz-1-Single-Seq,6yao_1_OJ2_0,1.0909090909090908,0.5636363636363637,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 4, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:TYR:VdWContact': 2}"
+920,Boltz-1-Single-Seq,6ea9_1_9BG_0,0.22222222222222227,0.9111111111111111,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 2}"
+921,Boltz-1-Single-Seq,6ur1_2_AT3_0,0.7999999999999999,0.68,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:HIS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+922,Boltz-1-Single-Seq,4mig_1_G3F_2,,0.0,,
+923,Boltz-1-Single-Seq,6wyz_1_DGL_1,0.4,0.84,"{'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3}"
+924,Boltz-1-Single-Seq,2v7t_1_SAH_4,0.34782608695652173,0.8608695652173913,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+925,Boltz-1-Single-Seq,3ad7_1_NAD_0,,0.0,,
+926,Boltz-1-Single-Seq,5hw0_1_GLU_2,0.3,0.88,"{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}"
+927,Boltz-1-Single-Seq,5hqx_1_EDZ_0,0.7692307692307692,0.6923076923076923,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 4, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+928,Boltz-1-Single-Seq,2q37_1_3AL_0,0.46153846153846145,0.8153846153846154,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 4, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+929,Boltz-1-Single-Seq,6n19_2_K8V_0,,0.0,,
+930,Boltz-1-Single-Seq,2v7w_1_5FD_0,0.5217391304347827,0.7913043478260869,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+931,Boltz-1-Single-Seq,4phs_1_UDP_0,0.33333333333333337,0.8666666666666667,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+932,Boltz-1-Single-Seq,4ydx_1_TCE_0,0.5,0.8,"{'UNL:CYS:VdWContact': 1, 'UNL:LYS:VdWContact': 1}","{'UNL:CYS:VdWContact': 2, 'UNL:LYS:VdWContact': 1}"
+933,Boltz-1-Single-Seq,4xfm_1_THE_0,0.6,0.76,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}"
+934,Boltz-1-Single-Seq,3ub9_1_NHY_1,0.7142857142857143,0.7142857142857143,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:VdWContact': 3}","{'UNL:ASP:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:VdWContact': 2}"
+935,Boltz-1-Single-Seq,1tkg_1_SSA_0,0.5882352941176471,0.7647058823529411,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 2}"
+936,Boltz-1-Single-Seq,4o0d_1_GLY_3,,0.0,,
+937,Boltz-1-Single-Seq,6yap_1_OHZ_0,0.6923076923076923,0.7230769230769231,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 4, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+938,Boltz-1-Single-Seq,6xb3_3_9BG_1,0.5454545454545454,0.7818181818181819,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 4, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:VdWContact': 5, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 2}"
+939,Boltz-1-Single-Seq,4kgx_1_CTP_5,0.5,0.8,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+940,Boltz-1-Single-Seq,3se5_1_ANP_2,0.33333333333333326,0.8666666666666667,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+941,Boltz-1-Single-Seq,6gbf_1_AMP_0,,0.0,,
+942,Boltz-1-Single-Seq,2v7u_1_SAM_2,0.52,0.792,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+943,Boltz-1-Single-Seq,2gag_1_FOA_0,,0.0,,
+944,Boltz-1-Single-Seq,4uuw_1_AMP_0,0.8571428571428572,0.6571428571428571,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2}"
+945,Boltz-1-Single-Seq,4phr_1_UDP_0,0.411764705882353,0.8352941176470587,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2}"
+946,Boltz-1-Single-Seq,1o72_2_PC_0,0.7777777777777779,0.6888888888888889,"{'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 3}","{'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}"
+947,Boltz-1-Single-Seq,4oal_2_245_0,1.1818181818181819,0.5272727272727272,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:LEU:VdWContact': 1}"
+948,Boltz-1-Single-Seq,1hg0_1_SIN_1,0.6363636363636364,0.7454545454545455,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}","{'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3}"
+949,Boltz-1-Single-Seq,3zjx_1_BOG_0,1.0,0.6,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 3}","{'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+950,Boltz-1-Single-Seq,6pa6_2_ASN_0,,0.0,,
+951,Boltz-1-Single-Seq,1qaw_1_TRP_7,0.5,0.8,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 2, 'UNL:THR:Hydrophobic': 3, 'UNL:THR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 3}"
+952,Boltz-1,3s6a_1_ANP_0,0.30769230769230776,0.8769230769230769,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1}"
+953,Boltz-1,2gf3_2_FOA_1,0.75,0.7,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:GLN:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+954,Boltz-1,1v2g_1_OCA_0,0.6,0.76,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2}"
+955,Boltz-1,2r4e_1_13P_0,0.3636363636363636,0.8545454545454545,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+956,Boltz-1,3ub7_1_ACM_1,0.25,0.9,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ASP:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:VdWContact': 1}"
+957,Boltz-1,4cdn_2_FAD_0,0.4000000000000001,0.84,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+958,Boltz-1,6yaq_1_OHZ_0,0.7857142857142858,0.6857142857142857,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+959,Boltz-1,4cnl_1_CHT_1,1.3333333333333335,0.46666666666666656,"{'UNL:MET:VdWContact': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 1}",{}
+960,Boltz-1,5k45_2_GLU_1,0.16666666666666666,0.9333333333333333,"{'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+961,Boltz-1,2zcz_2_TRP_3,0.625,0.75,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 3, 'UNL:THR:VdWContact': 4, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 6}"
+962,Boltz-1,5fxd_1_H7Y_1,,0.0,,
+963,Boltz-1,5k3o_2_ASP_0,0.5333333333333334,0.7866666666666666,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 4, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}"
+964,Boltz-1,5fxe_1_CIY_1,,0.0,,
+965,Boltz-1,5ida_1_BMA_0,0.14285714285714285,0.9428571428571428,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+966,Boltz-1,4osy_1_GLY_3,,0.0,,
+967,Boltz-1,5k62_1_ASN-VAL_0,,0.0,,
+968,Boltz-1,5b5s_1_BOG_0,0.6000000000000001,0.76,"{'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:VdWContact': 1}"
+969,Boltz-1,1tke_1_SER_0,0.6000000000000001,0.76,"{'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:CYS:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 3, 'UNL:MET:VdWContact': 1}"
+970,Boltz-1,6paa_1_ASP_2,0.3571428571428571,0.8571428571428572,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+971,Boltz-1,2gag_1_NAD_0,,0.0,,
+972,Boltz-1,6o6y_1_ACK_0,0.9999999999999999,0.6000000000000001,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:VdWContact': 4}"
+973,Boltz-1,3zec_1_ANP_0,,0.0,,
+974,Boltz-1,5mh1_1_BMA_0,,0.0,,
+975,Boltz-1,5dnc_1_ASN_2,,0.0,,
+976,Boltz-1,5u82_2_ZN0_0,,0.0,,
+977,Boltz-1,3wrb_1_GDE_0,,0.0,,
+978,Boltz-1,6ep5_1_ADP_1,,0.0,,
+979,Boltz-1,2vfu_1_MTL_0,0.15384615384615385,0.9384615384615385,"{'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+980,Boltz-1,3zzs_1_TRP_3,,0.0,,
+981,Boltz-1,6ryz_1_SAM_2,,0.0,,
+982,Boltz-1,5hmr_1_FDZ_0,1.0,0.6,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}"
+983,Boltz-1,2hs3_1_FGR_0,0.31578947368421045,0.8736842105263158,"{'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1}"
+984,Boltz-1,6etf_1_AMP_0,,0.0,,
+985,Boltz-1,3jqm_1_GTP_5,1.1249999999999998,0.55,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:HBDonor': 2, 'UNL:LYS:VdWContact': 4, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+986,Boltz-1,3eca_1_ASP_3,,0.0,,
+987,Boltz-1,4osx_1_GLY_2,,0.0,,
+988,Boltz-1,2ze9_1_PD7_0,0.47058823529411764,0.8117647058823529,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+989,Boltz-1,5f52_1_ASP_2,,0.0,,
+990,Boltz-1,6xug_1_O1Q_0,,0.0,,
+991,Boltz-1,4fyv_1_DCP_2,,0.0,,
+992,Boltz-1,2hk9_1_SKM_0,0.4615384615384615,0.8153846153846154,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+993,Boltz-1,6v2a_1_ASN_3,,0.0,,
+994,Boltz-1,1rqp_1_SAM_0,,0.0,,
+995,Boltz-1,2wr8_1_SAH_1,0.5294117647058824,0.788235294117647,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+996,Boltz-1,5gqi_1_ATP_7,,0.0,,
+997,Boltz-1,2vdf_1_OCT_0,1.1666666666666665,0.5333333333333334,"{'UNL:ALA:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:VdWContact': 1}",{}
+998,Boltz-1,4qa8_1_PJZ_0,1.625,0.35,"{'UNL:ALA:Hydrophobic': 3, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 3, 'UNL:THR:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 6, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+999,Boltz-1,5k66_1_ASN-GLU_0,,0.0,,
+1000,Boltz-1,3gf4_1_FAD_1,,0.0,,
+1001,Boltz-1,4tvd_1_BGC_4,,0.0,,
+1002,Boltz-1,1u8u_1_OCA_0,0.5,0.8,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2}"
+1003,Boltz-1,2xta_1_ACO_0,,0.0,,
+1004,Boltz-1,5hhz_1_ZME_0,1.0909090909090908,0.5636363636363637,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2}"
+1005,Boltz-1,4xdr_1_ADN_0,,0.0,,
+1006,Boltz-1,6uqy_2_AT3_0,0.4666666666666666,0.8133333333333334,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 3}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1007,Boltz-1,5k4h_2_GLU_3,,0.0,,
+1008,Boltz-1,4tvd_1_GLC_0,,0.0,,
+1009,Boltz-1,1pj2_1_FUM_0,,0.0,,
+1010,Boltz-1,6o70_1_ACK_1,0.49999999999999994,0.8,"{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+1011,Boltz-1,2zd0_1_TRP_9,0.625,0.75,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 2, 'UNL:THR:Hydrophobic': 3, 'UNL:THR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 4}"
+1012,Boltz-1,1uf5_1_CDT_0,0.35714285714285715,0.8571428571428572,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+1013,Boltz-1,4o95_1_245_0,1.3333333333333335,0.46666666666666656,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}",{'UNL:ASP:VdWContact': 1}
+1014,Boltz-1,3ad9_1_NAD_0,,0.0,,
+1015,Boltz-1,5k63_1_ASN-GLY_0,,0.0,,
+1016,Boltz-1,4rpm_1_HXC_0,,0.0,,
+1017,Boltz-1,4pfx_1_UDP_0,0.15789473684210514,0.9368421052631579,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+1018,Boltz-1,2gah_1_NAD_0,,0.0,,
+1019,Boltz-1,6pa2_1_ASP_2,,0.0,,
+1020,Boltz-1,4h2f_1_ADN_0,0.6666666666666666,0.7333333333333334,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:VdWContact': 1}"
+1021,Boltz-1,4u63_1_FAD_0,0.607142857142857,0.7571428571428572,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+1022,Boltz-1,4o0f_1_GLY_3,,0.0,,
+1023,Boltz-1,2q6k_1_ADN_1,0.11764705882352944,0.9529411764705882,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2}","{'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}"
+1024,Boltz-1,5fiu_1_Y3J_3,,0.0,,
+1025,Boltz-1,5f2t_1_PLM_0,1.3529411764705883,0.45882352941176463,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:VdWContact': 1, 'UNL:HIS:VdWContact': 1}"
+1026,Boltz-1,3ada_1_NAD_0,,0.0,,
+1027,Boltz-1,4b4v_1_L34_0,0.5384615384615384,0.7846153846153846,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1028,Boltz-1,4uoc_1_NCN_1,,0.0,,
+1029,Boltz-1,3uni_1_SAL_0,,0.0,,
+1030,Boltz-1,3o7j_1_2AL_0,0.5714285714285714,0.7714285714285715,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+1031,Boltz-1,2v7v_1_5FD_0,,0.0,,
+1032,Boltz-1,4rhe_1_FMN_6,,0.0,,
+1033,Boltz-1,5fxf_1_BEZ_0,,0.0,,
+1034,Boltz-1,2wwc_1_CHT_2,1.0,0.6,"{'UNL:GLY:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}",{}
+1035,Boltz-1,6qkr_1_FAD_0,0.6666666666666666,0.7333333333333334,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 3, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:VdWContact': 6, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 4, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1}"
+1036,Boltz-1,3inr_1_GDU_0,,0.0,,
+1037,Boltz-1,4idk_1_1FE_0,1.1818181818181819,0.5272727272727272,"{'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:GLU:VdWContact': 1, 'UNL:THR:VdWContact': 2}"
+1038,Boltz-1,6yao_1_OJ2_0,0.9999999999999999,0.6000000000000001,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 4, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:TYR:VdWContact': 2}"
+1039,Boltz-1,6ea9_1_9BG_0,0.5,0.8,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 2}"
+1040,Boltz-1,6ur1_2_AT3_0,0.6666666666666667,0.7333333333333333,"{'UNL:ASN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:HIS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+1041,Boltz-1,4mig_1_G3F_2,,0.0,,
+1042,Boltz-1,6wyz_1_DGL_1,,0.0,,
+1043,Boltz-1,2v7t_1_SAH_4,,0.0,,
+1044,Boltz-1,3ad7_1_NAD_0,,0.0,,
+1045,Boltz-1,5hw0_1_GLU_2,,0.0,,
+1046,Boltz-1,5hqx_1_EDZ_0,0.7857142857142858,0.6857142857142857,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 4, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+1047,Boltz-1,2q37_1_3AL_0,0.41666666666666674,0.8333333333333333,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 4, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+1048,Boltz-1,6n19_2_K8V_0,,0.0,,
+1049,Boltz-1,2v7w_1_5FD_0,,0.0,,
+1050,Boltz-1,4phs_1_UDP_0,0.23529411764705885,0.9058823529411765,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+1051,Boltz-1,4ydx_1_TCE_0,1.0,0.6,{'UNL:CYS:VdWContact': 1},"{'UNL:CYS:VdWContact': 2, 'UNL:LYS:VdWContact': 1}"
+1052,Boltz-1,4xfm_1_THE_0,0.5,0.8,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}"
+1053,Boltz-1,3ub9_1_NHY_1,0.7142857142857143,0.7142857142857143,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:VdWContact': 3}","{'UNL:ASP:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:VdWContact': 2}"
+1054,Boltz-1,1tkg_1_SSA_0,0.631578947368421,0.7473684210526316,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 2}"
+1055,Boltz-1,4o0d_1_GLY_3,,0.0,,
+1056,Boltz-1,6yap_1_OHZ_0,0.6923076923076923,0.7230769230769231,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+1057,Boltz-1,6xb3_3_9BG_1,0.5714285714285713,0.7714285714285715,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:VdWContact': 5, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 2}"
+1058,Boltz-1,4kgx_1_CTP_5,,0.0,,
+1059,Boltz-1,3se5_1_ANP_2,,0.0,,
+1060,Boltz-1,6gbf_1_AMP_0,,0.0,,
+1061,Boltz-1,2v7u_1_SAM_2,,0.0,,
+1062,Boltz-1,2gag_1_FOA_0,,0.0,,
+1063,Boltz-1,4uuw_1_AMP_0,,0.0,,
+1064,Boltz-1,4phr_1_UDP_0,0.4705882352941177,0.8117647058823529,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2}"
+1065,Boltz-1,1o72_2_PC_0,0.75,0.7,"{'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 3}","{'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}"
+1066,Boltz-1,4oal_2_245_0,1.2727272727272727,0.49090909090909096,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:LEU:VdWContact': 1}"
+1067,Boltz-1,1hg0_1_SIN_1,,0.0,,
+1068,Boltz-1,3zjx_1_BOG_0,0.888888888888889,0.6444444444444444,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+1069,Boltz-1,6pa6_2_ASN_0,,0.0,,
+1070,Boltz-1,1qaw_1_TRP_7,0.3157894736842105,0.8736842105263158,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 3}"
+1071,AF3-Single-Seq,3s6a_1_ANP_0,0.5,0.8,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1}"
+1072,AF3-Single-Seq,2gf3_2_FOA_1,0.6666666666666667,0.7333333333333333,"{'UNL:ARG:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:GLN:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+1073,AF3-Single-Seq,1v2g_1_OCA_0,0.375,0.85,"{'UNL:ASN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2}"
+1074,AF3-Single-Seq,2r4e_1_13P_0,0.4285714285714286,0.8285714285714285,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+1075,AF3-Single-Seq,3ub7_1_ACM_1,0.33333333333333337,0.8666666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:VdWContact': 1}"
+1076,AF3-Single-Seq,4cdn_2_FAD_0,0.40740740740740733,0.837037037037037,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+1077,AF3-Single-Seq,6yaq_1_OHZ_0,0.7499999999999999,0.7000000000000001,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ASP:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1078,AF3-Single-Seq,4cnl_1_CHT_1,1.3333333333333335,0.46666666666666656,"{'UNL:MET:VdWContact': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 1}",{}
+1079,AF3-Single-Seq,5k45_2_GLU_1,0.3333333333333333,0.8666666666666667,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+1080,AF3-Single-Seq,2zcz_2_TRP_3,0.375,0.85,"{'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 6}"
+1081,AF3-Single-Seq,5fxd_1_H7Y_1,0.6666666666666666,0.7333333333333334,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ASP:VdWContact': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1082,AF3-Single-Seq,5k3o_2_ASP_0,0.2857142857142857,0.8857142857142857,"{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 4, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}"
+1083,AF3-Single-Seq,5fxe_1_CIY_1,0.25,0.9,"{'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1084,AF3-Single-Seq,5ida_1_BMA_0,0.25,0.9,"{'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+1085,AF3-Single-Seq,4osy_1_GLY_3,,0.0,,
+1086,AF3-Single-Seq,5k62_1_ASN-VAL_0,,0.0,,
+1087,AF3-Single-Seq,5b5s_1_BOG_0,0.5555555555555556,0.7777777777777778,"{'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:VdWContact': 1}"
+1088,AF3-Single-Seq,1tke_1_SER_0,0.36363636363636365,0.8545454545454545,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:CYS:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 3, 'UNL:MET:VdWContact': 1}"
+1089,AF3-Single-Seq,6paa_1_ASP_2,0.8333333333333335,0.6666666666666666,"{'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+1090,AF3-Single-Seq,2gag_1_NAD_0,0.14285714285714285,0.9428571428571428,"{'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 4, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+1091,AF3-Single-Seq,6o6y_1_ACK_0,0.625,0.75,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:VdWContact': 4}"
+1092,AF3-Single-Seq,3zec_1_ANP_0,0.4166666666666667,0.8333333333333333,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+1093,AF3-Single-Seq,5mh1_1_BMA_0,,0.0,,
+1094,AF3-Single-Seq,5dnc_1_ASN_2,,0.0,,
+1095,AF3-Single-Seq,5u82_2_ZN0_0,,0.0,,
+1096,AF3-Single-Seq,3wrb_1_GDE_0,0.49999999999999994,0.8,"{'UNL:ARG:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1097,AF3-Single-Seq,6ep5_1_ADP_1,0.3125,0.875,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+1098,AF3-Single-Seq,2vfu_1_MTL_0,0.3333333333333333,0.8666666666666667,"{'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+1099,AF3-Single-Seq,3zzs_1_TRP_3,,0.0,,
+1100,AF3-Single-Seq,6ryz_1_SAM_2,0.2272727272727273,0.9090909090909091,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+1101,AF3-Single-Seq,5hmr_1_FDZ_0,0.39999999999999997,0.8400000000000001,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}"
+1102,AF3-Single-Seq,2hs3_1_FGR_0,0.33333333333333337,0.8666666666666667,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1}"
+1103,AF3-Single-Seq,6etf_1_AMP_0,,0.0,,
+1104,AF3-Single-Seq,3jqm_1_GTP_5,0.4444444444444445,0.8222222222222222,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+1105,AF3-Single-Seq,3eca_1_ASP_3,0.2142857142857142,0.9142857142857144,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}"
+1106,AF3-Single-Seq,4osx_1_GLY_2,,0.0,,
+1107,AF3-Single-Seq,2ze9_1_PD7_0,0.8333333333333334,0.6666666666666666,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+1108,AF3-Single-Seq,5f52_1_ASP_2,,0.0,,
+1109,AF3-Single-Seq,6xug_1_O1Q_0,,0.0,,
+1110,AF3-Single-Seq,4fyv_1_DCP_2,0.46666666666666656,0.8133333333333334,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+1111,AF3-Single-Seq,2hk9_1_SKM_0,0.33333333333333326,0.8666666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+1112,AF3-Single-Seq,6v2a_1_ASN_3,,0.0,,
+1113,AF3-Single-Seq,1rqp_1_SAM_0,0.1578947368421053,0.9368421052631579,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+1114,AF3-Single-Seq,2wr8_1_SAH_1,0.375,0.85,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+1115,AF3-Single-Seq,5gqi_1_ATP_7,0.36363636363636354,0.8545454545454546,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+1116,AF3-Single-Seq,2vdf_1_OCT_0,1.2,0.52,"{'UNL:ALA:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}",{}
+1117,AF3-Single-Seq,4qa8_1_PJZ_0,1.818181818181818,0.2727272727272728,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 5, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 3}","{'UNL:ALA:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+1118,AF3-Single-Seq,5k66_1_ASN-GLU_0,,0.0,,
+1119,AF3-Single-Seq,3gf4_1_FAD_1,0.25,0.9,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+1120,AF3-Single-Seq,4tvd_1_BGC_4,0.5714285714285715,0.7714285714285714,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 1}","{'UNL:GLU:VdWContact': 2, 'UNL:TYR:VdWContact': 2}"
+1121,AF3-Single-Seq,1u8u_1_OCA_0,0.30769230769230765,0.8769230769230769,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2}"
+1122,AF3-Single-Seq,2xta_1_ACO_0,0.5555555555555556,0.7777777777777778,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 4, 'UNL:ASP:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 4, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1}"
+1123,AF3-Single-Seq,5hhz_1_ZME_0,1.0,0.6,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2}"
+1124,AF3-Single-Seq,4xdr_1_ADN_0,,0.0,,
+1125,AF3-Single-Seq,6uqy_2_AT3_0,0.4615384615384615,0.8153846153846154,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1126,AF3-Single-Seq,5k4h_2_GLU_3,0.4545454545454546,0.8181818181818181,"{'UNL:ARG:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+1127,AF3-Single-Seq,4tvd_1_GLC_0,0.7999999999999999,0.68,"{'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:LYS:VdWContact': 2}"
+1128,AF3-Single-Seq,1pj2_1_FUM_0,,0.0,,
+1129,AF3-Single-Seq,6o70_1_ACK_1,0.3333333333333333,0.8666666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+1130,AF3-Single-Seq,2zd0_1_TRP_9,0.39999999999999997,0.8400000000000001,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 4}"
+1131,AF3-Single-Seq,1uf5_1_CDT_0,0.26315789473684215,0.8947368421052632,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+1132,AF3-Single-Seq,4o95_1_245_0,1.4,0.44000000000000006,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}",{'UNL:ASP:VdWContact': 1}
+1133,AF3-Single-Seq,3ad9_1_NAD_0,0.19047619047619052,0.9238095238095237,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 3, 'UNL:THR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+1134,AF3-Single-Seq,5k63_1_ASN-GLY_0,,0.0,,
+1135,AF3-Single-Seq,4rpm_1_HXC_0,,0.0,,
+1136,AF3-Single-Seq,4pfx_1_UDP_0,0.23809523809523803,0.9047619047619048,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+1137,AF3-Single-Seq,2gah_1_NAD_0,0.31818181818181823,0.8727272727272727,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 4, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+1138,AF3-Single-Seq,6pa2_1_ASP_2,,0.0,,
+1139,AF3-Single-Seq,4h2f_1_ADN_0,0.5384615384615384,0.7846153846153846,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:VdWContact': 1}"
+1140,AF3-Single-Seq,4u63_1_FAD_0,0.18518518518518523,0.9259259259259259,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+1141,AF3-Single-Seq,4o0f_1_GLY_3,,0.0,,
+1142,AF3-Single-Seq,2q6k_1_ADN_1,0.4166666666666667,0.8333333333333333,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}"
+1143,AF3-Single-Seq,5fiu_1_Y3J_3,0.10526315789473689,0.9578947368421052,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}"
+1144,AF3-Single-Seq,5f2t_1_PLM_0,0.9375,0.625,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:GLU:Hydrophobic': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:HIS:VdWContact': 1}"
+1145,AF3-Single-Seq,3ada_1_NAD_0,0.2799999999999999,0.888,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 3, 'UNL:THR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+1146,AF3-Single-Seq,4b4v_1_L34_0,0.15000000000000008,0.94,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1147,AF3-Single-Seq,4uoc_1_NCN_1,1.0625,0.575,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+1148,AF3-Single-Seq,3uni_1_SAL_0,,0.0,,
+1149,AF3-Single-Seq,3o7j_1_2AL_0,0.30769230769230765,0.8769230769230769,"{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+1150,AF3-Single-Seq,2v7v_1_5FD_0,0.14999999999999997,0.9400000000000001,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+1151,AF3-Single-Seq,4rhe_1_FMN_6,0.3846153846153846,0.8461538461538461,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 4, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 4, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1152,AF3-Single-Seq,5fxf_1_BEZ_0,0.22222222222222227,0.9111111111111111,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1153,AF3-Single-Seq,2wwc_1_CHT_2,1.0,0.6,{'UNL:TYR:VdWContact': 1},{}
+1154,AF3-Single-Seq,6qkr_1_FAD_0,0.3636363636363636,0.8545454545454545,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 4, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 4, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1}"
+1155,AF3-Single-Seq,3inr_1_GDU_0,0.125,0.95,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+1156,AF3-Single-Seq,4idk_1_1FE_0,0.3333333333333333,0.8666666666666667,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ILE:VdWContact': 1}","{'UNL:GLU:VdWContact': 1, 'UNL:THR:VdWContact': 2}"
+1157,AF3-Single-Seq,6yao_1_OJ2_0,,0.0,,
+1158,AF3-Single-Seq,6ea9_1_9BG_0,0.34782608695652184,0.8608695652173912,"{'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 2}"
+1159,AF3-Single-Seq,6ur1_2_AT3_0,0.25,0.9,"{'UNL:ALA:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:HIS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+1160,AF3-Single-Seq,4mig_1_G3F_2,,0.0,,
+1161,AF3-Single-Seq,6wyz_1_DGL_1,0.33333333333333337,0.8666666666666667,"{'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3}"
+1162,AF3-Single-Seq,2v7t_1_SAH_4,0.3076923076923077,0.8769230769230769,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+1163,AF3-Single-Seq,3ad7_1_NAD_0,0.0,1.0,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+1164,AF3-Single-Seq,5hw0_1_GLU_2,0.41666666666666674,0.8333333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}"
+1165,AF3-Single-Seq,5hqx_1_EDZ_0,0.5,0.8,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+1166,AF3-Single-Seq,2q37_1_3AL_0,0.3846153846153845,0.8461538461538463,"{'UNL:ARG:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 4, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+1167,AF3-Single-Seq,6n19_2_K8V_0,,0.0,,
+1168,AF3-Single-Seq,2v7w_1_5FD_0,0.31578947368421056,0.8736842105263158,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+1169,AF3-Single-Seq,4phs_1_UDP_0,0.32,0.872,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+1170,AF3-Single-Seq,4ydx_1_TCE_0,0.0,1.0,"{'UNL:CYS:VdWContact': 2, 'UNL:GLY:VdWContact': 1}","{'UNL:CYS:VdWContact': 2, 'UNL:LYS:VdWContact': 1}"
+1171,AF3-Single-Seq,4xfm_1_THE_0,0.25,0.9,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}"
+1172,AF3-Single-Seq,3ub9_1_NHY_1,1.0,0.6,"{'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:VdWContact': 2}"
+1173,AF3-Single-Seq,1tkg_1_SSA_0,0.4,0.84,"{'UNL:ASP:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 2}"
+1174,AF3-Single-Seq,4o0d_1_GLY_3,,0.0,,
+1175,AF3-Single-Seq,6yap_1_OHZ_0,0.6818181818181818,0.7272727272727273,"{'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+1176,AF3-Single-Seq,6xb3_3_9BG_1,0.6296296296296298,0.7481481481481481,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:VdWContact': 5, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 2}"
+1177,AF3-Single-Seq,4kgx_1_CTP_5,0.5,0.8,"{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+1178,AF3-Single-Seq,3se5_1_ANP_2,0.368421052631579,0.8526315789473684,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+1179,AF3-Single-Seq,6gbf_1_AMP_0,,0.0,,
+1180,AF3-Single-Seq,2v7u_1_SAM_2,0.375,0.85,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 4, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+1181,AF3-Single-Seq,2gag_1_FOA_0,0.4666666666666666,0.8133333333333334,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+1182,AF3-Single-Seq,4uuw_1_AMP_0,0.2727272727272727,0.8909090909090909,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2}"
+1183,AF3-Single-Seq,4phr_1_UDP_0,0.125,0.95,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2}"
+1184,AF3-Single-Seq,1o72_2_PC_0,0.875,0.65,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:VdWContact': 3}","{'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}"
+1185,AF3-Single-Seq,4oal_2_245_0,0.9166666666666667,0.6333333333333333,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:LEU:VdWContact': 1}"
+1186,AF3-Single-Seq,1hg0_1_SIN_1,1.625,0.35,{'UNL:SER:VdWContact': 2},"{'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3}"
+1187,AF3-Single-Seq,3zjx_1_BOG_0,0.7647058823529413,0.6941176470588235,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 4}","{'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+1188,AF3-Single-Seq,6pa6_2_ASN_0,,0.0,,
+1189,AF3-Single-Seq,1qaw_1_TRP_7,0.17647058823529416,0.9294117647058824,"{'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 3}"
+1190,AF3,3s6a_1_ANP_0,0.39999999999999997,0.8400000000000001,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1}"
+1191,AF3,2gf3_2_FOA_1,0.8181818181818182,0.6727272727272727,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:GLN:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+1192,AF3,1v2g_1_OCA_0,0.5,0.8,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2}"
+1193,AF3,2r4e_1_13P_0,0.5,0.8,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 4, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+1194,AF3,3ub7_1_ACM_1,0.4444444444444444,0.8222222222222222,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:VdWContact': 1}"
+1195,AF3,4cdn_2_FAD_0,0.49999999999999994,0.8,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 4, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+1196,AF3,6yaq_1_OHZ_0,0.7894736842105262,0.6842105263157895,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1197,AF3,4cnl_1_CHT_1,1.3333333333333335,0.46666666666666656,"{'UNL:MET:VdWContact': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 1}",{}
+1198,AF3,5k45_2_GLU_1,0.4166666666666667,0.8333333333333333,"{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+1199,AF3,2zcz_2_TRP_3,0.7058823529411765,0.7176470588235294,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 3, 'UNL:THR:VdWContact': 4, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 6}"
+1200,AF3,5fxd_1_H7Y_1,0.9166666666666666,0.6333333333333333,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1201,AF3,5k3o_2_ASP_0,0.6363636363636365,0.7454545454545454,"{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 4, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}"
+1202,AF3,5fxe_1_CIY_1,0.7692307692307693,0.6923076923076923,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1203,AF3,5ida_1_BMA_0,0.16666666666666663,0.9333333333333333,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+1204,AF3,4osy_1_GLY_3,,0.0,,
+1205,AF3,5k62_1_ASN-VAL_0,,0.0,,
+1206,AF3,5b5s_1_BOG_0,0.7142857142857142,0.7142857142857143,"{'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:VdWContact': 1}"
+1207,AF3,1tke_1_SER_0,0.625,0.75,"{'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1}","{'UNL:CYS:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 3, 'UNL:MET:VdWContact': 1}"
+1208,AF3,6paa_1_ASP_2,0.2857142857142857,0.8857142857142857,"{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+1209,AF3,2gag_1_NAD_0,0.6153846153846154,0.7538461538461538,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 4, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+1210,AF3,6o6y_1_ACK_0,0.923076923076923,0.6307692307692307,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:VdWContact': 4}"
+1211,AF3,3zec_1_ANP_0,0.611111111111111,0.7555555555555555,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+1212,AF3,5mh1_1_BMA_0,,0.0,,
+1213,AF3,5dnc_1_ASN_2,,0.0,,
+1214,AF3,5u82_2_ZN0_0,,0.0,,
+1215,AF3,3wrb_1_GDE_0,0.5454545454545454,0.7818181818181819,"{'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1216,AF3,6ep5_1_ADP_1,0.3333333333333333,0.8666666666666667,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+1217,AF3,2vfu_1_MTL_0,0.33333333333333337,0.8666666666666667,"{'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+1218,AF3,3zzs_1_TRP_3,,0.0,,
+1219,AF3,6ryz_1_SAM_2,0.5,0.8,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+1220,AF3,5hmr_1_FDZ_0,0.7272727272727272,0.7090909090909091,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}"
+1221,AF3,2hs3_1_FGR_0,0.05882352941176469,0.9764705882352941,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1}"
+1222,AF3,6etf_1_AMP_0,,0.0,,
+1223,AF3,3jqm_1_GTP_5,1.1739130434782608,0.5304347826086957,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 5, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+1224,AF3,3eca_1_ASP_3,0.4285714285714285,0.8285714285714286,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}"
+1225,AF3,4osx_1_GLY_2,,0.0,,
+1226,AF3,2ze9_1_PD7_0,0.5625,0.775,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+1227,AF3,5f52_1_ASP_2,,0.0,,
+1228,AF3,6xug_1_O1Q_0,,0.0,,
+1229,AF3,4fyv_1_DCP_2,0.6428571428571428,0.7428571428571429,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+1230,AF3,2hk9_1_SKM_0,0.5384615384615384,0.7846153846153846,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+1231,AF3,6v2a_1_ASN_3,,0.0,,
+1232,AF3,1rqp_1_SAM_0,0.5833333333333334,0.7666666666666666,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+1233,AF3,2wr8_1_SAH_1,0.4,0.84,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+1234,AF3,5gqi_1_ATP_7,0.6666666666666666,0.7333333333333334,"{'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+1235,AF3,2vdf_1_OCT_0,1.2,0.52,"{'UNL:ALA:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}",{}
+1236,AF3,4qa8_1_PJZ_0,1.5555555555555558,0.37777777777777766,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 3, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 6, 'UNL:VAL:VdWContact': 3}","{'UNL:ALA:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+1237,AF3,5k66_1_ASN-GLU_0,,0.0,,
+1238,AF3,3gf4_1_FAD_1,0.4375,0.825,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+1239,AF3,4tvd_1_BGC_4,0.5,0.8,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 3}","{'UNL:GLU:VdWContact': 2, 'UNL:TYR:VdWContact': 2}"
+1240,AF3,1u8u_1_OCA_0,0.28571428571428575,0.8857142857142857,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2}"
+1241,AF3,2xta_1_ACO_0,0.4,0.84,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 2, 'UNL:ARG:VdWContact': 5, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1}"
+1242,AF3,5hhz_1_ZME_0,1.0,0.6,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2}"
+1243,AF3,4xdr_1_ADN_0,,0.0,,
+1244,AF3,6uqy_2_AT3_0,0.5,0.8,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 3}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1245,AF3,5k4h_2_GLU_3,0.5384615384615385,0.7846153846153846,"{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+1246,AF3,4tvd_1_GLC_0,1.25,0.5,{'UNL:ALA:VdWContact': 1},"{'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:LYS:VdWContact': 2}"
+1247,AF3,1pj2_1_FUM_0,,0.0,,
+1248,AF3,6o70_1_ACK_1,0.4615384615384615,0.8153846153846154,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+1249,AF3,2zd0_1_TRP_9,0.5294117647058824,0.788235294117647,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 2, 'UNL:THR:Hydrophobic': 3, 'UNL:THR:VdWContact': 4, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 4}"
+1250,AF3,1uf5_1_CDT_0,0.3571428571428572,0.8571428571428571,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+1251,AF3,4o95_1_245_0,1.2222222222222223,0.5111111111111111,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}",{'UNL:ASP:VdWContact': 1}
+1252,AF3,3ad9_1_NAD_0,0.6153846153846154,0.7538461538461538,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 4, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+1253,AF3,5k63_1_ASN-GLY_0,,0.0,,
+1254,AF3,4rpm_1_HXC_0,,0.0,,
+1255,AF3,4pfx_1_UDP_0,0.15,0.94,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+1256,AF3,2gah_1_NAD_0,0.48,0.808,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 4, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+1257,AF3,6pa2_1_ASP_2,,0.0,,
+1258,AF3,4h2f_1_ADN_0,0.375,0.85,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:VdWContact': 1}"
+1259,AF3,4u63_1_FAD_0,0.5357142857142856,0.7857142857142858,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 2, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+1260,AF3,4o0f_1_GLY_3,,0.0,,
+1261,AF3,2q6k_1_ADN_1,0.17647058823529416,0.9294117647058824,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}"
+1262,AF3,5fiu_1_Y3J_3,0.38095238095238093,0.8476190476190476,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}"
+1263,AF3,5f2t_1_PLM_0,1.2222222222222223,0.5111111111111111,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:HIS:VdWContact': 1}"
+1264,AF3,3ada_1_NAD_0,0.6086956521739132,0.7565217391304347,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 4, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+1265,AF3,4b4v_1_L34_0,0.44000000000000006,0.824,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1266,AF3,4uoc_1_NCN_1,0.10526315789473689,0.9578947368421052,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+1267,AF3,3uni_1_SAL_0,,0.0,,
+1268,AF3,3o7j_1_2AL_0,0.49999999999999994,0.8,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+1269,AF3,2v7v_1_5FD_0,0.5454545454545454,0.7818181818181819,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+1270,AF3,4rhe_1_FMN_6,0.4210526315789473,0.8315789473684211,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 4, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 4, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1271,AF3,5fxf_1_BEZ_0,0.1111111111111111,0.9555555555555556,"{'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1272,AF3,2wwc_1_CHT_2,1.5,0.4,"{'UNL:GLY:VdWContact': 1, 'UNL:TYR:VdWContact': 2}",{}
+1273,AF3,6qkr_1_FAD_0,0.5625,0.775,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 4, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1}"
+1274,AF3,3inr_1_GDU_0,0.8,0.6799999999999999,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 4}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+1275,AF3,4idk_1_1FE_0,1.0,0.6,"{'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLU:VdWContact': 1, 'UNL:THR:VdWContact': 2}"
+1276,AF3,6yao_1_OJ2_0,1.0,0.6,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:TYR:VdWContact': 2}"
+1277,AF3,6ea9_1_9BG_0,0.5714285714285713,0.7714285714285715,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 2}"
+1278,AF3,6ur1_2_AT3_0,0.8125,0.675,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:HIS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+1279,AF3,4mig_1_G3F_2,,0.0,,
+1280,AF3,6wyz_1_DGL_1,0.4444444444444445,0.8222222222222222,"{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3}"
+1281,AF3,2v7t_1_SAH_4,0.5833333333333335,0.7666666666666666,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+1282,AF3,3ad7_1_NAD_0,0.6799999999999999,0.728,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 4, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 4, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+1283,AF3,5hw0_1_GLU_2,0.2727272727272727,0.8909090909090909,"{'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}"
+1284,AF3,5hqx_1_EDZ_0,0.6923076923076921,0.7230769230769232,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+1285,AF3,2q37_1_3AL_0,0.5,0.8,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 4, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+1286,AF3,6n19_2_K8V_0,,0.0,,
+1287,AF3,2v7w_1_5FD_0,0.5238095238095237,0.7904761904761906,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+1288,AF3,4phs_1_UDP_0,0.22222222222222227,0.9111111111111111,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+1289,AF3,4ydx_1_TCE_0,0.3333333333333333,0.8666666666666667,"{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:LYS:VdWContact': 1}","{'UNL:CYS:VdWContact': 2, 'UNL:LYS:VdWContact': 1}"
+1290,AF3,4xfm_1_THE_0,0.375,0.85,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}"
+1291,AF3,3ub9_1_NHY_1,0.6666666666666667,0.7333333333333333,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ASP:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:VdWContact': 2}"
+1292,AF3,1tkg_1_SSA_0,0.5714285714285714,0.7714285714285715,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1}","{'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 2}"
+1293,AF3,4o0d_1_GLY_3,,0.0,,
+1294,AF3,6yap_1_OHZ_0,0.7692307692307692,0.6923076923076923,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 4, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+1295,AF3,6xb3_3_9BG_1,0.5454545454545454,0.7818181818181819,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 4, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:VdWContact': 5, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 2}"
+1296,AF3,4kgx_1_CTP_5,1.2857142857142856,0.48571428571428577,{},"{'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+1297,AF3,3se5_1_ANP_2,0.35,0.86,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+1298,AF3,6gbf_1_AMP_0,,0.0,,
+1299,AF3,2v7u_1_SAM_2,0.5833333333333335,0.7666666666666666,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+1300,AF3,2gag_1_FOA_0,0.28571428571428575,0.8857142857142857,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1}","{'UNL:ASN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+1301,AF3,4uuw_1_AMP_0,0.9333333333333333,0.6266666666666667,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2}"
+1302,AF3,4phr_1_UDP_0,0.411764705882353,0.8352941176470587,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2}"
+1303,AF3,1o72_2_PC_0,0.625,0.75,"{'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}"
+1304,AF3,4oal_2_245_0,1.090909090909091,0.5636363636363636,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:LEU:VdWContact': 1}"
+1305,AF3,1hg0_1_SIN_1,0.5999999999999999,0.76,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}","{'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3}"
+1306,AF3,3zjx_1_BOG_0,0.6666666666666667,0.7333333333333333,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+1307,AF3,6pa6_2_ASN_0,,0.0,,
+1308,AF3,1qaw_1_TRP_7,0.5625,0.775,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 3, 'UNL:THR:VdWContact': 4, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 3}"
diff --git a/notebooks/dockgen_plif_wm_values.png b/notebooks/dockgen_plif_wm_values.png
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diff --git a/notebooks/dockgen_primary_ligand_relaxed_bar_chart.png b/notebooks/dockgen_primary_ligand_relaxed_bar_chart.png
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diff --git a/notebooks/dockgen_primary_ligand_relaxed_rmsd_violin_plot.png b/notebooks/dockgen_primary_ligand_relaxed_rmsd_violin_plot.png
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diff --git a/notebooks/dockgen_structured_plif_metrics.csv b/notebooks/dockgen_structured_plif_metrics.csv
new file mode 100644
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+++ b/notebooks/dockgen_structured_plif_metrics.csv
@@ -0,0 +1,533 @@
+,Category,Target,Structured_EMD,Unstructured_EMD,Method_Histogram,Reference_Histogram
+0,P2Rank-Vina,3s6a_1_ANP_0,0.5,0.33333333333333337,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1}"
+1,P2Rank-Vina,2q37_1_3AL_0,0.25,0.5,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 2, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 4, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+2,P2Rank-Vina,4phs_1_UDP_0,0.75,0.38888888888888884,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+3,P2Rank-Vina,4xfm_1_THE_0,0.0,0.6666666666666666,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}"
+4,P2Rank-Vina,1tkg_1_SSA_0,0.25,0.45454545454545453,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 2}"
+5,P2Rank-Vina,1o72_2_PC_0,0.3333333333333333,0.75,"{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}"
+6,DiffDock-L,1v2g_1_OCA_0,0.5,0.5833333333333334,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2}"
+7,DiffDock-L,4cdn_2_FAD_0,0.5,0.47368421052631576,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+8,DiffDock-L,5k45_2_GLU_1,0.0,0.25,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+9,DiffDock-L,5k3o_2_ASP_0,0.5,1.3333333333333333,"{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 4, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}"
+10,DiffDock-L,5b5s_1_BOG_0,0.5,0.6666666666666667,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:VdWContact': 1}"
+11,DiffDock-L,6paa_1_ASP_2,0.75,0.3333333333333334,"{'UNL:ALA:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+12,DiffDock-L,2gag_1_NAD_0,0.4285714285714286,0.5909090909090908,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 4, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+13,DiffDock-L,6ep5_1_ADP_1,0.6,0.41666666666666674,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+14,DiffDock-L,2hs3_1_FGR_0,0.1428571428571429,0.4166666666666667,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1}"
+15,DiffDock-L,2ze9_1_PD7_0,0.3333333333333333,1.0714285714285716,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+16,DiffDock-L,4fyv_1_DCP_2,0.3333333333333333,0.4444444444444445,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+17,DiffDock-L,3gf4_1_FAD_1,0.22222222222222227,0.5238095238095237,"{'UNL:ARG:VdWContact': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 2, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+18,DiffDock-L,1u8u_1_OCA_0,0.0,0.7272727272727272,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2}"
+19,DiffDock-L,2xta_1_ACO_0,0.0,0.5454545454545453,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1}"
+20,DiffDock-L,6uqy_2_AT3_0,0.6666666666666666,0.36363636363636365,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+21,DiffDock-L,5k4h_2_GLU_3,0.39999999999999997,0.1428571428571429,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+22,DiffDock-L,4tvd_1_GLC_0,0.5,0.6,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:LYS:VdWContact': 2}"
+23,DiffDock-L,2zd0_1_TRP_9,0.19999999999999996,0.5999999999999999,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 4}"
+24,DiffDock-L,3ad9_1_NAD_0,0.11111111111111116,0.7142857142857144,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 8, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+25,DiffDock-L,4pfx_1_UDP_0,0.16666666666666666,0.2727272727272727,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+26,DiffDock-L,4u63_1_FAD_0,0.39999999999999997,0.619047619047619,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+27,DiffDock-L,3ada_1_NAD_0,0.2727272727272727,0.6363636363636362,"{'UNL:ALA:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 5, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+28,DiffDock-L,4b4v_1_L34_0,0.6666666666666666,0.3529411764705882,"{'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+29,DiffDock-L,4uoc_1_NCN_1,0.5,0.41666666666666663,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 4, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+30,DiffDock-L,2v7v_1_5FD_0,0.0,0.4,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+31,DiffDock-L,3inr_1_GDU_0,0.3333333333333333,0.42857142857142866,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+32,DiffDock-L,6wyz_1_DGL_1,0.0,0.75,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3}"
+33,DiffDock-L,2v7t_1_SAH_4,0.2857142857142857,0.375,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+34,DiffDock-L,3ad7_1_NAD_0,0.22222222222222227,0.6315789473684212,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 6, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+35,DiffDock-L,5hw0_1_GLU_2,0.6666666666666666,0.5,"{'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}"
+36,DiffDock-L,2v7w_1_5FD_0,0.16666666666666666,0.4666666666666667,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+37,DiffDock-L,4kgx_1_CTP_5,0.33333333333333337,0.33333333333333337,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+38,DiffDock-L,3se5_1_ANP_2,0.75,0.36363636363636365,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+39,DiffDock-L,2v7u_1_SAM_2,0.4444444444444445,0.2857142857142857,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+40,DiffDock-L,4uuw_1_AMP_0,0.19999999999999996,0.75,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2}"
+41,DiffDock-L,4phr_1_UDP_0,0.8,0.5454545454545454,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2}"
+42,DiffDock-L,1hg0_1_SIN_1,0.2,0.8571428571428571,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3}"
+43,DynamicBind,3s6a_1_ANP_0,0.5,0.10000000000000009,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1}"
+44,DynamicBind,1v2g_1_OCA_0,0.3333333333333333,0.5833333333333334,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2}"
+45,DynamicBind,2r4e_1_13P_0,0.75,0.5714285714285714,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+46,DynamicBind,4cdn_2_FAD_0,0.3999999999999999,0.41176470588235287,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+47,DynamicBind,5k45_2_GLU_1,0.19999999999999996,0.28571428571428575,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+48,DynamicBind,2zcz_2_TRP_3,0.19999999999999996,0.6666666666666667,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 3, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 6}"
+49,DynamicBind,5k3o_2_ASP_0,1.0,1.0,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 4, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}"
+50,DynamicBind,5ida_1_BMA_0,0.0,0.375,"{'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+51,DynamicBind,6paa_1_ASP_2,0.16666666666666669,0.4444444444444444,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+52,DynamicBind,2gag_1_NAD_0,0.7999999999999999,0.47368421052631576,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+53,DynamicBind,6o6y_1_ACK_0,0.0,1.0,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:VdWContact': 4}"
+54,DynamicBind,3wrb_1_GDE_0,0.0,0.45454545454545453,"{'UNL:ASN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+55,DynamicBind,6ep5_1_ADP_1,1.25,0.18181818181818188,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+56,DynamicBind,2vfu_1_MTL_0,0.16666666666666669,0.33333333333333326,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+57,DynamicBind,3jqm_1_GTP_5,0.3333333333333333,1.0833333333333335,"{'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+58,DynamicBind,3eca_1_ASP_3,0.49999999999999994,0.5454545454545455,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}"
+59,DynamicBind,2ze9_1_PD7_0,0.25,0.9444444444444444,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+60,DynamicBind,4fyv_1_DCP_2,0.3333333333333333,0.6923076923076923,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 4, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 3}","{'UNL:ALA:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+61,DynamicBind,1rqp_1_SAM_0,0.14285714285714285,0.55,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+62,DynamicBind,2wr8_1_SAH_1,0.19999999999999996,0.4666666666666666,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+63,DynamicBind,5gqi_1_ATP_7,0.0,0.7857142857142857,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+64,DynamicBind,3gf4_1_FAD_1,0.2,0.5789473684210528,"{'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 4, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+65,DynamicBind,1u8u_1_OCA_0,0.5,0.7000000000000001,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2}"
+66,DynamicBind,2xta_1_ACO_0,0.25,0.5833333333333334,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:VdWContact': 3}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1}"
+67,DynamicBind,5k4h_2_GLU_3,0.16666666666666669,0.5555555555555556,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+68,DynamicBind,6o70_1_ACK_1,0.5,0.18181818181818182,"{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+69,DynamicBind,1uf5_1_CDT_0,0.25,0.25,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+70,DynamicBind,3ad9_1_NAD_0,0.25,0.33333333333333326,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+71,DynamicBind,2gah_1_NAD_0,0.375,0.6666666666666667,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 4, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 4, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+72,DynamicBind,4h2f_1_ADN_0,0.19999999999999996,1.0,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 4, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:VdWContact': 1}"
+73,DynamicBind,2q6k_1_ADN_1,0.0,0.36363636363636365,"{'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}"
+74,DynamicBind,5fiu_1_Y3J_3,0.5,0.0,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}"
+75,DynamicBind,3ada_1_NAD_0,0.8333333333333334,0.380952380952381,"{'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+76,DynamicBind,4b4v_1_L34_0,0.5,0.42105263157894746,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+77,DynamicBind,4uoc_1_NCN_1,0.7999999999999999,0.5,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+78,DynamicBind,3o7j_1_2AL_0,0.3333333333333333,0.25,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 2, 'UNL:PRO:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+79,DynamicBind,2v7v_1_5FD_0,0.6000000000000001,0.2142857142857143,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+80,DynamicBind,4rhe_1_FMN_6,0.28571428571428575,0.5000000000000001,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 4, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 4, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+81,DynamicBind,5fxf_1_BEZ_0,0.0,0.33333333333333337,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+82,DynamicBind,6qkr_1_FAD_0,0.7142857142857143,0.3809523809523809,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 4, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 4, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1}"
+83,DynamicBind,3inr_1_GDU_0,0.7142857142857143,0.2857142857142857,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+84,DynamicBind,6ea9_1_9BG_0,0.0,0.5000000000000001,"{'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 2}"
+85,DynamicBind,6wyz_1_DGL_1,0.75,1.0,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3}"
+86,DynamicBind,2v7t_1_SAH_4,0.16666666666666669,0.3529411764705881,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 3, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+87,DynamicBind,3ad7_1_NAD_0,0.375,0.40909090909090906,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+88,DynamicBind,5hw0_1_GLU_2,0.3333333333333333,0.375,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 2}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}"
+89,DynamicBind,2q37_1_3AL_0,0.3333333333333333,0.25,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 4, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+90,DynamicBind,2v7w_1_5FD_0,0.6000000000000001,0.26666666666666666,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+91,DynamicBind,4phs_1_UDP_0,1.0,0.30769230769230776,"{'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+92,DynamicBind,4xfm_1_THE_0,0.0,0.5,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:SER:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}"
+93,DynamicBind,1tkg_1_SSA_0,0.3999999999999999,0.6923076923076923,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 2}"
+94,DynamicBind,6xb3_3_9BG_1,0.7999999999999998,0.6000000000000001,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 3, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:VdWContact': 5, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 2}"
+95,DynamicBind,4kgx_1_CTP_5,0.3999999999999999,0.5999999999999999,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 3}","{'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+96,DynamicBind,3se5_1_ANP_2,1.25,0.33333333333333337,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+97,DynamicBind,2v7u_1_SAM_2,0.3333333333333333,0.6111111111111112,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+98,DynamicBind,2gag_1_FOA_0,0.3333333333333333,0.6153846153846155,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ASN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+99,DynamicBind,4uuw_1_AMP_0,0.19999999999999996,0.6363636363636364,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2}"
+100,DynamicBind,1hg0_1_SIN_1,0.75,0.6666666666666667,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3}"
+101,DynamicBind,3zjx_1_BOG_0,0.0,0.19999999999999996,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+102,NeuralPLexer,3s6a_1_ANP_0,0.4000000000000001,0.125,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1}"
+103,NeuralPLexer,1v2g_1_OCA_0,0.5,0.5,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2}"
+104,NeuralPLexer,2r4e_1_13P_0,0.3999999999999999,1.0,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+105,NeuralPLexer,4cdn_2_FAD_0,0.6666666666666666,0.4,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+106,NeuralPLexer,5k45_2_GLU_1,0.25,0.16666666666666666,"{'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+107,NeuralPLexer,2zcz_2_TRP_3,0.25,0.9285714285714284,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 6}"
+108,NeuralPLexer,5k3o_2_ASP_0,0.3333333333333333,0.8571428571428572,"{'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 4, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}"
+109,NeuralPLexer,5b5s_1_BOG_0,0.0,0.19999999999999996,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:VdWContact': 1}"
+110,NeuralPLexer,6paa_1_ASP_2,0.2,0.2857142857142858,"{'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+111,NeuralPLexer,2gag_1_NAD_0,0.11111111111111116,0.5000000000000002,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 7, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+112,NeuralPLexer,6o6y_1_ACK_0,0.3333333333333333,0.7692307692307692,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:VdWContact': 4}"
+113,NeuralPLexer,3zec_1_ANP_0,0.25,0.75,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+114,NeuralPLexer,3wrb_1_GDE_0,0.0,0.5555555555555556,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+115,NeuralPLexer,6ep5_1_ADP_1,0.8333333333333334,0.3846153846153847,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+116,NeuralPLexer,2vfu_1_MTL_0,0.16666666666666669,0.3333333333333333,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+117,NeuralPLexer,2hs3_1_FGR_0,0.3333333333333333,0.44444444444444436,"{'UNL:ALA:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 3}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1}"
+118,NeuralPLexer,3jqm_1_GTP_5,0.0,0.8333333333333334,"{'UNL:ALA:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+119,NeuralPLexer,3eca_1_ASP_3,0.33333333333333326,0.5,"{'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}"
+120,NeuralPLexer,2ze9_1_PD7_0,1.0,0.42857142857142855,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+121,NeuralPLexer,4fyv_1_DCP_2,0.0,0.4545454545454545,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+122,NeuralPLexer,2hk9_1_SKM_0,0.0,0.11111111111111116,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+123,NeuralPLexer,1rqp_1_SAM_0,0.0,0.5625,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+124,NeuralPLexer,2wr8_1_SAH_1,0.4,0.45454545454545453,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+125,NeuralPLexer,5gqi_1_ATP_7,0.3333333333333333,0.19999999999999996,"{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+126,NeuralPLexer,3gf4_1_FAD_1,0.09090909090909094,0.4444444444444445,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+127,NeuralPLexer,1u8u_1_OCA_0,0.3333333333333333,0.6000000000000001,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2}"
+128,NeuralPLexer,2xta_1_ACO_0,0.6000000000000001,0.7692307692307694,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 3, 'UNL:SER:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1}"
+129,NeuralPLexer,5k4h_2_GLU_3,0.0,0.16666666666666666,"{'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+130,NeuralPLexer,4tvd_1_GLC_0,1.0,0.6666666666666666,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2}","{'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:LYS:VdWContact': 2}"
+131,NeuralPLexer,6o70_1_ACK_1,0.0,0.11111111111111116,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+132,NeuralPLexer,1uf5_1_CDT_0,0.6666666666666667,0.3636363636363635,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+133,NeuralPLexer,3ad9_1_NAD_0,0.11111111111111116,0.5555555555555556,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+134,NeuralPLexer,4pfx_1_UDP_0,0.1428571428571429,0.21428571428571438,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+135,NeuralPLexer,2gah_1_NAD_0,0.5,0.13333333333333341,"{'UNL:ALA:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 4, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 3}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 4, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+136,NeuralPLexer,4h2f_1_ADN_0,0.5,0.6666666666666666,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:VdWContact': 1}"
+137,NeuralPLexer,4u63_1_FAD_0,0.7999999999999999,0.2666666666666667,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 3, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+138,NeuralPLexer,2q6k_1_ADN_1,0.3333333333333333,0.5,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}"
+139,NeuralPLexer,5fiu_1_Y3J_3,0.33333333333333337,0.33333333333333326,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}"
+140,NeuralPLexer,3ada_1_NAD_0,0.6666666666666666,0.4666666666666667,"{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+141,NeuralPLexer,4uoc_1_NCN_1,0.8333333333333333,0.3571428571428571,"{'UNL:ALA:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+142,NeuralPLexer,3o7j_1_2AL_0,0.0,0.375,"{'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+143,NeuralPLexer,2v7v_1_5FD_0,0.375,0.5714285714285714,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+144,NeuralPLexer,4rhe_1_FMN_6,0.8,0.5625,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 4, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 4, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+145,NeuralPLexer,6qkr_1_FAD_0,0.33333333333333337,0.2857142857142858,"{'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 6, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 4, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1}"
+146,NeuralPLexer,3inr_1_GDU_0,0.3333333333333333,0.5555555555555557,"{'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 4}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+147,NeuralPLexer,6ea9_1_9BG_0,0.5999999999999999,0.6153846153846153,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 2}"
+148,NeuralPLexer,6wyz_1_DGL_1,0.6666666666666667,1.7999999999999998,"{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3}"
+149,NeuralPLexer,2v7t_1_SAH_4,0.125,0.375,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+150,NeuralPLexer,3ad7_1_NAD_0,0.14285714285714285,0.6428571428571428,"{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 5, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 2, 'UNL:GLY:VdWContact': 4, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 3}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+151,NeuralPLexer,5hw0_1_GLU_2,0.5,0.8,"{'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}"
+152,NeuralPLexer,2q37_1_3AL_0,0.0,0.5714285714285716,"{'UNL:ALA:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 4, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+153,NeuralPLexer,2v7w_1_5FD_0,0.25,0.5,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+154,NeuralPLexer,4phs_1_UDP_0,0.2,0.24999999999999994,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+155,NeuralPLexer,4xfm_1_THE_0,0.0,0.5,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}"
+156,NeuralPLexer,1tkg_1_SSA_0,0.3999999999999999,0.7999999999999999,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 2}"
+157,NeuralPLexer,6xb3_3_9BG_1,0.5555555555555557,0.5,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 4, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:VdWContact': 5, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 2}"
+158,NeuralPLexer,4kgx_1_CTP_5,0.19999999999999996,0.16666666666666669,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+159,NeuralPLexer,3se5_1_ANP_2,1.3333333333333333,0.16666666666666666,"{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+160,NeuralPLexer,2v7u_1_SAM_2,0.14285714285714285,0.588235294117647,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+161,NeuralPLexer,4phr_1_UDP_0,0.0,0.23076923076923078,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2}"
+162,NeuralPLexer,1o72_2_PC_0,0.0,1.5,"{'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 4, 'UNL:VAL:VdWContact': 1}","{'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}"
+163,NeuralPLexer,1hg0_1_SIN_1,0.25,0.6666666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3}"
+164,RFAA,1v2g_1_OCA_0,0.5,0.3,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2}"
+165,RFAA,2hs3_1_FGR_0,0.49999999999999994,0.26666666666666666,"{'UNL:ALA:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1}"
+166,RFAA,4fyv_1_DCP_2,0.3333333333333333,0.7142857142857143,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+167,RFAA,5gqi_1_ATP_7,0.19999999999999996,1.0,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 3, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+168,RFAA,3gf4_1_FAD_1,0.1111111111111111,0.25,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+169,RFAA,1u8u_1_OCA_0,0.25,0.6000000000000001,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2}"
+170,RFAA,3o7j_1_2AL_0,0.0,0.3333333333333333,"{'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+171,RFAA,1tkg_1_SSA_0,0.25,0.5,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 2}"
+172,RFAA,4kgx_1_CTP_5,0.0,0.375,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+173,RFAA,2v7u_1_SAM_2,0.14285714285714285,0.30769230769230776,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+174,Chai-1-Single-Seq,3s6a_1_ANP_0,0.5,0.33333333333333326,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1}"
+175,Chai-1-Single-Seq,1v2g_1_OCA_0,0.5,0.6923076923076923,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2}"
+176,Chai-1-Single-Seq,2r4e_1_13P_0,0.75,0.8333333333333334,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+177,Chai-1-Single-Seq,4cdn_2_FAD_0,0.2,0.55,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+178,Chai-1-Single-Seq,5k45_2_GLU_1,0.6,0.5555555555555555,"{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+179,Chai-1-Single-Seq,2zcz_2_TRP_3,0.3333333333333333,0.5000000000000001,"{'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 6}"
+180,Chai-1-Single-Seq,5k3o_2_ASP_0,0.5,0.5714285714285716,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}","{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 4, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}"
+181,Chai-1-Single-Seq,5ida_1_BMA_0,0.6666666666666666,0.2,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+182,Chai-1-Single-Seq,5b5s_1_BOG_0,0.0,1.1666666666666665,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:VdWContact': 1}"
+183,Chai-1-Single-Seq,1tke_1_SER_0,0.33333333333333337,0.7142857142857143,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1}","{'UNL:CYS:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 3, 'UNL:MET:VdWContact': 1}"
+184,Chai-1-Single-Seq,2gag_1_NAD_0,0.2857142857142857,0.75,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 4, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+185,Chai-1-Single-Seq,6o6y_1_ACK_0,0.6000000000000001,0.7272727272727273,"{'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:VdWContact': 4}"
+186,Chai-1-Single-Seq,3zec_1_ANP_0,0.3333333333333333,0.5,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+187,Chai-1-Single-Seq,3wrb_1_GDE_0,0.5,1.0,"{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+188,Chai-1-Single-Seq,6ep5_1_ADP_1,0.8,0.33333333333333326,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+189,Chai-1-Single-Seq,2vfu_1_MTL_0,0.3333333333333333,0.19999999999999996,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+190,Chai-1-Single-Seq,6ryz_1_SAM_2,0.2,0.15000000000000002,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+191,Chai-1-Single-Seq,2hs3_1_FGR_0,0.16666666666666663,0.33333333333333326,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:SER:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1}"
+192,Chai-1-Single-Seq,3eca_1_ASP_3,0.25,0.4285714285714286,"{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}"
+193,Chai-1-Single-Seq,2ze9_1_PD7_0,0.0,0.9230769230769231,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PRO:Hydrophobic': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+194,Chai-1-Single-Seq,4fyv_1_DCP_2,0.5,0.6,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+195,Chai-1-Single-Seq,2hk9_1_SKM_0,0.75,0.6000000000000001,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+196,Chai-1-Single-Seq,1rqp_1_SAM_0,0.3333333333333333,0.2142857142857143,"{'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+197,Chai-1-Single-Seq,2wr8_1_SAH_1,0.5,0.4,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+198,Chai-1-Single-Seq,5gqi_1_ATP_7,0.5,0.25,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+199,Chai-1-Single-Seq,3gf4_1_FAD_1,0.7142857142857143,0.1999999999999999,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+200,Chai-1-Single-Seq,1u8u_1_OCA_0,0.25,0.8666666666666667,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2}"
+201,Chai-1-Single-Seq,2xta_1_ACO_0,0.5,0.4444444444444444,"{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1}"
+202,Chai-1-Single-Seq,6uqy_2_AT3_0,0.0,0.25,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+203,Chai-1-Single-Seq,5k4h_2_GLU_3,0.75,0.3,"{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+204,Chai-1-Single-Seq,1pj2_1_FUM_0,0.3333333333333333,0.8333333333333334,"{'UNL:ARG:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2}"
+205,Chai-1-Single-Seq,6o70_1_ACK_1,0.6000000000000001,0.3333333333333334,"{'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+206,Chai-1-Single-Seq,2zd0_1_TRP_9,0.19999999999999996,0.3846153846153846,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 4}"
+207,Chai-1-Single-Seq,1uf5_1_CDT_0,0.6,0.5,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+208,Chai-1-Single-Seq,3ad9_1_NAD_0,0.14285714285714285,0.6,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 5, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+209,Chai-1-Single-Seq,2gah_1_NAD_0,0.375,0.5625,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 4, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+210,Chai-1-Single-Seq,4h2f_1_ADN_0,0.0,0.375,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:VdWContact': 1}"
+211,Chai-1-Single-Seq,4u63_1_FAD_0,0.2857142857142857,0.6818181818181819,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 2, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+212,Chai-1-Single-Seq,2q6k_1_ADN_1,0.3333333333333333,0.0,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2}","{'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}"
+213,Chai-1-Single-Seq,5fiu_1_Y3J_3,0.33333333333333337,0.21428571428571425,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}"
+214,Chai-1-Single-Seq,3ada_1_NAD_0,0.14285714285714285,0.6875,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 4, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 5, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+215,Chai-1-Single-Seq,4b4v_1_L34_0,0.33333333333333337,0.38888888888888895,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+216,Chai-1-Single-Seq,4uoc_1_NCN_1,0.5,0.20000000000000007,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+217,Chai-1-Single-Seq,3o7j_1_2AL_0,0.6,0.42857142857142855,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+218,Chai-1-Single-Seq,2v7v_1_5FD_0,0.11111111111111116,0.6428571428571428,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 3, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+219,Chai-1-Single-Seq,4rhe_1_FMN_6,1.0,0.8333333333333333,"{'UNL:ARG:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 4, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 4, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+220,Chai-1-Single-Seq,6qkr_1_FAD_0,0.15384615384615374,0.5357142857142856,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 4, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1}"
+221,Chai-1-Single-Seq,3inr_1_GDU_0,0.6666666666666666,0.5833333333333334,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 3, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+222,Chai-1-Single-Seq,6ea9_1_9BG_0,0.5,0.6000000000000001,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 2}"
+223,Chai-1-Single-Seq,6wyz_1_DGL_1,0.3999999999999999,0.7142857142857143,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3}"
+224,Chai-1-Single-Seq,2v7t_1_SAH_4,0.6000000000000001,0.3571428571428571,"{'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+225,Chai-1-Single-Seq,3ad7_1_NAD_0,0.14285714285714285,0.6428571428571428,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 4, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 4, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+226,Chai-1-Single-Seq,5hw0_1_GLU_2,0.75,0.8333333333333334,"{'UNL:ALA:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}"
+227,Chai-1-Single-Seq,2q37_1_3AL_0,0.6,0.4999999999999999,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 4, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+228,Chai-1-Single-Seq,2v7w_1_5FD_0,0.0,0.38461538461538464,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+229,Chai-1-Single-Seq,4phs_1_UDP_0,0.0,0.5,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+230,Chai-1-Single-Seq,4xfm_1_THE_0,0.3333333333333333,0.4000000000000001,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}"
+231,Chai-1-Single-Seq,1tkg_1_SSA_0,0.33333333333333337,0.5,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:PRO:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 2}"
+232,Chai-1-Single-Seq,6xb3_3_9BG_1,1.2,0.5333333333333332,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:VdWContact': 5, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 2}"
+233,Chai-1-Single-Seq,4kgx_1_CTP_5,0.25,0.2222222222222222,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+234,Chai-1-Single-Seq,3se5_1_ANP_2,0.25,0.4285714285714285,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+235,Chai-1-Single-Seq,2v7u_1_SAM_2,0.16666666666666669,0.4166666666666667,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+236,Chai-1-Single-Seq,4uuw_1_AMP_0,0.7999999999999999,0.6666666666666666,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2}"
+237,Chai-1-Single-Seq,4phr_1_UDP_0,0.5714285714285714,0.36363636363636365,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2}"
+238,Chai-1-Single-Seq,1o72_2_PC_0,0.0,0.5,"{'UNL:ARG:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}"
+239,Chai-1-Single-Seq,1hg0_1_SIN_1,0.0,0.75,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3}"
+240,Chai-1-Single-Seq,3zjx_1_BOG_0,0.0,0.9230769230769231,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+241,Chai-1,3s6a_1_ANP_0,0.6666666666666666,0.14285714285714285,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1}"
+242,Chai-1,1v2g_1_OCA_0,0.6,0.6923076923076924,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2}"
+243,Chai-1,2r4e_1_13P_0,0.5,0.20000000000000007,"{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+244,Chai-1,4cdn_2_FAD_0,0.4,0.5500000000000002,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 4, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+245,Chai-1,5k45_2_GLU_1,0.6,0.5555555555555555,"{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+246,Chai-1,2zcz_2_TRP_3,0.25,0.5000000000000001,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 6}"
+247,Chai-1,5k3o_2_ASP_0,0.5,0.5,"{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 4, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}"
+248,Chai-1,5ida_1_BMA_0,0.6666666666666666,0.2,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+249,Chai-1,1tke_1_SER_0,0.5,0.5714285714285714,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:CYS:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 3, 'UNL:MET:VdWContact': 1}"
+250,Chai-1,6paa_1_ASP_2,0.2857142857142857,0.375,"{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+251,Chai-1,2gag_1_NAD_0,0.6666666666666666,0.35294117647058826,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 3, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+252,Chai-1,6o6y_1_ACK_0,0.6666666666666666,1.0,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:VdWContact': 4}"
+253,Chai-1,3wrb_1_GDE_0,0.5,0.8,"{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+254,Chai-1,2vfu_1_MTL_0,0.25,0.11111111111111105,"{'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+255,Chai-1,2ze9_1_PD7_0,0.0,0.5625,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+256,Chai-1,4fyv_1_DCP_2,0.5,0.29999999999999993,"{'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PRO:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+257,Chai-1,2hk9_1_SKM_0,0.5,0.5000000000000001,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+258,Chai-1,1rqp_1_SAM_0,0.16666666666666666,0.25,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+259,Chai-1,2wr8_1_SAH_1,0.14285714285714285,0.35714285714285715,"{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+260,Chai-1,5gqi_1_ATP_7,0.5,0.3333333333333333,"{'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+261,Chai-1,3gf4_1_FAD_1,0.33333333333333337,0.3888888888888889,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 4}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+262,Chai-1,1u8u_1_OCA_0,0.3333333333333333,0.5714285714285715,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2}"
+263,Chai-1,2xta_1_ACO_0,0.5,0.25,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1}"
+264,Chai-1,6o70_1_ACK_1,0.3333333333333333,0.5625,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+265,Chai-1,2zd0_1_TRP_9,0.5,0.4545454545454545,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 3, 'UNL:THR:VdWContact': 4}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 4}"
+266,Chai-1,1uf5_1_CDT_0,0.6666666666666666,0.29999999999999993,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+267,Chai-1,3ad9_1_NAD_0,0.2857142857142857,0.4000000000000001,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+268,Chai-1,4pfx_1_UDP_0,0.0,0.1666666666666666,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+269,Chai-1,2gah_1_NAD_0,0.8,1.1666666666666665,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 4, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+270,Chai-1,4h2f_1_ADN_0,0.3333333333333333,0.625,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:VdWContact': 1}"
+271,Chai-1,4u63_1_FAD_0,0.28571428571428564,0.6000000000000001,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 2, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+272,Chai-1,2q6k_1_ADN_1,0.5,0.375,"{'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}"
+273,Chai-1,5fiu_1_Y3J_3,0.5,0.21428571428571427,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}"
+274,Chai-1,3ada_1_NAD_0,0.2857142857142857,0.46666666666666673,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+275,Chai-1,4b4v_1_L34_0,0.2,0.5263157894736842,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+276,Chai-1,4uoc_1_NCN_1,0.2,0.16666666666666663,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+277,Chai-1,3o7j_1_2AL_0,0.6,0.42857142857142855,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+278,Chai-1,2v7v_1_5FD_0,0.5,0.5714285714285714,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+279,Chai-1,5fxf_1_BEZ_0,0.0,0.44444444444444436,"{'UNL:ARG:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+280,Chai-1,6qkr_1_FAD_0,0.39999999999999997,0.2857142857142858,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 3, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 4, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1}"
+281,Chai-1,3inr_1_GDU_0,0.19999999999999996,0.24999999999999994,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+282,Chai-1,6ea9_1_9BG_0,0.4444444444444445,0.5384615384615385,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 2}"
+283,Chai-1,4mig_1_G3F_2,0.3333333333333333,0.875,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+284,Chai-1,2v7t_1_SAH_4,0.2857142857142857,0.33333333333333337,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+285,Chai-1,3ad7_1_NAD_0,0.2857142857142857,0.6000000000000001,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 4, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+286,Chai-1,5hw0_1_GLU_2,0.4,0.33333333333333326,"{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}"
+287,Chai-1,2q37_1_3AL_0,0.6,0.28571428571428575,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 3, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 4, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+288,Chai-1,2v7w_1_5FD_0,0.42857142857142855,0.5714285714285714,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+289,Chai-1,4phs_1_UDP_0,0.0,0.08333333333333334,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+290,Chai-1,4xfm_1_THE_0,0.3333333333333333,0.25,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}"
+291,Chai-1,1tkg_1_SSA_0,0.5,0.7692307692307693,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 2}"
+292,Chai-1,6xb3_3_9BG_1,0.7999999999999998,0.7647058823529411,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:VdWContact': 5, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 2}"
+293,Chai-1,4kgx_1_CTP_5,0.25,0.33333333333333337,"{'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+294,Chai-1,2v7u_1_SAM_2,0.16666666666666666,0.25000000000000006,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+295,Chai-1,2gag_1_FOA_0,0.0,0.3999999999999999,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1}","{'UNL:ASN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+296,Chai-1,4uuw_1_AMP_0,1.0,0.6666666666666666,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2}"
+297,Chai-1,4phr_1_UDP_0,0.375,0.41666666666666663,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2}"
+298,Chai-1,1hg0_1_SIN_1,0.75,1.2857142857142856,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1}","{'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3}"
+299,Chai-1,3zjx_1_BOG_0,0.0,1.0,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 3}","{'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+300,Chai-1,1qaw_1_TRP_7,0.5,1.1428571428571428,"{'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 3}"
+301,Boltz-1-Single-Seq,3s6a_1_ANP_0,0.5,0.25,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1}"
+302,Boltz-1-Single-Seq,1v2g_1_OCA_0,0.5,0.6000000000000001,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2}"
+303,Boltz-1-Single-Seq,2r4e_1_13P_0,0.5,0.125,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+304,Boltz-1-Single-Seq,4cdn_2_FAD_0,0.6000000000000001,0.4500000000000001,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+305,Boltz-1-Single-Seq,5k45_2_GLU_1,0.25,0.5,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+306,Boltz-1-Single-Seq,2zcz_2_TRP_3,0.6,0.6666666666666666,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 3, 'UNL:THR:VdWContact': 4, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 6}"
+307,Boltz-1-Single-Seq,5k3o_2_ASP_0,0.5,0.5555555555555556,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 4, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}"
+308,Boltz-1-Single-Seq,5ida_1_BMA_0,0.5,0.16666666666666666,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+309,Boltz-1-Single-Seq,1tke_1_SER_0,0.33333333333333337,0.6666666666666666,"{'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:CYS:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 3, 'UNL:MET:VdWContact': 1}"
+310,Boltz-1-Single-Seq,6paa_1_ASP_2,0.3333333333333333,0.4444444444444445,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+311,Boltz-1-Single-Seq,6o6y_1_ACK_0,0.6666666666666666,1.0,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:VdWContact': 4}"
+312,Boltz-1-Single-Seq,3zec_1_ANP_0,0.5,0.6666666666666666,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+313,Boltz-1-Single-Seq,3wrb_1_GDE_0,0.3333333333333333,0.7272727272727273,"{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+314,Boltz-1-Single-Seq,6ep5_1_ADP_1,0.5,0.18181818181818182,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+315,Boltz-1-Single-Seq,2vfu_1_MTL_0,0.0,0.0,"{'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+316,Boltz-1-Single-Seq,6ryz_1_SAM_2,0.375,0.6470588235294117,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+317,Boltz-1-Single-Seq,2hs3_1_FGR_0,0.8,0.46153846153846145,"{'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1}"
+318,Boltz-1-Single-Seq,3jqm_1_GTP_5,0.9,1.0666666666666667,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+319,Boltz-1-Single-Seq,3eca_1_ASP_3,0.2857142857142857,0.5555555555555556,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}"
+320,Boltz-1-Single-Seq,2ze9_1_PD7_0,0.6666666666666667,0.5384615384615383,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+321,Boltz-1-Single-Seq,4fyv_1_DCP_2,0.6666666666666666,0.8,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+322,Boltz-1-Single-Seq,2hk9_1_SKM_0,0.6666666666666666,0.375,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+323,Boltz-1-Single-Seq,1rqp_1_SAM_0,0.5454545454545454,0.5625,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+324,Boltz-1-Single-Seq,2wr8_1_SAH_1,0.5,0.5,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+325,Boltz-1-Single-Seq,3gf4_1_FAD_1,0.3,0.5454545454545454,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+326,Boltz-1-Single-Seq,1u8u_1_OCA_0,0.25,0.8333333333333334,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2}"
+327,Boltz-1-Single-Seq,6uqy_2_AT3_0,0.0,0.6666666666666666,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 3}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+328,Boltz-1-Single-Seq,5k4h_2_GLU_3,0.33333333333333337,0.5714285714285714,"{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+329,Boltz-1-Single-Seq,4tvd_1_GLC_0,1.0,0.75,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:LYS:VdWContact': 2}"
+330,Boltz-1-Single-Seq,2zd0_1_TRP_9,0.6666666666666666,0.6363636363636364,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 2, 'UNL:THR:Hydrophobic': 3, 'UNL:THR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 4}"
+331,Boltz-1-Single-Seq,1uf5_1_CDT_0,0.5,0.3333333333333333,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+332,Boltz-1-Single-Seq,4pfx_1_UDP_0,0.14285714285714285,0.24999999999999997,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+333,Boltz-1-Single-Seq,4h2f_1_ADN_0,0.6666666666666667,0.6666666666666666,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:VdWContact': 1}"
+334,Boltz-1-Single-Seq,4u63_1_FAD_0,0.375,0.7142857142857142,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 2, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+335,Boltz-1-Single-Seq,2q6k_1_ADN_1,0.0,0.25,"{'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}"
+336,Boltz-1-Single-Seq,5fiu_1_Y3J_3,0.5714285714285714,0.4285714285714285,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}"
+337,Boltz-1-Single-Seq,4b4v_1_L34_0,0.2,0.55,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+338,Boltz-1-Single-Seq,4uoc_1_NCN_1,0.14285714285714285,0.08333333333333326,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+339,Boltz-1-Single-Seq,3o7j_1_2AL_0,0.6666666666666666,0.5,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+340,Boltz-1-Single-Seq,2v7v_1_5FD_0,0.4444444444444445,0.4666666666666667,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+341,Boltz-1-Single-Seq,4rhe_1_FMN_6,0.5,0.38461538461538464,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 3, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 4, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 4, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+342,Boltz-1-Single-Seq,5fxf_1_BEZ_0,0.0,0.2222222222222222,"{'UNL:ARG:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+343,Boltz-1-Single-Seq,6qkr_1_FAD_0,0.125,0.7727272727272728,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 3, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:VdWContact': 4, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 4, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1}"
+344,Boltz-1-Single-Seq,3inr_1_GDU_0,0.25,0.5833333333333335,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 4}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+345,Boltz-1-Single-Seq,6ea9_1_9BG_0,0.2,0.3846153846153846,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 2}"
+346,Boltz-1-Single-Seq,6wyz_1_DGL_1,0.2,0.6,"{'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3}"
+347,Boltz-1-Single-Seq,2v7t_1_SAH_4,0.5,0.26666666666666666,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+348,Boltz-1-Single-Seq,5hw0_1_GLU_2,0.25,0.33333333333333326,"{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}"
+349,Boltz-1-Single-Seq,2q37_1_3AL_0,0.6666666666666666,0.2857142857142858,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 4, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+350,Boltz-1-Single-Seq,2v7w_1_5FD_0,0.375,0.6,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+351,Boltz-1-Single-Seq,4phs_1_UDP_0,0.2,0.38461538461538475,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+352,Boltz-1-Single-Seq,4xfm_1_THE_0,0.3333333333333333,0.7142857142857143,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}"
+353,Boltz-1-Single-Seq,1tkg_1_SSA_0,0.5999999999999999,0.5833333333333334,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 2}"
+354,Boltz-1-Single-Seq,6xb3_3_9BG_1,0.33333333333333337,0.625,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 4, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:VdWContact': 5, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 2}"
+355,Boltz-1-Single-Seq,4kgx_1_CTP_5,0.5,0.5,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+356,Boltz-1-Single-Seq,3se5_1_ANP_2,0.5,0.2857142857142857,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+357,Boltz-1-Single-Seq,2v7u_1_SAM_2,0.4444444444444445,0.5625,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+358,Boltz-1-Single-Seq,4uuw_1_AMP_0,0.75,0.8999999999999999,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2}"
+359,Boltz-1-Single-Seq,4phr_1_UDP_0,0.3333333333333333,0.4545454545454546,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2}"
+360,Boltz-1-Single-Seq,1o72_2_PC_0,0.5,1.0,"{'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 3}","{'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}"
+361,Boltz-1-Single-Seq,1hg0_1_SIN_1,0.25,0.8571428571428571,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}","{'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3}"
+362,Boltz-1-Single-Seq,1qaw_1_TRP_7,0.6,0.45454545454545436,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 2, 'UNL:THR:Hydrophobic': 3, 'UNL:THR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 3}"
+363,Boltz-1,3s6a_1_ANP_0,0.4,0.25,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1}"
+364,Boltz-1,1v2g_1_OCA_0,0.5,0.6363636363636364,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2}"
+365,Boltz-1,2r4e_1_13P_0,1.0,0.125,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+366,Boltz-1,4cdn_2_FAD_0,0.5000000000000001,0.368421052631579,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+367,Boltz-1,5k45_2_GLU_1,0.25,0.375,"{'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+368,Boltz-1,2zcz_2_TRP_3,0.6,0.6363636363636362,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 3, 'UNL:THR:VdWContact': 4, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 6}"
+369,Boltz-1,5k3o_2_ASP_0,0.5,0.5555555555555556,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 4, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}"
+370,Boltz-1,5ida_1_BMA_0,0.0,0.16666666666666666,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+371,Boltz-1,1tke_1_SER_0,0.5,0.6666666666666666,"{'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:CYS:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 3, 'UNL:MET:VdWContact': 1}"
+372,Boltz-1,6paa_1_ASP_2,0.2,0.4444444444444445,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+373,Boltz-1,6o6y_1_ACK_0,0.6666666666666666,1.0833333333333335,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:VdWContact': 4}"
+374,Boltz-1,2vfu_1_MTL_0,0.5,0.0,"{'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+375,Boltz-1,2hs3_1_FGR_0,0.3333333333333333,0.3076923076923077,"{'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1}"
+376,Boltz-1,3jqm_1_GTP_5,1.0,1.2142857142857142,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:HBDonor': 2, 'UNL:LYS:VdWContact': 4, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+377,Boltz-1,2ze9_1_PD7_0,0.5,0.4615384615384615,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+378,Boltz-1,2hk9_1_SKM_0,0.6666666666666666,0.40000000000000013,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+379,Boltz-1,2wr8_1_SAH_1,0.5,0.5454545454545454,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+380,Boltz-1,1u8u_1_OCA_0,0.25,0.5833333333333334,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2}"
+381,Boltz-1,6uqy_2_AT3_0,0.0,0.5833333333333335,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 3}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+382,Boltz-1,6o70_1_ACK_1,0.6000000000000001,0.4666666666666666,"{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+383,Boltz-1,2zd0_1_TRP_9,0.6666666666666666,0.6,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 2, 'UNL:THR:Hydrophobic': 3, 'UNL:THR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 4}"
+384,Boltz-1,1uf5_1_CDT_0,0.5,0.30000000000000004,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+385,Boltz-1,4pfx_1_UDP_0,0.14285714285714285,0.16666666666666663,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+386,Boltz-1,4h2f_1_ADN_0,0.6666666666666667,0.6666666666666666,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:VdWContact': 1}"
+387,Boltz-1,4u63_1_FAD_0,0.2857142857142857,0.7142857142857142,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+388,Boltz-1,2q6k_1_ADN_1,0.3333333333333333,0.0,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2}","{'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}"
+389,Boltz-1,4b4v_1_L34_0,0.2,0.6190476190476191,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+390,Boltz-1,3o7j_1_2AL_0,0.6666666666666666,0.5,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+391,Boltz-1,6qkr_1_FAD_0,0.2222222222222222,0.8571428571428571,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 3, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:VdWContact': 6, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 4, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1}"
+392,Boltz-1,6ea9_1_9BG_0,0.19999999999999996,0.6153846153846154,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 2}"
+393,Boltz-1,2q37_1_3AL_0,0.6666666666666666,0.4999999999999999,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 4, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+394,Boltz-1,4phs_1_UDP_0,0.2,0.24999999999999997,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+395,Boltz-1,4xfm_1_THE_0,0.3333333333333333,0.6000000000000001,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}"
+396,Boltz-1,1tkg_1_SSA_0,0.5999999999999999,0.6428571428571429,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 2}"
+397,Boltz-1,6xb3_3_9BG_1,0.16666666666666666,0.7333333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:VdWContact': 5, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 2}"
+398,Boltz-1,4phr_1_UDP_0,0.3333333333333333,0.5454545454545455,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2}"
+399,Boltz-1,1o72_2_PC_0,0.3333333333333333,1.0,"{'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 3}","{'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}"
+400,Boltz-1,3zjx_1_BOG_0,0.0,1.0,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+401,Boltz-1,1qaw_1_TRP_7,0.5,0.5333333333333333,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 3}"
+402,AF3-Single-Seq,3s6a_1_ANP_0,0.8999999999999999,0.16666666666666669,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1}"
+403,AF3-Single-Seq,1v2g_1_OCA_0,0.3333333333333333,0.5384615384615384,"{'UNL:ASN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2}"
+404,AF3-Single-Seq,2r4e_1_13P_0,0.3999999999999999,0.44444444444444453,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+405,AF3-Single-Seq,4cdn_2_FAD_0,0.3999999999999999,0.4090909090909091,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+406,AF3-Single-Seq,5k45_2_GLU_1,0.16666666666666669,0.44444444444444436,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+407,AF3-Single-Seq,5k3o_2_ASP_0,0.33333333333333337,0.25,"{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 4, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}"
+408,AF3-Single-Seq,5b5s_1_BOG_0,0.0,0.7142857142857144,"{'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:VdWContact': 1}"
+409,AF3-Single-Seq,1tke_1_SER_0,0.6666666666666667,0.5,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:CYS:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 3, 'UNL:MET:VdWContact': 1}"
+410,AF3-Single-Seq,2gag_1_NAD_0,0.2857142857142857,0.28571428571428586,"{'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 4, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+411,AF3-Single-Seq,6o6y_1_ACK_0,0.0,0.7142857142857142,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:VdWContact': 4}"
+412,AF3-Single-Seq,3zec_1_ANP_0,0.5,0.375,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+413,AF3-Single-Seq,6ep5_1_ADP_1,0.8,0.2727272727272728,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+414,AF3-Single-Seq,2vfu_1_MTL_0,0.0,0.49999999999999994,"{'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+415,AF3-Single-Seq,6ryz_1_SAM_2,0.39999999999999997,0.4117647058823529,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+416,AF3-Single-Seq,2hs3_1_FGR_0,0.1428571428571429,0.4545454545454546,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1}"
+417,AF3-Single-Seq,3jqm_1_GTP_5,0.0,0.5714285714285715,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+418,AF3-Single-Seq,3eca_1_ASP_3,0.75,0.4000000000000001,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}"
+419,AF3-Single-Seq,2ze9_1_PD7_0,0.6666666666666667,1.1333333333333333,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+420,AF3-Single-Seq,4fyv_1_DCP_2,0.6666666666666667,0.4166666666666667,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+421,AF3-Single-Seq,2hk9_1_SKM_0,0.0,0.3846153846153845,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+422,AF3-Single-Seq,1rqp_1_SAM_0,0.125,0.36363636363636365,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+423,AF3-Single-Seq,2wr8_1_SAH_1,0.33333333333333337,0.39999999999999997,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+424,AF3-Single-Seq,5gqi_1_ATP_7,0.0,0.5714285714285714,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+425,AF3-Single-Seq,3gf4_1_FAD_1,0.10000000000000003,0.40909090909090917,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+426,AF3-Single-Seq,1u8u_1_OCA_0,0.6666666666666666,0.6000000000000001,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2}"
+427,AF3-Single-Seq,2xta_1_ACO_0,0.3999999999999999,0.7692307692307694,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 4, 'UNL:ASP:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 4, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1}"
+428,AF3-Single-Seq,6o70_1_ACK_1,0.3333333333333333,0.3333333333333334,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+429,AF3-Single-Seq,1uf5_1_CDT_0,0.49999999999999994,0.46153846153846156,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+430,AF3-Single-Seq,3ad9_1_NAD_0,0.28571428571428575,0.4285714285714286,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 3, 'UNL:THR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+431,AF3-Single-Seq,4pfx_1_UDP_0,0.8333333333333334,0.26666666666666666,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+432,AF3-Single-Seq,2gah_1_NAD_0,0.28571428571428575,0.6,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 4, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+433,AF3-Single-Seq,4h2f_1_ADN_0,0.0,0.7000000000000001,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:VdWContact': 1}"
+434,AF3-Single-Seq,4u63_1_FAD_0,0.33333333333333326,0.2380952380952382,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+435,AF3-Single-Seq,2q6k_1_ADN_1,0.3333333333333333,0.4444444444444445,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}"
+436,AF3-Single-Seq,5fiu_1_Y3J_3,0.2,0.21428571428571425,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}"
+437,AF3-Single-Seq,3ada_1_NAD_0,0.33333333333333326,0.4736842105263158,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 3, 'UNL:THR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+438,AF3-Single-Seq,4b4v_1_L34_0,0.5,0.0625,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+439,AF3-Single-Seq,4uoc_1_NCN_1,1.0,1.0909090909090908,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+440,AF3-Single-Seq,3o7j_1_2AL_0,0.5999999999999999,0.625,"{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+441,AF3-Single-Seq,2v7v_1_5FD_0,0.0,0.21428571428571436,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+442,AF3-Single-Seq,4rhe_1_FMN_6,0.3333333333333333,0.5,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 4, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 4, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+443,AF3-Single-Seq,6qkr_1_FAD_0,0.1111111111111111,0.5416666666666667,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 4, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 4, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1}"
+444,AF3-Single-Seq,3inr_1_GDU_0,0.19999999999999996,0.27272727272727265,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+445,AF3-Single-Seq,6ea9_1_9BG_0,0.3333333333333333,0.4705882352941176,"{'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 2}"
+446,AF3-Single-Seq,6wyz_1_DGL_1,0.25,0.625,"{'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3}"
+447,AF3-Single-Seq,2v7t_1_SAH_4,0.33333333333333337,0.2941176470588235,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+448,AF3-Single-Seq,3ad7_1_NAD_0,0.28571428571428575,0.10526315789473689,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+449,AF3-Single-Seq,5hw0_1_GLU_2,1.0,0.4444444444444445,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}"
+450,AF3-Single-Seq,2q37_1_3AL_0,0.3333333333333333,0.3999999999999999,"{'UNL:ARG:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 4, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+451,AF3-Single-Seq,2v7w_1_5FD_0,0.14285714285714285,0.41666666666666663,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+452,AF3-Single-Seq,4phs_1_UDP_0,0.28571428571428575,0.4444444444444444,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+453,AF3-Single-Seq,4xfm_1_THE_0,0.39999999999999997,0.14285714285714285,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}"
+454,AF3-Single-Seq,6xb3_3_9BG_1,0.4999999999999999,0.7058823529411764,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:VdWContact': 5, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 2}"
+455,AF3-Single-Seq,4kgx_1_CTP_5,0.7999999999999998,0.36363636363636365,"{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+456,AF3-Single-Seq,3se5_1_ANP_2,0.39999999999999997,0.3571428571428571,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+457,AF3-Single-Seq,2v7u_1_SAM_2,0.25,0.4375,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 4, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+458,AF3-Single-Seq,2gag_1_FOA_0,0.3333333333333333,0.5,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+459,AF3-Single-Seq,4phr_1_UDP_0,0.5999999999999999,0.27272727272727276,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2}"
+460,AF3-Single-Seq,1o72_2_PC_0,0.3333333333333333,1.2,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:VdWContact': 3}","{'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}"
+461,AF3-Single-Seq,3zjx_1_BOG_0,0.3333333333333333,0.8571428571428572,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 4}","{'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+462,AF3-Single-Seq,1qaw_1_TRP_7,0.19999999999999996,0.16666666666666663,"{'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 3}"
+463,AF3,3s6a_1_ANP_0,0.5,0.33333333333333326,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1}"
+464,AF3,1v2g_1_OCA_0,0.5,0.5,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2}"
+465,AF3,2r4e_1_13P_0,0.6666666666666667,0.4000000000000001,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 4, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+466,AF3,4cdn_2_FAD_0,0.5,0.5000000000000001,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 4, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+467,AF3,5k45_2_GLU_1,0.5,0.33333333333333326,"{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+468,AF3,2zcz_2_TRP_3,0.6,0.75,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 3, 'UNL:THR:VdWContact': 4, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 6}"
+469,AF3,5k3o_2_ASP_0,0.5,0.7142857142857144,"{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 4, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}"
+470,AF3,5ida_1_BMA_0,0.0,0.19999999999999996,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+471,AF3,5b5s_1_BOG_0,0.0,1.0,"{'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:VdWContact': 1}"
+472,AF3,1tke_1_SER_0,0.6666666666666667,0.6000000000000001,"{'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1}","{'UNL:CYS:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 3, 'UNL:MET:VdWContact': 1}"
+473,AF3,6paa_1_ASP_2,0.2,0.3333333333333333,"{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+474,AF3,2gag_1_NAD_0,0.375,0.7222222222222222,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 4, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+475,AF3,6o6y_1_ACK_0,0.5,1.0,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:VdWContact': 4}"
+476,AF3,3zec_1_ANP_0,0.4,0.6923076923076923,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+477,AF3,3wrb_1_GDE_0,0.0,0.6666666666666667,"{'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+478,AF3,6ep5_1_ADP_1,0.0,0.4166666666666666,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+479,AF3,2vfu_1_MTL_0,0.5,0.25,"{'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+480,AF3,6ryz_1_SAM_2,0.375,0.5555555555555556,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+481,AF3,2hs3_1_FGR_0,0.4285714285714286,0.19999999999999998,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1}"
+482,AF3,3jqm_1_GTP_5,0.9,1.3846153846153844,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 5, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+483,AF3,3eca_1_ASP_3,0.2857142857142857,0.5714285714285715,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}"
+484,AF3,2ze9_1_PD7_0,0.3333333333333333,0.6153846153846153,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+485,AF3,4fyv_1_DCP_2,0.3333333333333333,0.7272727272727272,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+486,AF3,2hk9_1_SKM_0,0.6666666666666666,0.5000000000000001,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+487,AF3,1rqp_1_SAM_0,0.5555555555555556,0.6000000000000001,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
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+492,AF3,2xta_1_ACO_0,0.0,0.5714285714285714,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 2, 'UNL:ARG:VdWContact': 5, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1}"
+493,AF3,6uqy_2_AT3_0,0.0,0.6363636363636364,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 3}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
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+495,AF3,6o70_1_ACK_1,0.5,0.4545454545454545,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
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+498,AF3,3ad9_1_NAD_0,0.375,0.7222222222222223,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 4, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+499,AF3,4pfx_1_UDP_0,0.25,0.08333333333333334,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+500,AF3,2gah_1_NAD_0,0.2857142857142857,0.5555555555555556,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 4, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+501,AF3,4h2f_1_ADN_0,0.5,0.33333333333333337,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:VdWContact': 1}"
+502,AF3,4u63_1_FAD_0,0.375,0.6000000000000001,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 2, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+503,AF3,2q6k_1_ADN_1,0.3333333333333333,0.09090909090909083,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}"
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+520,AF3,4phs_1_UDP_0,0.3333333333333333,0.1666666666666666,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+521,AF3,4xfm_1_THE_0,0.5,0.25,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}"
+522,AF3,1tkg_1_SSA_0,0.3333333333333333,0.6363636363636364,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1}","{'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 2}"
+523,AF3,6xb3_3_9BG_1,0.375,0.6428571428571428,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 4, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:VdWContact': 5, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 2}"
+524,AF3,3se5_1_ANP_2,0.39999999999999997,0.4666666666666667,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+525,AF3,2v7u_1_SAM_2,0.5555555555555556,0.6000000000000001,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+526,AF3,2gag_1_FOA_0,0.0,0.3999999999999999,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1}","{'UNL:ASN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+527,AF3,4uuw_1_AMP_0,0.7999999999999999,1.0,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2}"
+528,AF3,4phr_1_UDP_0,0.49999999999999994,0.36363636363636354,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2}"
+529,AF3,1o72_2_PC_0,0.3333333333333333,0.8,"{'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}"
+530,AF3,1hg0_1_SIN_1,0.25,0.8333333333333334,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}","{'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3}"
+531,AF3,1qaw_1_TRP_7,0.4,0.6363636363636362,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 3, 'UNL:THR:VdWContact': 4, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 3}"
diff --git a/notebooks/dockgen_structured_vs_unstructured_emd_values.png b/notebooks/dockgen_structured_vs_unstructured_emd_values.png
new file mode 100644
index 00000000..fd4dd55f
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diff --git a/notebooks/failed_af3_complexes_functional_keywords.png b/notebooks/failed_af3_complexes_functional_keywords.png
new file mode 100644
index 00000000..a44af721
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diff --git a/notebooks/failed_complexes_functional_keywords_1.png b/notebooks/failed_complexes_functional_keywords_1.png
new file mode 100644
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diff --git a/notebooks/failure_modes_analysis_plotting.ipynb b/notebooks/failure_modes_analysis_plotting.ipynb
index 9d30d91a..9d9ada39 100644
--- a/notebooks/failure_modes_analysis_plotting.ipynb
+++ b/notebooks/failure_modes_analysis_plotting.ipynb
@@ -94,6 +94,8 @@
     "    \"rfaa\",\n",
     "    \"chai-lab_ss\",\n",
     "    \"chai-lab\",\n",
+    "    \"boltz_ss\",\n",
+    "    \"boltz\",\n",
     "    \"alphafold3_ss\",\n",
     "    \"alphafold3\",\n",
     "]\n",
@@ -131,6 +133,7 @@
     "globals()[\"neuralplexer_output_dir\"] = os.path.join(\"..\", \"forks\", \"NeuralPLexer\", \"inference\")\n",
     "globals()[\"rfaa_output_dir\"] = os.path.join(\"..\", \"forks\", \"RoseTTAFold-All-Atom\", \"inference\")\n",
     "globals()[\"chai-lab_output_dir\"] = os.path.join(\"..\", \"forks\", \"chai-lab\", \"inference\")\n",
+    "globals()[\"boltz_output_dir\"] = os.path.join(\"..\", \"forks\", \"boltz\", \"inference\")\n",
     "globals()[\"alphafold3_output_dir\"] = os.path.join(\"..\", \"forks\", \"alphafold3\", \"inference\")\n",
     "globals()[\"casp15_output_dir\"] = os.path.join(\"..\", \"data\", \"test_cases\", \"casp15\")\n",
     "for config in [\"\", \"_relaxed\"]:\n",
@@ -255,6 +258,40 @@
     "                )\n",
     "            )\n",
     "\n",
+    "            # Boltz (Single-Seq) results\n",
+    "            globals()[f\"boltz_ss_{dataset}{config}_bust_results_csv_filepath_{repeat_index}\"] = (\n",
+    "                os.path.join(\n",
+    "                    (\n",
+    "                        globals()[\"casp15_output_dir\"] + config\n",
+    "                        if dataset == \"casp15\"\n",
+    "                        else globals()[\"boltz_output_dir\"]\n",
+    "                    ),\n",
+    "                    (\n",
+    "                        f\"top_boltz_ss_ensemble_predictions_{repeat_index}\"\n",
+    "                        if dataset == \"casp15\"\n",
+    "                        else f\"boltz_ss_{dataset}_outputs_{repeat_index}{config}\"\n",
+    "                    ),\n",
+    "                    \"scoring_results.csv\" if dataset == \"casp15\" else \"bust_results.csv\",\n",
+    "                )\n",
+    "            )\n",
+    "\n",
+    "            # Boltz results\n",
+    "            globals()[f\"boltz_{dataset}{config}_bust_results_csv_filepath_{repeat_index}\"] = (\n",
+    "                os.path.join(\n",
+    "                    (\n",
+    "                        globals()[\"casp15_output_dir\"] + config\n",
+    "                        if dataset == \"casp15\"\n",
+    "                        else globals()[\"boltz_output_dir\"]\n",
+    "                    ),\n",
+    "                    (\n",
+    "                        f\"top_boltz_ensemble_predictions_{repeat_index}\"\n",
+    "                        if dataset == \"casp15\"\n",
+    "                        else f\"boltz_{dataset}_outputs_{repeat_index}{config}\"\n",
+    "                    ),\n",
+    "                    \"scoring_results.csv\" if dataset == \"casp15\" else \"bust_results.csv\",\n",
+    "                )\n",
+    "            )\n",
+    "\n",
     "            # AlphaFold 3 (Single-Seq) results\n",
     "            globals()[\n",
     "                f\"alphafold3_ss_{dataset}{config}_bust_results_csv_filepath_{repeat_index}\"\n",
@@ -298,6 +335,8 @@
     "    \"rfaa\": \"RFAA\",\n",
     "    \"chai-lab_ss\": \"Chai-1-Single-Seq\",\n",
     "    \"chai-lab\": \"Chai-1\",\n",
+    "    \"boltz_ss\": \"Boltz-1-Single-Seq\",\n",
+    "    \"boltz\": \"Boltz-1\",\n",
     "    \"alphafold3_ss\": \"AF3-Single-Seq\",\n",
     "    \"alphafold3\": \"AF3\",\n",
     "}\n",
@@ -310,6 +349,8 @@
     "    \"rfaa\": \"DL-based blind\",\n",
     "    \"chai-lab_ss\": \"DL-based blind\",\n",
     "    \"chai-lab\": \"DL-based blind\",\n",
+    "    \"boltz_ss\": \"DL-based blind\",\n",
+    "    \"boltz\": \"DL-based blind\",\n",
     "    \"alphafold3_ss\": \"DL-based blind\",\n",
     "    \"alphafold3\": \"DL-based blind\",\n",
     "}\n",
diff --git a/notebooks/failure_modes_analysis_plotting_plinder.ipynb b/notebooks/failure_modes_analysis_plotting_plinder.ipynb
new file mode 100644
index 00000000..1f47f7aa
--- /dev/null
+++ b/notebooks/failure_modes_analysis_plotting_plinder.ipynb
@@ -0,0 +1,1375 @@
+{
+ "cells": [
+  {
+   "cell_type": "markdown",
+   "metadata": {},
+   "source": [
+    "## Failure Modes Analysis Plotting"
+   ]
+  },
+  {
+   "cell_type": "markdown",
+   "metadata": {},
+   "source": [
+    "#### Import packages"
+   ]
+  },
+  {
+   "cell_type": "code",
+   "execution_count": null,
+   "metadata": {},
+   "outputs": [],
+   "source": [
+    "import copy\n",
+    "import glob\n",
+    "import os\n",
+    "from collections import Counter, defaultdict\n",
+    "\n",
+    "import matplotlib.pyplot as plt\n",
+    "import numpy as np\n",
+    "import pandas as pd\n",
+    "import pypdb\n",
+    "import seaborn as sns\n",
+    "from scipy.stats import pearsonr, spearmanr\n",
+    "\n",
+    "from posebench.analysis.inference_analysis import BUST_TEST_COLUMNS"
+   ]
+  },
+  {
+   "cell_type": "markdown",
+   "metadata": {},
+   "source": [
+    "#### Configure packages"
+   ]
+  },
+  {
+   "cell_type": "code",
+   "execution_count": null,
+   "metadata": {},
+   "outputs": [],
+   "source": [
+    "pd.options.mode.copy_on_write = False"
+   ]
+  },
+  {
+   "cell_type": "markdown",
+   "metadata": {},
+   "source": [
+    "#### Define constants"
+   ]
+  },
+  {
+   "cell_type": "code",
+   "execution_count": null,
+   "metadata": {},
+   "outputs": [],
+   "source": [
+    "# General variables\n",
+    "baseline_methods = [\n",
+    "    \"vina_p2rank\",\n",
+    "    \"diffdock\",\n",
+    "    \"dynamicbind\",\n",
+    "    \"neuralplexer\",\n",
+    "    \"rfaa\",\n",
+    "    \"chai-lab_ss\",\n",
+    "    \"chai-lab\",\n",
+    "    \"boltz_ss\",\n",
+    "    \"boltz\",\n",
+    "    \"alphafold3_ss\",\n",
+    "    \"alphafold3\",\n",
+    "]\n",
+    "max_num_repeats_per_method = 3\n",
+    "method_max_training_cutoff_date = \"2021-09-30\"\n",
+    "\n",
+    "datasets = [\"astex_diverse\", \"posebusters_benchmark\", \"dockgen\", \"casp15\"]\n",
+    "\n",
+    "# PoseBusters Benchmark deposition dates\n",
+    "pb_deposition_dates_filepath = \"posebusters_benchmark_complex_pdb_deposition_dates.csv\"\n",
+    "assert os.path.exists(\n",
+    "    pb_deposition_dates_filepath\n",
+    "), \"Please prepare the PoseBusters Benchmark complex PDB deposition dates CSV file via later steps in `failure_modes_analysis_plotting_plinder.ipynb` before proceeding.\"\n",
+    "\n",
+    "pb_pdb_id_deposition_date_mapping_df = pd.read_csv(pb_deposition_dates_filepath)\n",
+    "pb_pdb_id_deposition_date_mapping_df[\"Deposition Date\"] = pd.to_datetime(\n",
+    "    pb_pdb_id_deposition_date_mapping_df[\"Deposition Date\"]\n",
+    ")\n",
+    "pb_pdb_id_deposition_date_mapping_df = pb_pdb_id_deposition_date_mapping_df[\n",
+    "    pb_pdb_id_deposition_date_mapping_df[\"Deposition Date\"] > method_max_training_cutoff_date\n",
+    "]\n",
+    "pb_pdb_id_deposition_date_mapping = dict(\n",
+    "    zip(\n",
+    "        pb_pdb_id_deposition_date_mapping_df[\"PDB ID\"],\n",
+    "        pb_pdb_id_deposition_date_mapping_df[\"Deposition Date\"].astype(str),\n",
+    "    )\n",
+    ")\n",
+    "\n",
+    "# Filepaths for each baseline method\n",
+    "globals()[\"vina_output_dir\"] = os.path.join(\"..\", \"forks\", \"Vina\", \"inference\")\n",
+    "globals()[\"diffdock_output_dir\"] = os.path.join(\"..\", \"forks\", \"DiffDock\", \"inference\")\n",
+    "globals()[\"dynamicbind_output_dir\"] = os.path.join(\n",
+    "    \"..\", \"forks\", \"DynamicBind\", \"inference\", \"outputs\", \"results\"\n",
+    ")\n",
+    "globals()[\"neuralplexer_output_dir\"] = os.path.join(\"..\", \"forks\", \"NeuralPLexer\", \"inference\")\n",
+    "globals()[\"rfaa_output_dir\"] = os.path.join(\"..\", \"forks\", \"RoseTTAFold-All-Atom\", \"inference\")\n",
+    "globals()[\"chai-lab_output_dir\"] = os.path.join(\"..\", \"forks\", \"chai-lab\", \"inference\")\n",
+    "globals()[\"boltz_output_dir\"] = os.path.join(\"..\", \"forks\", \"boltz\", \"inference\")\n",
+    "globals()[\"alphafold3_output_dir\"] = os.path.join(\"..\", \"forks\", \"alphafold3\", \"inference\")\n",
+    "globals()[\"casp15_output_dir\"] = os.path.join(\"..\", \"data\", \"test_cases\", \"casp15\")\n",
+    "for config in [\"\", \"_relaxed\"]:\n",
+    "    for dataset in datasets:\n",
+    "        for repeat_index in range(1, max_num_repeats_per_method + 1):\n",
+    "            # P2Rank-Vina results\n",
+    "            globals()[\n",
+    "                f\"vina_p2rank_{dataset}{config}_bust_results_csv_filepath_{repeat_index}\"\n",
+    "            ] = os.path.join(\n",
+    "                (\n",
+    "                    globals()[\"casp15_output_dir\"] + config\n",
+    "                    if dataset == \"casp15\"\n",
+    "                    else globals()[\"vina_output_dir\"]\n",
+    "                ),\n",
+    "                (\n",
+    "                    f\"top_vina_p2rank_ensemble_predictions_{repeat_index}\"\n",
+    "                    if dataset == \"casp15\"\n",
+    "                    else f\"vina_p2rank_{dataset}_outputs_{repeat_index}{config}\"\n",
+    "                ),\n",
+    "                \"scoring_results.csv\" if dataset == \"casp15\" else \"bust_results.csv\",\n",
+    "            )\n",
+    "\n",
+    "            # DiffDock results\n",
+    "            globals()[f\"diffdock_{dataset}{config}_bust_results_csv_filepath_{repeat_index}\"] = (\n",
+    "                os.path.join(\n",
+    "                    (\n",
+    "                        globals()[\"casp15_output_dir\"] + config\n",
+    "                        if dataset == \"casp15\"\n",
+    "                        else globals()[\"diffdock_output_dir\"]\n",
+    "                    ),\n",
+    "                    (\n",
+    "                        f\"top_diffdock_ensemble_predictions_{repeat_index}\"\n",
+    "                        if dataset == \"casp15\"\n",
+    "                        else f\"diffdock_{dataset}_output_{repeat_index}{config}\"\n",
+    "                    ),\n",
+    "                    \"scoring_results.csv\" if dataset == \"casp15\" else \"bust_results.csv\",\n",
+    "                )\n",
+    "            )\n",
+    "\n",
+    "            # DynamicBind results\n",
+    "            globals()[\n",
+    "                f\"dynamicbind_{dataset}{config}_bust_results_csv_filepath_{repeat_index}\"\n",
+    "            ] = os.path.join(\n",
+    "                (\n",
+    "                    globals()[\"casp15_output_dir\"] + config\n",
+    "                    if dataset == \"casp15\"\n",
+    "                    else globals()[\"dynamicbind_output_dir\"]\n",
+    "                ),\n",
+    "                (\n",
+    "                    f\"top_dynamicbind_ensemble_predictions_{repeat_index}\"\n",
+    "                    if dataset == \"casp15\"\n",
+    "                    else f\"{dataset}_{repeat_index}{config}\"\n",
+    "                ),\n",
+    "                \"scoring_results.csv\" if dataset == \"casp15\" else \"bust_results.csv\",\n",
+    "            )\n",
+    "\n",
+    "            # NeuralPLexer results\n",
+    "            globals()[\n",
+    "                f\"neuralplexer_{dataset}{config}_bust_results_csv_filepath_{repeat_index}\"\n",
+    "            ] = os.path.join(\n",
+    "                (\n",
+    "                    globals()[\"casp15_output_dir\"] + config\n",
+    "                    if dataset == \"casp15\"\n",
+    "                    else globals()[\"neuralplexer_output_dir\"]\n",
+    "                ),\n",
+    "                (\n",
+    "                    f\"top_neuralplexer_ensemble_predictions_{repeat_index}\"\n",
+    "                    if dataset == \"casp15\"\n",
+    "                    else f\"neuralplexer_{dataset}_outputs_{repeat_index}{config}\"\n",
+    "                ),\n",
+    "                \"scoring_results.csv\" if dataset == \"casp15\" else \"bust_results.csv\",\n",
+    "            )\n",
+    "\n",
+    "            # RoseTTAFold-All-Atom results\n",
+    "            globals()[f\"rfaa_{dataset}{config}_bust_results_csv_filepath_{repeat_index}\"] = (\n",
+    "                os.path.join(\n",
+    "                    (\n",
+    "                        globals()[\"casp15_output_dir\"] + config\n",
+    "                        if dataset == \"casp15\"\n",
+    "                        else globals()[\"rfaa_output_dir\"]\n",
+    "                    ),\n",
+    "                    (\n",
+    "                        f\"top_rfaa_ensemble_predictions_{repeat_index}\"\n",
+    "                        if dataset == \"casp15\"\n",
+    "                        else f\"rfaa_{dataset}_outputs_{repeat_index}{config}\"\n",
+    "                    ),\n",
+    "                    \"scoring_results.csv\" if dataset == \"casp15\" else \"bust_results.csv\",\n",
+    "                )\n",
+    "            )\n",
+    "\n",
+    "            # Chai-1 (Single-Seq) results\n",
+    "            globals()[\n",
+    "                f\"chai-lab_ss_{dataset}{config}_bust_results_csv_filepath_{repeat_index}\"\n",
+    "            ] = os.path.join(\n",
+    "                (\n",
+    "                    globals()[\"casp15_output_dir\"] + config\n",
+    "                    if dataset == \"casp15\"\n",
+    "                    else globals()[\"chai-lab_output_dir\"]\n",
+    "                ),\n",
+    "                (\n",
+    "                    f\"top_chai-lab_ss_ensemble_predictions_{repeat_index}\"\n",
+    "                    if dataset == \"casp15\"\n",
+    "                    else f\"chai-lab_ss_{dataset}_outputs_{repeat_index}{config}\"\n",
+    "                ),\n",
+    "                \"scoring_results.csv\" if dataset == \"casp15\" else \"bust_results.csv\",\n",
+    "            )\n",
+    "\n",
+    "            # Chai-1 results\n",
+    "            globals()[f\"chai-lab_{dataset}{config}_bust_results_csv_filepath_{repeat_index}\"] = (\n",
+    "                os.path.join(\n",
+    "                    (\n",
+    "                        globals()[\"casp15_output_dir\"] + config\n",
+    "                        if dataset == \"casp15\"\n",
+    "                        else globals()[\"chai-lab_output_dir\"]\n",
+    "                    ),\n",
+    "                    (\n",
+    "                        f\"top_chai-lab_ensemble_predictions_{repeat_index}\"\n",
+    "                        if dataset == \"casp15\"\n",
+    "                        else f\"chai-lab_{dataset}_outputs_{repeat_index}{config}\"\n",
+    "                    ),\n",
+    "                    \"scoring_results.csv\" if dataset == \"casp15\" else \"bust_results.csv\",\n",
+    "                )\n",
+    "            )\n",
+    "\n",
+    "            # Boltz (Single-Seq) results\n",
+    "            globals()[f\"boltz_ss_{dataset}{config}_bust_results_csv_filepath_{repeat_index}\"] = (\n",
+    "                os.path.join(\n",
+    "                    (\n",
+    "                        globals()[\"casp15_output_dir\"] + config\n",
+    "                        if dataset == \"casp15\"\n",
+    "                        else globals()[\"boltz_output_dir\"]\n",
+    "                    ),\n",
+    "                    (\n",
+    "                        f\"top_boltz_ss_ensemble_predictions_{repeat_index}\"\n",
+    "                        if dataset == \"casp15\"\n",
+    "                        else f\"boltz_ss_{dataset}_outputs_{repeat_index}{config}\"\n",
+    "                    ),\n",
+    "                    \"scoring_results.csv\" if dataset == \"casp15\" else \"bust_results.csv\",\n",
+    "                )\n",
+    "            )\n",
+    "\n",
+    "            # Boltz results\n",
+    "            globals()[f\"boltz_{dataset}{config}_bust_results_csv_filepath_{repeat_index}\"] = (\n",
+    "                os.path.join(\n",
+    "                    (\n",
+    "                        globals()[\"casp15_output_dir\"] + config\n",
+    "                        if dataset == \"casp15\"\n",
+    "                        else globals()[\"boltz_output_dir\"]\n",
+    "                    ),\n",
+    "                    (\n",
+    "                        f\"top_boltz_ensemble_predictions_{repeat_index}\"\n",
+    "                        if dataset == \"casp15\"\n",
+    "                        else f\"boltz_{dataset}_outputs_{repeat_index}{config}\"\n",
+    "                    ),\n",
+    "                    \"scoring_results.csv\" if dataset == \"casp15\" else \"bust_results.csv\",\n",
+    "                )\n",
+    "            )\n",
+    "\n",
+    "            # AlphaFold 3 (Single-Seq) results\n",
+    "            globals()[\n",
+    "                f\"alphafold3_ss_{dataset}{config}_bust_results_csv_filepath_{repeat_index}\"\n",
+    "            ] = os.path.join(\n",
+    "                (\n",
+    "                    globals()[\"casp15_output_dir\"] + config\n",
+    "                    if dataset == \"casp15\"\n",
+    "                    else globals()[\"alphafold3_output_dir\"]\n",
+    "                ),\n",
+    "                (\n",
+    "                    f\"top_alphafold3_ss_ensemble_predictions_{repeat_index}\"\n",
+    "                    if dataset == \"casp15\"\n",
+    "                    else f\"alphafold3_ss_{dataset}_outputs_{repeat_index}{config}\"\n",
+    "                ),\n",
+    "                \"scoring_results.csv\" if dataset == \"casp15\" else \"bust_results.csv\",\n",
+    "            )\n",
+    "\n",
+    "            # AlphaFold 3 results\n",
+    "            globals()[f\"alphafold3_{dataset}{config}_bust_results_csv_filepath_{repeat_index}\"] = (\n",
+    "                os.path.join(\n",
+    "                    (\n",
+    "                        globals()[\"casp15_output_dir\"] + config\n",
+    "                        if dataset == \"casp15\"\n",
+    "                        else globals()[\"alphafold3_output_dir\"]\n",
+    "                    ),\n",
+    "                    (\n",
+    "                        f\"top_alphafold3_ensemble_predictions_{repeat_index}\"\n",
+    "                        if dataset == \"casp15\"\n",
+    "                        else f\"alphafold3_{dataset}_outputs_{repeat_index}{config}\"\n",
+    "                    ),\n",
+    "                    \"scoring_results.csv\" if dataset == \"casp15\" else \"bust_results.csv\",\n",
+    "                )\n",
+    "            )\n",
+    "\n",
+    "# Mappings\n",
+    "method_mapping = {\n",
+    "    \"vina_p2rank\": \"P2Rank-Vina\",\n",
+    "    \"diffdock\": \"DiffDock-L\",\n",
+    "    \"dynamicbind\": \"DynamicBind\",\n",
+    "    \"neuralplexer\": \"NeuralPLexer\",\n",
+    "    \"rfaa\": \"RFAA\",\n",
+    "    \"chai-lab_ss\": \"Chai-1-Single-Seq\",\n",
+    "    \"chai-lab\": \"Chai-1\",\n",
+    "    \"boltz_ss\": \"Boltz-1-Single-Seq\",\n",
+    "    \"boltz\": \"Boltz-1\",\n",
+    "    \"alphafold3_ss\": \"AF3-Single-Seq\",\n",
+    "    \"alphafold3\": \"AF3\",\n",
+    "}\n",
+    "\n",
+    "method_category_mapping = {\n",
+    "    \"vina_p2rank\": \"Conventional blind\",\n",
+    "    \"diffdock\": \"DL-based blind\",\n",
+    "    \"dynamicbind\": \"DL-based blind\",\n",
+    "    \"neuralplexer\": \"DL-based blind\",\n",
+    "    \"rfaa\": \"DL-based blind\",\n",
+    "    \"chai-lab_ss\": \"DL-based blind\",\n",
+    "    \"chai-lab\": \"DL-based blind\",\n",
+    "    \"boltz_ss\": \"DL-based blind\",\n",
+    "    \"boltz\": \"DL-based blind\",\n",
+    "    \"alphafold3_ss\": \"DL-based blind\",\n",
+    "    \"alphafold3\": \"DL-based blind\",\n",
+    "}\n",
+    "\n",
+    "dataset_mapping = {\n",
+    "    \"astex_diverse\": \"Astex Diverse set\",\n",
+    "    \"posebusters_benchmark\": \"Posebusters Benchmark set\",\n",
+    "    \"dockgen\": \"DockGen set\",\n",
+    "    \"casp15\": \"CASP15 set\",\n",
+    "}\n",
+    "\n",
+    "casp15_target_pdb_id_mapping = {\n",
+    "    # NOTE: `?` indicates that the target's crystal structure is not publicly available\n",
+    "    \"H1135\": \"7z8y\",\n",
+    "    \"H1171v1\": \"7pbl\",\n",
+    "    \"H1171v2\": \"7pbl\",\n",
+    "    \"H1172v1\": \"7pbp\",\n",
+    "    \"H1172v2\": \"7pbp\",\n",
+    "    \"H1172v3\": \"7pbp\",\n",
+    "    \"H1172v4\": \"7pbp\",\n",
+    "    \"T1124\": \"7ux8\",\n",
+    "    \"T1127v2\": \"?\",\n",
+    "    \"T1146\": \"?\",\n",
+    "    \"T1152\": \"7r1l\",\n",
+    "    \"T1158v1\": \"8sx8\",\n",
+    "    \"T1158v2\": \"8sxb\",\n",
+    "    \"T1158v3\": \"8sx7\",\n",
+    "    \"T1158v4\": \"8swn\",\n",
+    "    \"T1170\": \"7pbr\",\n",
+    "    \"T1181\": \"?\",\n",
+    "    \"T1186\": \"?\",\n",
+    "    \"T1187\": \"8ad2\",\n",
+    "    \"T1188\": \"8c6z\",\n",
+    "}"
+   ]
+  },
+  {
+   "cell_type": "markdown",
+   "metadata": {},
+   "source": [
+    "#### Load test results for each baseline method"
+   ]
+  },
+  {
+   "cell_type": "code",
+   "execution_count": null,
+   "metadata": {},
+   "outputs": [],
+   "source": [
+    "# load and report test results for each baseline method\n",
+    "for config in [\"\"]:\n",
+    "    for dataset in datasets:\n",
+    "        for method in baseline_methods:\n",
+    "            for repeat_index in range(1, max_num_repeats_per_method + 1):\n",
+    "                method_title = method_mapping[method]\n",
+    "\n",
+    "                if not os.path.exists(\n",
+    "                    globals()[\n",
+    "                        f\"{method}_{dataset}{config}_bust_results_csv_filepath_{repeat_index}\"\n",
+    "                    ]\n",
+    "                ):\n",
+    "                    continue\n",
+    "\n",
+    "                globals()[f\"{method}_{dataset}{config}_bust_results_table_{repeat_index}\"] = (\n",
+    "                    pd.read_csv(\n",
+    "                        globals()[\n",
+    "                            f\"{method}_{dataset}{config}_bust_results_csv_filepath_{repeat_index}\"\n",
+    "                        ]\n",
+    "                    )\n",
+    "                )\n",
+    "\n",
+    "                if dataset == \"casp15\":\n",
+    "                    # count the number of ligands in each target complex, and assign these corresponding numbers to the ligands (rows) of each complex\n",
+    "                    globals()[f\"{method}_{dataset}{config}_bust_results_table_{repeat_index}\"].loc[\n",
+    "                        :, \"num_target_ligands\"\n",
+    "                    ] = (\n",
+    "                        globals()[f\"{method}_{dataset}{config}_bust_results_table_{repeat_index}\"]\n",
+    "                        .groupby([\"target\", \"mdl\"])[\"pose\"]\n",
+    "                        .transform(\"count\")\n",
+    "                    )\n",
+    "\n",
+    "                    # filter out non-relevant ligand predictions, and for all methods select only their first model for each ligand\n",
+    "                    globals()[\n",
+    "                        f\"{method}_{dataset}{config}_bust_results_table_{repeat_index}\"\n",
+    "                    ] = globals()[f\"{method}_{dataset}{config}_bust_results_table_{repeat_index}\"][\n",
+    "                        np.where(\n",
+    "                            (\n",
+    "                                globals()[\n",
+    "                                    f\"{method}_{dataset}{config}_bust_results_table_{repeat_index}\"\n",
+    "                                ].relevant\n",
+    "                            ),\n",
+    "                            True,\n",
+    "                            False,\n",
+    "                        )\n",
+    "                        & (\n",
+    "                            globals()[\n",
+    "                                f\"{method}_{dataset}{config}_bust_results_table_{repeat_index}\"\n",
+    "                            ].mdl\n",
+    "                            == 1\n",
+    "                        )\n",
+    "                    ]\n",
+    "\n",
+    "                    # finalize bust (i.e., scoring) results for CASP15, using dummy values for `pb_valid` and `crmsd_≤_1å`\n",
+    "                    globals()[f\"{method}_{dataset}{config}_bust_results_table_{repeat_index}\"].loc[\n",
+    "                        :, \"rmsd_≤_2å\"\n",
+    "                    ] = (\n",
+    "                        globals()[\n",
+    "                            f\"{method}_{dataset}{config}_bust_results_table_{repeat_index}\"\n",
+    "                        ].loc[:, \"rmsd\"]\n",
+    "                        <= 2\n",
+    "                    )\n",
+    "                    globals()[f\"{method}_{dataset}{config}_bust_results_table_{repeat_index}\"].loc[\n",
+    "                        :, \"pdb_valid\"\n",
+    "                    ] = True\n",
+    "                    globals()[f\"{method}_{dataset}{config}_bust_results_table_{repeat_index}\"].loc[\n",
+    "                        :, \"crmsd_≤_1å\"\n",
+    "                    ] = True\n",
+    "\n",
+    "                else:\n",
+    "                    globals()[\n",
+    "                        f\"{method}_{dataset}{config}_bust_results_table_{repeat_index}\"\n",
+    "                    ] = globals()[f\"{method}_{dataset}{config}_bust_results_table_{repeat_index}\"][\n",
+    "                        BUST_TEST_COLUMNS + [\"rmsd\", \"centroid_distance\", \"mol_id\"]\n",
+    "                    ]\n",
+    "                    globals()[f\"{method}_{dataset}{config}_bust_results_table_{repeat_index}\"].loc[\n",
+    "                        :, \"pb_valid\"\n",
+    "                    ] = (\n",
+    "                        globals()[f\"{method}_{dataset}{config}_bust_results_table_{repeat_index}\"]\n",
+    "                        .iloc[:, 1:-3]\n",
+    "                        .all(axis=1)\n",
+    "                    )\n",
+    "                    globals()[f\"{method}_{dataset}{config}_bust_results_table_{repeat_index}\"].loc[\n",
+    "                        :, \"crmsd_≤_1å\"\n",
+    "                    ] = (\n",
+    "                        globals()[f\"{method}_{dataset}{config}_bust_results_table_{repeat_index}\"][\n",
+    "                            \"centroid_distance\"\n",
+    "                        ]\n",
+    "                        < 1\n",
+    "                    )\n",
+    "                    globals()[f\"{method}_{dataset}{config}_bust_results_table_{repeat_index}\"].loc[\n",
+    "                        :, \"pdb_id\"\n",
+    "                    ] = globals()[f\"{method}_{dataset}{config}_bust_results_table_{repeat_index}\"][\n",
+    "                        \"mol_id\"\n",
+    "                    ]\n",
+    "\n",
+    "                globals()[f\"{method}_{dataset}{config}_bust_results_table_{repeat_index}\"].loc[\n",
+    "                    :, \"method\"\n",
+    "                ] = method\n",
+    "                globals()[f\"{method}_{dataset}{config}_bust_results_table_{repeat_index}\"].loc[\n",
+    "                    :, \"post-processing\"\n",
+    "                ] = (\"energy minimization\" if config == \"_relaxed\" else \"none\")\n",
+    "                globals()[f\"{method}_{dataset}{config}_bust_results_table_{repeat_index}\"].loc[\n",
+    "                    :, \"dataset\"\n",
+    "                ] = dataset\n",
+    "                globals()[f\"{method}_{dataset}{config}_bust_results_table_{repeat_index}\"].loc[\n",
+    "                    :, \"docked_ligand_successfully_loaded\"\n",
+    "                ] = (\n",
+    "                    True\n",
+    "                    if dataset == \"casp15\"\n",
+    "                    else globals()[\n",
+    "                        f\"{method}_{dataset}{config}_bust_results_table_{repeat_index}\"\n",
+    "                    ][[\"mol_pred_loaded\", \"mol_true_loaded\", \"mol_cond_loaded\"]].all(axis=1)\n",
+    "                )\n",
+    "\n",
+    "                if dataset == \"posebusters_benchmark\":\n",
+    "                    # keep only the results for complexes deposited in the PDB after the maximum cutoff date for any method's training data\n",
+    "                    globals()[f\"{method}_{dataset}{config}_bust_results_table_{repeat_index}\"][\n",
+    "                        \"pdb_id\"\n",
+    "                    ] = globals()[f\"{method}_{dataset}{config}_bust_results_table_{repeat_index}\"][\n",
+    "                        \"mol_id\"\n",
+    "                    ].map(\n",
+    "                        lambda x: x.lower().split(\"_\")[0]\n",
+    "                    )\n",
+    "                    globals()[\n",
+    "                        f\"{method}_{dataset}{config}_bust_results_table_{repeat_index}\"\n",
+    "                    ] = globals()[f\"{method}_{dataset}{config}_bust_results_table_{repeat_index}\"][\n",
+    "                        globals()[f\"{method}_{dataset}{config}_bust_results_table_{repeat_index}\"][\n",
+    "                            \"pdb_id\"\n",
+    "                        ].isin(pb_pdb_id_deposition_date_mapping.keys())\n",
+    "                    ]"
+   ]
+  },
+  {
+   "cell_type": "markdown",
+   "metadata": {},
+   "source": [
+    "#### Define helper functions"
+   ]
+  },
+  {
+   "cell_type": "code",
+   "execution_count": null,
+   "metadata": {},
+   "outputs": [],
+   "source": [
+    "def assign_method_index(method: str) -> str:\n",
+    "    \"\"\"\n",
+    "    Assign method index for plotting.\n",
+    "\n",
+    "    :param method: Method name.\n",
+    "    :return: Method index.\n",
+    "    \"\"\"\n",
+    "    return list(method_mapping.keys()).index(method)\n",
+    "\n",
+    "\n",
+    "def categorize_method(method: str) -> str:\n",
+    "    \"\"\"\n",
+    "    Categorize method for plotting.\n",
+    "\n",
+    "    :param method: Method name.\n",
+    "    :return: Method category.\n",
+    "    \"\"\"\n",
+    "    return method_category_mapping.get(method, \"Misc\")\n",
+    "\n",
+    "\n",
+    "def subset_counter(\n",
+    "    subset_counter: Counter, superset_counter: Counter, normalize_subset: bool = False\n",
+    ") -> Counter:\n",
+    "    \"\"\"\n",
+    "    Subset a superset counter by a subset counter.\n",
+    "\n",
+    "    :param subset_counter: Subset counter.\n",
+    "    :param superset_counter: Superset counter.\n",
+    "    :param normalize_subset: Normalize subset counter by superset counter.\n",
+    "    :return: Subsetted counter.\n",
+    "    \"\"\"\n",
+    "    subsetted_counter = Counter()\n",
+    "    for key in subset_counter:\n",
+    "        if key in superset_counter and superset_counter[key] != 0:\n",
+    "            subsetted_counter[key] = (\n",
+    "                subset_counter[key] / superset_counter[key]\n",
+    "                if normalize_subset\n",
+    "                else superset_counter[key]\n",
+    "            )\n",
+    "        else:\n",
+    "            subsetted_counter[key] = 0  # or handle as needed\n",
+    "    return subsetted_counter"
+   ]
+  },
+  {
+   "cell_type": "markdown",
+   "metadata": {},
+   "source": [
+    "#### Standardize metrics"
+   ]
+  },
+  {
+   "cell_type": "code",
+   "execution_count": null,
+   "metadata": {},
+   "outputs": [],
+   "source": [
+    "# load and organize the results CSVs\n",
+    "for repeat_index in range(1, max_num_repeats_per_method + 1):\n",
+    "    globals()[f\"results_table_{repeat_index}\"] = pd.concat(\n",
+    "        [\n",
+    "            globals()[f\"{method}_{dataset}{config}_bust_results_table_{repeat_index}\"]\n",
+    "            for dataset in datasets\n",
+    "            for method in baseline_methods\n",
+    "            for config in [\"\"]\n",
+    "            if f\"{method}_{dataset}{config}_bust_results_table_{repeat_index}\" in globals()\n",
+    "        ]\n",
+    "    )\n",
+    "    globals()[f\"results_table_{repeat_index}\"].loc[:, \"method_category\"] = globals()[\n",
+    "        f\"results_table_{repeat_index}\"\n",
+    "    ][\"method\"].apply(categorize_method)\n",
+    "    globals()[f\"results_table_{repeat_index}\"].loc[:, \"method_assignment_index\"] = globals()[\n",
+    "        f\"results_table_{repeat_index}\"\n",
+    "    ][\"method\"].apply(assign_method_index)\n",
+    "    globals()[f\"results_table_{repeat_index}\"].loc[:, \"crmsd_within_threshold\"] = (\n",
+    "        globals()[f\"results_table_{repeat_index}\"].loc[:, \"crmsd_≤_1å\"].fillna(False)\n",
+    "    )\n",
+    "    globals()[f\"results_table_{repeat_index}\"].loc[:, \"rmsd_within_threshold\"] = (\n",
+    "        globals()[f\"results_table_{repeat_index}\"].loc[:, \"rmsd_≤_2å\"].fillna(False)\n",
+    "    )\n",
+    "    globals()[f\"results_table_{repeat_index}\"].loc[:, \"rmsd_within_threshold_and_pb_valid\"] = (\n",
+    "        globals()[f\"results_table_{repeat_index}\"].loc[:, \"rmsd_within_threshold\"]\n",
+    "    ) & (globals()[f\"results_table_{repeat_index}\"].loc[:, \"pb_valid\"].fillna(False))\n",
+    "    globals()[f\"results_table_{repeat_index}\"].loc[:, \"RMSD ≤ 2 Å & PB-Valid\"] = (\n",
+    "        globals()[f\"results_table_{repeat_index}\"]\n",
+    "        .loc[:, \"rmsd_within_threshold_and_pb_valid\"]\n",
+    "        .astype(int)\n",
+    "    )\n",
+    "    globals()[f\"results_table_{repeat_index}\"].loc[:, \"cRMSD ≤ 1 Å\"] = (\n",
+    "        globals()[f\"results_table_{repeat_index}\"]\n",
+    "        .loc[:, \"crmsd_within_threshold\"]\n",
+    "        .fillna(False)\n",
+    "        .astype(int)\n",
+    "    )\n",
+    "    globals()[f\"results_table_{repeat_index}\"].loc[:, \"RMSD ≤ 2 Å\"] = (\n",
+    "        globals()[f\"results_table_{repeat_index}\"]\n",
+    "        .loc[:, \"rmsd_within_threshold\"]\n",
+    "        .fillna(False)\n",
+    "        .astype(int)\n",
+    "    )\n",
+    "    globals()[f\"results_table_{repeat_index}\"].loc[:, \"dataset\"] = (\n",
+    "        globals()[f\"results_table_{repeat_index}\"].loc[:, \"dataset\"].map(dataset_mapping)\n",
+    "    )\n",
+    "    globals()[f\"results_table_{repeat_index}\"].loc[:, \"method\"] = (\n",
+    "        globals()[f\"results_table_{repeat_index}\"].loc[:, \"method\"].map(method_mapping)\n",
+    "    )"
+   ]
+  },
+  {
+   "cell_type": "markdown",
+   "metadata": {},
+   "source": [
+    "#### Collect metadata across all datasets"
+   ]
+  },
+  {
+   "cell_type": "code",
+   "execution_count": null,
+   "metadata": {},
+   "outputs": [],
+   "source": [
+    "# find PDB IDs of complexes across all datasets\n",
+    "for dataset in datasets:\n",
+    "    for repeat_index in range(1, max_num_repeats_per_method + 1):\n",
+    "        dataset_results_table = globals()[f\"results_table_{repeat_index}\"].loc[\n",
+    "            globals()[f\"results_table_{repeat_index}\"].loc[:, \"dataset\"]\n",
+    "            == dataset_mapping[dataset]\n",
+    "        ]\n",
+    "\n",
+    "        if dataset == \"casp15\":\n",
+    "            dataset_results_table.loc[:, \"pdb_id\"] = dataset_results_table.loc[:, \"target\"].map(\n",
+    "                casp15_target_pdb_id_mapping\n",
+    "            )\n",
+    "\n",
+    "        globals()[f\"{dataset}_complexes_{repeat_index}\"] = set(\n",
+    "            dataset_results_table.loc[:, \"pdb_id\"].unique()\n",
+    "        )"
+   ]
+  },
+  {
+   "cell_type": "markdown",
+   "metadata": {},
+   "source": [
+    "#### Plot distribution of complex types across all datasets"
+   ]
+  },
+  {
+   "cell_type": "code",
+   "execution_count": null,
+   "metadata": {},
+   "outputs": [],
+   "source": [
+    "# plot functional keyword statistics of the complexes across all datasets\n",
+    "pdb_info_cache = dict()\n",
+    "\n",
+    "for repeat_index in [1]:  # NOTE: we only consider the first repeat\n",
+    "    all_complexes_df = []\n",
+    "    for dataset in datasets:\n",
+    "        complexes_df = pd.DataFrame(\n",
+    "            globals()[f\"{dataset}_complexes_{repeat_index}\"], columns=[\"pdb_id\"]\n",
+    "        )\n",
+    "        complexes_df[\"dataset\"] = dataset_mapping[dataset]\n",
+    "        all_complexes_df.append(complexes_df)\n",
+    "    all_complexes_df = pd.concat(all_complexes_df, ignore_index=True)\n",
+    "\n",
+    "    if all_complexes_df.empty:\n",
+    "        print(\"No complexes for any dataset.\")\n",
+    "        continue\n",
+    "\n",
+    "    complex_function_annotations = []\n",
+    "    for pdb_id in set(all_complexes_df[\"pdb_id\"]):\n",
+    "        pdb_id = pdb_id.lower().split(\"_\")[0]\n",
+    "        if pdb_id == \"?\":\n",
+    "            continue\n",
+    "        if pdb_id in pdb_info_cache:\n",
+    "            pdb_id_info = pdb_info_cache[pdb_id]\n",
+    "        else:\n",
+    "            pdb_id_info = pypdb.get_all_info(pdb_id)\n",
+    "            pdb_info_cache[pdb_id] = pdb_id_info\n",
+    "        if not pdb_id_info:\n",
+    "            continue\n",
+    "        complex_function_annotations.append(\n",
+    "            # NOTE: these represent functional keywords\n",
+    "            pdb_id_info[\"struct_keywords\"][\"pdbx_keywords\"]\n",
+    "            .lower()\n",
+    "            .split(\", \")[0]\n",
+    "        )\n",
+    "\n",
+    "    complex_function_annotation_counts = Counter(complex_function_annotations)\n",
+    "    df = pd.DataFrame(\n",
+    "        complex_function_annotation_counts.items(),\n",
+    "        columns=[\"Keyword\", \"Frequency\"],\n",
+    "    )\n",
+    "    df[\"Frequency\"] = df[\"Frequency\"].astype(int)\n",
+    "    df = df.sort_values(by=\"Frequency\", ascending=False)\n",
+    "\n",
+    "    plt.figure(figsize=(20, 10))\n",
+    "    sns.barplot(data=df, x=\"Frequency\", y=\"Keyword\", palette=\"viridis\")\n",
+    "\n",
+    "    max_freq = df[\"Frequency\"].max()\n",
+    "    plt.xticks(ticks=range(0, max_freq + 1), labels=range(0, max_freq + 1), rotation=60)\n",
+    "\n",
+    "    plt.xlabel(\"Frequency\")\n",
+    "    plt.ylabel(\"Complex Annotation\")\n",
+    "\n",
+    "    plt.tight_layout()\n",
+    "    plt.savefig(f\"complexes_functional_keywords_{repeat_index}.png\", bbox_inches=\"tight\")\n",
+    "    plt.show()\n",
+    "\n",
+    "    plt.close(\"all\")\n",
+    "\n",
+    "    print(f\"{len(complex_function_annotations)} complex annotations across all datasets.\")"
+   ]
+  },
+  {
+   "cell_type": "markdown",
+   "metadata": {},
+   "source": [
+    "#### Plot distribution of the PoseBusters Benchmark dataset's complex deposition dates"
+   ]
+  },
+  {
+   "cell_type": "code",
+   "execution_count": null,
+   "metadata": {},
+   "outputs": [],
+   "source": [
+    "# # report the PDB deposition date of each PoseBusters Benchmark complex\n",
+    "# posebusters_complex_deposition_dates = dict()\n",
+    "# for pdb_id in set(\n",
+    "#     all_complexes_df[all_complexes_df[\"dataset\"] == \"Posebusters Benchmark set\"][\"pdb_id\"]\n",
+    "# ):\n",
+    "#     pdb_id = pdb_id.lower().split(\"_\")[0]\n",
+    "#     if pdb_id == \"?\":\n",
+    "#         continue\n",
+    "#     if pdb_id in pdb_info_cache:\n",
+    "#         pdb_id_info = pdb_info_cache[pdb_id]\n",
+    "#     else:\n",
+    "#         pdb_id_info = pypdb.get_all_info(pdb_id)\n",
+    "#         pdb_info_cache[pdb_id] = pdb_id_info\n",
+    "#     if not pdb_id_info:\n",
+    "#         continue\n",
+    "#     posebusters_complex_deposition_dates[pdb_id] = pdb_id_info[\"rcsb_accession_info\"][\n",
+    "#         \"deposit_date\"\n",
+    "#     ]\n",
+    "\n",
+    "# # analyze and plot statistics of the PoseBusters complexes' deposition dates\n",
+    "# posebusters_complex_pdb_deposition_dates_df = pd.DataFrame(\n",
+    "#     {\n",
+    "#         \"PDB ID\": posebusters_complex_deposition_dates.keys(),\n",
+    "#         \"Deposition Date\": posebusters_complex_deposition_dates.values(),\n",
+    "#     }\n",
+    "# )\n",
+    "# posebusters_complex_pdb_deposition_dates_df[\"Deposition Date\"] = pd.to_datetime(\n",
+    "#     posebusters_complex_pdb_deposition_dates_df[\"Deposition Date\"]\n",
+    "# )\n",
+    "# posebusters_complex_pdb_deposition_dates_df.to_csv(\n",
+    "#     \"posebusters_benchmark_complex_pdb_deposition_dates.csv\", index=False\n",
+    "# )\n",
+    "\n",
+    "# posebusters_pre_cutoff_complexes = posebusters_complex_pdb_deposition_dates_df[\n",
+    "#     posebusters_complex_pdb_deposition_dates_df[\"Deposition Date\"]\n",
+    "#     <= method_max_training_cutoff_date\n",
+    "# ]\n",
+    "# posebusters_post_cutoff_complexes = posebusters_complex_pdb_deposition_dates_df[\n",
+    "#     posebusters_complex_pdb_deposition_dates_df[\"Deposition Date\"]\n",
+    "#     > method_max_training_cutoff_date\n",
+    "# ]\n",
+    "# print(\n",
+    "#     f\"{len(posebusters_pre_cutoff_complexes)}/{len(posebusters_complex_pdb_deposition_dates_df)} PoseBusters Benchmark complexes deposited before maximum cutoff of {method_max_training_cutoff_date}.\"\n",
+    "# )\n",
+    "# print(\n",
+    "#     f\"{len(posebusters_post_cutoff_complexes)}/{len(posebusters_complex_pdb_deposition_dates_df)} PoseBusters Benchmark complexes deposited after maximum cutoff of {method_max_training_cutoff_date}.\"\n",
+    "# )\n",
+    "\n",
+    "# sns.histplot(posebusters_complex_pdb_deposition_dates_df[\"Deposition Date\"].values, bins=25)\n",
+    "# plt.xlabel(\"Deposition Date\")\n",
+    "# plt.xticks(rotation=45)\n",
+    "# plt.tight_layout()\n",
+    "# plt.savefig(\"posebusters_benchmark_complex_pdb_deposition_dates.png\")\n",
+    "# plt.show()\n",
+    "# plt.close(\"all\")"
+   ]
+  },
+  {
+   "cell_type": "markdown",
+   "metadata": {},
+   "source": [
+    "#### Identify failure modes across all datasets"
+   ]
+  },
+  {
+   "cell_type": "code",
+   "execution_count": null,
+   "metadata": {},
+   "outputs": [],
+   "source": [
+    "# find PDB IDs of complexes for which the correct (e.g., RMSD ≤ 2 Å & PB-Valid) binding conformation was not found by any method\n",
+    "for dataset in datasets:\n",
+    "    docking_success_column = \"RMSD ≤ 2 Å & PB-Valid\"\n",
+    "\n",
+    "    for repeat_index in range(1, max_num_repeats_per_method + 1):\n",
+    "        dataset_results_table = globals()[f\"results_table_{repeat_index}\"].loc[\n",
+    "            globals()[f\"results_table_{repeat_index}\"].loc[:, \"dataset\"]\n",
+    "            == dataset_mapping[dataset]\n",
+    "        ]\n",
+    "\n",
+    "        if dataset == \"casp15\":\n",
+    "            dataset_results_table.loc[:, \"pdb_id\"] = dataset_results_table.loc[:, \"target\"].map(\n",
+    "                casp15_target_pdb_id_mapping\n",
+    "            )\n",
+    "\n",
+    "        globals()[f\"{dataset}_complexes_docked_by_any_method_{repeat_index}\"] = set(\n",
+    "            dataset_results_table.loc[\n",
+    "                (dataset_results_table.loc[:, docking_success_column]).astype(bool),\n",
+    "                \"pdb_id\",\n",
+    "            ].unique()\n",
+    "        )\n",
+    "        globals()[f\"{dataset}_complexes_not_docked_by_any_method_{repeat_index}\"] = set(\n",
+    "            dataset_results_table.loc[\n",
+    "                ~dataset_results_table.loc[:, \"pdb_id\"].isin(\n",
+    "                    globals()[f\"{dataset}_complexes_docked_by_any_method_{repeat_index}\"]\n",
+    "                ),\n",
+    "                \"pdb_id\",\n",
+    "            ].unique()\n",
+    "        )"
+   ]
+  },
+  {
+   "cell_type": "markdown",
+   "metadata": {},
+   "source": [
+    "#### Find commonalities among the failure modes of each dataset"
+   ]
+  },
+  {
+   "cell_type": "code",
+   "execution_count": null,
+   "metadata": {},
+   "outputs": [],
+   "source": [
+    "# plot functional keyword statistics of the failed complexes across all datasets\n",
+    "for repeat_index in [1]:  # NOTE: for now, we only consider the first repeat\n",
+    "    all_failed_complexes_df = []\n",
+    "    for dataset in datasets:\n",
+    "        predicted_complexes_df = pd.DataFrame(\n",
+    "            globals()[f\"{dataset}_complexes_not_docked_by_any_method_{repeat_index}\"],\n",
+    "            columns=[\"pdb_id\"],\n",
+    "        )\n",
+    "        predicted_complexes_df[\"dataset\"] = dataset_mapping[dataset]\n",
+    "        all_failed_complexes_df.append(predicted_complexes_df)\n",
+    "    all_failed_complexes_df = pd.concat(all_failed_complexes_df, ignore_index=True)\n",
+    "\n",
+    "    if all_failed_complexes_df.empty:\n",
+    "        print(\"No failed complexes for any dataset.\")\n",
+    "        continue\n",
+    "\n",
+    "    failed_complex_function_annotations = []\n",
+    "    for pdb_id in set(all_failed_complexes_df[\"pdb_id\"]):\n",
+    "        pdb_id = pdb_id.lower().split(\"_\")[0]\n",
+    "        if pdb_id == \"?\":\n",
+    "            continue\n",
+    "        if pdb_id in pdb_info_cache:\n",
+    "            pdb_id_info = pdb_info_cache[pdb_id]\n",
+    "        else:\n",
+    "            pdb_id_info = pypdb.get_all_info(pdb_id)\n",
+    "            pdb_info_cache[pdb_id] = pdb_id_info\n",
+    "        if not pdb_id_info:\n",
+    "            continue\n",
+    "        failed_complex_function_annotations.append(\n",
+    "            # NOTE: these represent functional keywords\n",
+    "            pdb_id_info[\"struct_keywords\"][\"pdbx_keywords\"]\n",
+    "            .lower()\n",
+    "            .split(\", \")[0]\n",
+    "        )\n",
+    "\n",
+    "    failed_complex_function_annotation_counts = subset_counter(\n",
+    "        Counter(failed_complex_function_annotations),\n",
+    "        complex_function_annotation_counts,\n",
+    "        normalize_subset=True,\n",
+    "    )\n",
+    "    df = pd.DataFrame(\n",
+    "        failed_complex_function_annotation_counts.items(),\n",
+    "        columns=[\"Keyword\", \"Failed Ratio\"],\n",
+    "    )\n",
+    "    df[\"Frequency\"] = df[\"Keyword\"].map(complex_function_annotation_counts)\n",
+    "    df.sort_values(\n",
+    "        by=[\"Failed Ratio\", \"Frequency\"], ascending=False, inplace=True, ignore_index=True\n",
+    "    )\n",
+    "\n",
+    "    plt.figure(figsize=(10, 6))\n",
+    "    sns.barplot(data=df, x=\"Failed Ratio\", y=\"Keyword\", palette=\"viridis\")\n",
+    "\n",
+    "    plt.xlabel(\"Failed Ratio\")\n",
+    "    plt.ylabel(\"Complex Annotation\")\n",
+    "\n",
+    "    plt.xlim(0, 1.1)\n",
+    "\n",
+    "    # annotate bars with the frequency of each keyword\n",
+    "    for index, row in df.iterrows():\n",
+    "        plt.text(\n",
+    "            x=row[\"Failed Ratio\"] + 0.01,\n",
+    "            y=index,\n",
+    "            s=f\"{row['Failed Ratio']:.2f} ({row['Frequency']})\",\n",
+    "            va=\"center\",\n",
+    "        )\n",
+    "\n",
+    "    plt.tight_layout()\n",
+    "    plt.savefig(f\"failed_complexes_functional_keywords_{repeat_index}.png\")\n",
+    "    plt.show()\n",
+    "\n",
+    "    plt.close(\"all\")\n",
+    "\n",
+    "    print(f\"{len(failed_complex_function_annotations)} complex annotations across all datasets.\")"
+   ]
+  },
+  {
+   "cell_type": "markdown",
+   "metadata": {},
+   "source": [
+    "#### Identify AlphaFold 3's failure modes"
+   ]
+  },
+  {
+   "cell_type": "code",
+   "execution_count": null,
+   "metadata": {},
+   "outputs": [],
+   "source": [
+    "# find complexes that AlphaFold 3 failed to correctly predict\n",
+    "for dataset in datasets:\n",
+    "    docking_success_column = \"RMSD ≤ 2 Å & PB-Valid\"\n",
+    "\n",
+    "    for repeat_index in range(1, max_num_repeats_per_method + 1):\n",
+    "        dataset_results_table = globals()[f\"results_table_{repeat_index}\"].loc[\n",
+    "            (\n",
+    "                globals()[f\"results_table_{repeat_index}\"].loc[:, \"dataset\"]\n",
+    "                == dataset_mapping[dataset]\n",
+    "            )\n",
+    "            & (globals()[f\"results_table_{repeat_index}\"].loc[:, \"method\"] == \"AF3\")\n",
+    "        ]\n",
+    "\n",
+    "        if dataset == \"casp15\":\n",
+    "            dataset_results_table.loc[:, \"pdb_id\"] = dataset_results_table.loc[:, \"target\"].map(\n",
+    "                casp15_target_pdb_id_mapping\n",
+    "            )\n",
+    "\n",
+    "        globals()[f\"{dataset}_complexes_docked_by_af3_{repeat_index}\"] = set(\n",
+    "            dataset_results_table.loc[\n",
+    "                (dataset_results_table.loc[:, docking_success_column]).astype(bool),\n",
+    "                \"pdb_id\",\n",
+    "            ].unique()\n",
+    "        )\n",
+    "        globals()[f\"{dataset}_complexes_not_docked_by_af3_{repeat_index}\"] = set(\n",
+    "            dataset_results_table.loc[\n",
+    "                ~dataset_results_table.loc[:, \"pdb_id\"].isin(\n",
+    "                    globals()[f\"{dataset}_complexes_docked_by_af3_{repeat_index}\"]\n",
+    "                ),\n",
+    "                \"pdb_id\",\n",
+    "            ].unique()\n",
+    "        )"
+   ]
+  },
+  {
+   "cell_type": "markdown",
+   "metadata": {},
+   "source": [
+    "#### Record and plot AlphaFold 3's failure mode metadata"
+   ]
+  },
+  {
+   "cell_type": "code",
+   "execution_count": null,
+   "metadata": {},
+   "outputs": [],
+   "source": [
+    "# plot functional keyword statistics of AlphaFold 3's failed complexes across all datasets\n",
+    "all_failed_af3_complexes_df = []\n",
+    "for dataset in datasets:\n",
+    "    for repeat_index in [1]:  # NOTE: for now, we only consider the first repeat\n",
+    "        failed_af3_complexes_df = pd.DataFrame(\n",
+    "            globals()[f\"{dataset}_complexes_not_docked_by_af3_{repeat_index}\"],\n",
+    "            columns=[\"pdb_id\"],\n",
+    "        )\n",
+    "        failed_af3_complexes_df[\"dataset\"] = dataset_mapping[dataset]\n",
+    "        failed_af3_complexes_df[\"repeat_index\"] = repeat_index\n",
+    "        all_failed_af3_complexes_df.append(failed_af3_complexes_df)\n",
+    "all_failed_af3_complexes_df = pd.concat(all_failed_af3_complexes_df, ignore_index=True)\n",
+    "\n",
+    "failed_af3_complex_function_annotations = []\n",
+    "for pdb_id in set(all_failed_af3_complexes_df[\"pdb_id\"]):\n",
+    "    pdb_id = pdb_id.lower().split(\"_\")[0]\n",
+    "    if pdb_id == \"?\":\n",
+    "        continue\n",
+    "    if pdb_id in pdb_info_cache:\n",
+    "        pdb_id_info = pdb_info_cache[pdb_id]\n",
+    "    else:\n",
+    "        pdb_id_info = pypdb.get_all_info(pdb_id)\n",
+    "        pdb_info_cache[pdb_id] = pdb_id_info\n",
+    "    if not pdb_id_info:\n",
+    "        continue\n",
+    "    failed_af3_complex_function_annotations.append(\n",
+    "        # NOTE: these represent functional keywords\n",
+    "        pdb_id_info[\"struct_keywords\"][\"pdbx_keywords\"]\n",
+    "        .lower()\n",
+    "        .split(\", \")[0]\n",
+    "    )\n",
+    "\n",
+    "failed_af3_complex_function_annotation_counts = subset_counter(\n",
+    "    Counter(failed_af3_complex_function_annotations),\n",
+    "    complex_function_annotation_counts,\n",
+    "    normalize_subset=True,\n",
+    ")\n",
+    "df = pd.DataFrame(\n",
+    "    failed_af3_complex_function_annotation_counts.items(),\n",
+    "    columns=[\"Keyword\", \"Failed Ratio\"],\n",
+    ")\n",
+    "df[\"Frequency\"] = df[\"Keyword\"].map(complex_function_annotation_counts)\n",
+    "df.sort_values(by=[\"Failed Ratio\", \"Frequency\"], ascending=False, inplace=True, ignore_index=True)\n",
+    "\n",
+    "plt.figure(figsize=(12, 8))\n",
+    "sns.barplot(data=df, x=\"Failed Ratio\", y=\"Keyword\", palette=\"viridis\")\n",
+    "\n",
+    "plt.xlabel(\"Failed Ratio\")\n",
+    "plt.ylabel(\"Complex Annotation\")\n",
+    "\n",
+    "plt.xlim(0, 1.09)\n",
+    "\n",
+    "# annotate bars with the frequency of each keyword\n",
+    "for index, row in df.iterrows():\n",
+    "    plt.text(\n",
+    "        x=row[\"Failed Ratio\"] + 0.01,\n",
+    "        y=index,\n",
+    "        s=f\"{row['Failed Ratio']:.2f} ({row['Frequency']})\",\n",
+    "        va=\"center\",\n",
+    "    )\n",
+    "\n",
+    "plt.tight_layout()\n",
+    "plt.savefig(\"failed_af3_complexes_functional_keywords.png\")\n",
+    "plt.show()\n",
+    "\n",
+    "plt.close(\"all\")\n",
+    "\n",
+    "print(f\"{len(failed_af3_complex_function_annotations)} complex annotations across all datasets.\")"
+   ]
+  },
+  {
+   "cell_type": "markdown",
+   "metadata": {},
+   "source": [
+    "#### Study PDB statistics of different types of complexes"
+   ]
+  },
+  {
+   "cell_type": "code",
+   "execution_count": null,
+   "metadata": {},
+   "outputs": [],
+   "source": [
+    "# combine all CSV files from a custom PDB report\n",
+    "report_types = os.listdir(\"pdb_reports\")\n",
+    "\n",
+    "for report_type in report_types:\n",
+    "    pdb_report_dir = os.path.join(\"pdb_reports\", report_type)\n",
+    "    pdb_report_files = [\n",
+    "        os.path.join(pdb_report_dir, f) for f in os.listdir(pdb_report_dir) if f.endswith(\".csv\")\n",
+    "    ]\n",
+    "\n",
+    "    pdb_report_dfs = []\n",
+    "    for pdb_report_file in pdb_report_files:\n",
+    "        pdb_report_dfs.append(pd.read_csv(pdb_report_file, skiprows=1))\n",
+    "    pdb_report_df = pd.concat(pdb_report_dfs, ignore_index=True)\n",
+    "\n",
+    "    # analyze and plot statistics of the custom PDB report\n",
+    "    pdb_report_df[\"Refinement Resolution (Å)\"] = pdb_report_df[\"Refinement Resolution (Å)\"].astype(\n",
+    "        str\n",
+    "    )\n",
+    "    pdb_report_df[\"Refinement Resolution (Å)\"] = pd.to_numeric(\n",
+    "        pdb_report_df[\"Refinement Resolution (Å)\"].str.replace(\",\", \"\"),\n",
+    "        errors=\"coerce\",\n",
+    "    )\n",
+    "    pdb_report_df[\"Deposition Date\"] = pd.to_datetime(pdb_report_df[\"Deposition Date\"])\n",
+    "\n",
+    "    pdb_report_df.to_csv(f\"{report_type}_pdb_report.csv\", index=False)\n",
+    "\n",
+    "    print(f\"{len(pdb_report_df)} PDB entries in the custom {report_type} report.\")\n",
+    "\n",
+    "    sns.histplot(pdb_report_df[\"Refinement Resolution (Å)\"].values)\n",
+    "    plt.xlim(0, 10)\n",
+    "    plt.xlabel(\"Refinement Resolution (Å)\")\n",
+    "    plt.tight_layout()\n",
+    "    plt.savefig(f\"{report_type}_pdb_report_resolution.png\")\n",
+    "    plt.show()\n",
+    "\n",
+    "    plt.close(\"all\")\n",
+    "\n",
+    "    sns.histplot(pdb_report_df[\"Deposition Date\"].values)\n",
+    "    plt.xlabel(\"Deposition Date\")\n",
+    "    plt.tight_layout()\n",
+    "    plt.savefig(f\"{report_type}_pdb_report_deposition_date.png\")\n",
+    "    plt.show()\n",
+    "\n",
+    "    plt.close(\"all\")"
+   ]
+  },
+  {
+   "cell_type": "markdown",
+   "metadata": {},
+   "source": [
+    "<!-- #### Study AlphaFold 3's relationship between training-test set ligand-binding pocket structural overlap and structure prediction performance -->"
+   ]
+  },
+  {
+   "cell_type": "markdown",
+   "metadata": {},
+   "source": [
+    "#### Plot correlation between performance of method predictions for PoseBusters Benchmark set complexes and their maximum similarity to the PDB"
+   ]
+  },
+  {
+   "cell_type": "code",
+   "execution_count": null,
+   "metadata": {},
+   "outputs": [],
+   "source": [
+    "# compare max (training set) ligand-binding pocket structural overlap and (test set) RMSD of each method's predicted PoseBusters Benchmark set complexes\n",
+    "af3_overlap_datasets = [\"posebusters_benchmark\"]\n",
+    "\n",
+    "all_predicted_complexes_df = []\n",
+    "for dataset in af3_overlap_datasets:\n",
+    "    for repeat_index in [1]:  # NOTE: for now, we only consider the first repeat\n",
+    "        predicted_complexes_df = copy.deepcopy(\n",
+    "            globals()[f\"results_table_{repeat_index}\"].loc[\n",
+    "                (\n",
+    "                    globals()[f\"results_table_{repeat_index}\"].loc[:, \"dataset\"]\n",
+    "                    == dataset_mapping[dataset]\n",
+    "                )\n",
+    "            ]\n",
+    "        )\n",
+    "        predicted_complexes_df[\"dataset\"] = dataset_mapping[dataset]\n",
+    "        predicted_complexes_df[\"repeat_index\"] = repeat_index\n",
+    "        all_predicted_complexes_df.append(predicted_complexes_df)\n",
+    "all_predicted_complexes_df = pd.concat(all_predicted_complexes_df, ignore_index=True)\n",
+    "all_predicted_complex_pdb_ids = list(all_predicted_complexes_df.loc[:, \"pdb_id\"].unique())\n",
+    "\n",
+    "# analyze and plot statistics of each method's predictions and the novelty of the target binding modes\n",
+    "pb_pdb_id_ccd_code_mapping = {\n",
+    "    pdb_ccd_code.split(\"_\")[0]: pdb_ccd_code.split(\"_\")[1]\n",
+    "    for pdb_ccd_code in os.listdir(os.path.join(\"..\", \"data\", \"posebusters_benchmark_set\"))\n",
+    "    if os.path.isdir(os.path.join(\"..\", \"data\", \"posebusters_benchmark_set\", pdb_ccd_code))\n",
+    "    if pdb_ccd_code.split(\"_\")[0].lower() in all_predicted_complex_pdb_ids\n",
+    "    and not any(s in pdb_ccd_code for s in [\"plots\", \"msas\", \"structures\"])\n",
+    "}\n",
+    "\n",
+    "# load annotations from CSV\n",
+    "annotated_df = pd.read_csv(os.path.join(\"..\", \"data\", \"plinder\", \"annotations.csv\"))\n",
+    "annotated_df[\"target_release_date\"] = pd.to_datetime(annotated_df[\"target_release_date\"])\n",
+    "\n",
+    "# filter annotated_df to rows where (entry_pdb_id, ligand_ccd_code) matches pb_pdb_id_ccd_code_mapping\n",
+    "annotated_df = annotated_df[\n",
+    "    annotated_df.apply(\n",
+    "        lambda row: (\n",
+    "            (row[\"entry_pdb_id\"].upper(), row[\"ligand_ccd_code\"])\n",
+    "            in pb_pdb_id_ccd_code_mapping.items()\n",
+    "        )\n",
+    "        and not pd.isna(row[\"target_system\"]),\n",
+    "        axis=1,\n",
+    "    )\n",
+    "]\n",
+    "\n",
+    "# ensure the key columns match in format\n",
+    "predicted_complexes_df[\"pdb_id\"] = predicted_complexes_df[\"pdb_id\"].str.upper()\n",
+    "annotated_df[\"entry_pdb_id\"] = annotated_df[\"entry_pdb_id\"].str.upper()\n",
+    "\n",
+    "# merge RMSD values into annotated_df\n",
+    "annotated_df = annotated_df.merge(\n",
+    "    predicted_complexes_df[[\"pdb_id\", \"method\", \"rmsd\"]],\n",
+    "    left_on=\"entry_pdb_id\",\n",
+    "    right_on=\"pdb_id\",\n",
+    "    how=\"left\",\n",
+    ")\n",
+    "\n",
+    "\n",
+    "def remove_rmsd_outliers(df: pd.DataFrame, col: str = \"rmsd\", factor: float = 1.5) -> pd.DataFrame:\n",
+    "    \"\"\"Remove outliers from a DataFrame column.\"\"\"\n",
+    "    q1 = df[col].quantile(0.25)\n",
+    "    q3 = df[col].quantile(0.75)\n",
+    "    iqr = q3 - q1\n",
+    "    lower_bound = q1 - factor * iqr\n",
+    "    upper_bound = q3 + factor * iqr\n",
+    "    return df[(df[col] >= lower_bound) & (df[col] <= upper_bound)]\n",
+    "\n",
+    "\n",
+    "# drop rows with missing or outlier values\n",
+    "method_generalization_df = annotated_df[[\"sucos_shape_pocket_qcov\", \"method\", \"rmsd\"]].dropna()\n",
+    "method_generalization_df = remove_rmsd_outliers(method_generalization_df)\n",
+    "\n",
+    "# --- compute per-method correlations (use all points for stats) ---\n",
+    "method_corrs = []\n",
+    "for method_name, df_method in method_generalization_df.groupby(\"method\"):\n",
+    "    if len(df_method) < 3:\n",
+    "        continue\n",
+    "    pr, pp = pearsonr(df_method[\"sucos_shape_pocket_qcov\"], df_method[\"rmsd\"])\n",
+    "    sr, sp = spearmanr(df_method[\"sucos_shape_pocket_qcov\"], df_method[\"rmsd\"])\n",
+    "    method_corrs.append(\n",
+    "        {\n",
+    "            \"method\": method_name,\n",
+    "            \"pearson_r\": pr,\n",
+    "            \"pearson_p\": pp,\n",
+    "            \"spearman_r\": sr,\n",
+    "            \"spearman_p\": sp,\n",
+    "            \"n\": len(df_method),\n",
+    "        }\n",
+    "    )\n",
+    "\n",
+    "corr_df = pd.DataFrame(method_corrs)\n",
+    "if corr_df.empty:\n",
+    "    raise ValueError(\"No methods have >= 3 points; nothing to plot.\")\n",
+    "\n",
+    "# --- split positive vs negative Pearson r ---\n",
+    "# pos_df = corr_df[corr_df[\"pearson_r\"] >= 0].sort_values(\"pearson_r\", ascending=False)\n",
+    "# neg_df = corr_df[corr_df[\"pearson_r\"] < 0].sort_values(\"pearson_r\")\n",
+    "\n",
+    "neg_df = corr_df.sort_values(\"pearson_r\")\n",
+    "\n",
+    "# pos_methods = pos_df[\"method\"].tolist()\n",
+    "neg_methods = neg_df[\"method\"].tolist()\n",
+    "\n",
+    "# --- determine clipping to ignore extreme RMSD values for axis scaling ---\n",
+    "ymax = np.percentile(method_generalization_df[\"rmsd\"], 95)\n",
+    "ymin = max(0.0, method_generalization_df[\"rmsd\"].min())\n",
+    "\n",
+    "# fig, axes = plt.subplots(1, 2, figsize=(14, 6), sharey=True)\n",
+    "# ax_pos, ax_neg = axes\n",
+    "\n",
+    "fig, axes = plt.subplots(1, 1, figsize=(10, 6), sharey=True)\n",
+    "ax_neg = axes\n",
+    "\n",
+    "\n",
+    "def plot_group(ax, methods, corr_subdf):\n",
+    "    if not methods:\n",
+    "        ax.text(0.5, 0.5, \"No methods in this group\", ha=\"center\", va=\"center\")\n",
+    "        ax.set_xlabel(\"SuCOS-pocket similarity\")\n",
+    "        ax.set_ylim(ymin, ymax)\n",
+    "        return\n",
+    "\n",
+    "    palette = sns.color_palette(n_colors=len(methods))\n",
+    "    for i, method in enumerate(methods):\n",
+    "        dfm = method_generalization_df[method_generalization_df[\"method\"] == method]\n",
+    "        color = palette[i]\n",
+    "        # scatter points\n",
+    "        sns.scatterplot(\n",
+    "            data=dfm,\n",
+    "            x=\"sucos_shape_pocket_qcov\",\n",
+    "            y=\"rmsd\",\n",
+    "            ax=ax,\n",
+    "            label=method,\n",
+    "            color=color,\n",
+    "            alpha=0.5,\n",
+    "            s=40,\n",
+    "        )\n",
+    "        # regression line (no scatter here)\n",
+    "        sns.regplot(\n",
+    "            data=dfm,\n",
+    "            x=\"sucos_shape_pocket_qcov\",\n",
+    "            y=\"rmsd\",\n",
+    "            ax=ax,\n",
+    "            scatter=False,\n",
+    "            ci=None,\n",
+    "            color=color,\n",
+    "            line_kws={\"lw\": 2},\n",
+    "        )\n",
+    "        # mark outliers that were clipped for axis scaling\n",
+    "        out = dfm[dfm[\"rmsd\"] > ymax]\n",
+    "        if not out.empty:\n",
+    "            ax.scatter(\n",
+    "                out[\"sucos_shape_pocket_qcov\"],\n",
+    "                [ymax] * len(out),\n",
+    "                marker=\"^\",\n",
+    "                s=60,\n",
+    "                edgecolor=\"k\",\n",
+    "                linewidth=0.5,\n",
+    "                color=color,\n",
+    "                alpha=0.85,\n",
+    "            )\n",
+    "\n",
+    "    ax.set_xlabel(\"SuCOS-pocket similarity\")\n",
+    "    ax.set_ylim(ymin, ymax)\n",
+    "    ax.legend(fontsize=8, loc=\"upper left\")\n",
+    "\n",
+    "    # correlation table for this panel\n",
+    "    text_lines = [\n",
+    "        f\"{r['method']}: r={r['pearson_r']:.2f} (p={r['pearson_p']:.1g}), ρ={r['spearman_r']:.2f}\"\n",
+    "        for _, r in corr_subdf.iterrows()\n",
+    "    ]\n",
+    "    ax.text(\n",
+    "        0.98,\n",
+    "        0.98,  # near top-right\n",
+    "        \"\\n\".join(text_lines),\n",
+    "        fontsize=9,\n",
+    "        ha=\"right\",\n",
+    "        va=\"top\",\n",
+    "        transform=ax.transAxes,  # position in axes coordinates\n",
+    "        bbox=dict(facecolor=\"white\", edgecolor=\"gray\", boxstyle=\"round,pad=0.3\"),\n",
+    "    )\n",
+    "\n",
+    "\n",
+    "# plot_group(ax_pos, pos_methods, pos_df)\n",
+    "# # ax_pos.set_title(\"Methods with positive Pearson r\")\n",
+    "# ax_pos.set_ylabel(\"RMSD\")\n",
+    "\n",
+    "\n",
+    "plot_group(ax_neg, neg_methods, neg_df)\n",
+    "# ax_neg.set_title(\"Methods with negative Pearson r\")\n",
+    "# ax_neg.set_ylabel(\"\")  # shared y-label on left\n",
+    "ax_neg.set_ylabel(\"RMSD\")\n",
+    "\n",
+    "plt.tight_layout()\n",
+    "plt.savefig(\"posebusters_benchmark_methods_generalization_analysis.png\", dpi=300)\n",
+    "plt.show()\n",
+    "\n",
+    "# print sorted summary to console\n",
+    "print(corr_df.sort_values(\"pearson_r\", ascending=False).to_string(index=False))"
+   ]
+  }
+ ],
+ "metadata": {
+  "kernelspec": {
+   "display_name": "PoseBench",
+   "language": "python",
+   "name": "python3"
+  },
+  "language_info": {
+   "codemirror_mode": {
+    "name": "ipython",
+    "version": 3
+   },
+   "file_extension": ".py",
+   "mimetype": "text/x-python",
+   "name": "python",
+   "nbconvert_exporter": "python",
+   "pygments_lexer": "ipython3",
+   "version": "3.10.14"
+  }
+ },
+ "nbformat": 4,
+ "nbformat_minor": 2
+}
diff --git a/notebooks/immune_system_pdb_report.csv b/notebooks/immune_system_pdb_report.csv
new file mode 100644
index 00000000..cf06b16e
--- /dev/null
+++ b/notebooks/immune_system_pdb_report.csv
@@ -0,0 +1,10220 @@
+Entry ID,Deposition Date,Refinement Resolution (Å),Unnamed: 3
+1A6V,1998-03-03,1.8,
+1B09,1998-11-18,2.5,
+1B0W,1998-11-13,1.8,
+1B2W,1998-12-01,2.9,
+1B3J,1998-12-11,3.0,
+1B88,1999-02-09,2.5,
+1BAF,1992-01-16,2.9,
+1BJ1,1998-06-30,2.4,
+1BLN,1998-07-16,2.8,
+1BM3,1999-04-15,2.0,
+1BQH,1998-08-16,2.8,
+1BWM,1998-09-23,,
+1BWW,1998-09-29,1.7,
+1BX2,1998-10-12,2.6,
+1BXI,1998-10-04,2.05,
+1BXT,1998-10-08,1.85,
+1BZ7,1998-11-06,2.5,
+1C12,1999-07-20,2.6,
+1C16,1999-07-20,3.1,
+1C1E,1999-07-22,1.9,
+1C5B,1999-11-08,2.1,
+1C5C,1999-11-09,1.61,
+1C5D,1999-11-17,2.4,
+1C9H,1999-08-02,2.0,
+1CD0,1999-03-05,1.9,
+1CE1,1999-03-12,1.9,
+1CI5,1999-04-07,,
+1CL7,1999-05-06,3.0,
+1CQK,1999-08-06,2.2,
+1CQP,1999-08-10,2.6,
+1CR9,1999-08-14,2.0,
+1CT8,1999-08-20,2.2,
+1CU4,1999-08-20,2.9,
+1CV9,1999-08-23,,
+1CZ8,1999-09-01,2.4,
+1D5B,1999-10-06,2.8,
+1D5I,1999-10-07,2.0,
+1D6V,1999-10-15,2.0,
+1D6X,1999-10-15,,
+1D9C,1999-10-27,2.0,
+1D9G,1999-10-27,2.9,
+1D9K,1999-10-28,3.2,
+1DEE,1999-11-15,2.7,
+1DFW,1999-11-22,,
+1DGQ,1999-11-24,,
+1DL7,1999-12-08,2.35,
+1DN0,1999-12-15,2.28,
+1DN2,1999-12-15,2.7,
+1DQD,2000-01-04,2.1,
+1DQL,2000-01-04,2.6,
+1DQM,2000-01-04,2.1,
+1DQQ,2000-01-04,1.8,
+1DQT,2000-01-05,2.0,
+1DQY,2000-01-05,1.83,
+1DQZ,2000-01-05,1.5,
+1DR9,2000-01-06,3.0,
+1DT4,2000-01-11,2.6,
+1DTJ,2000-01-12,2.0,
+1DUY,2000-01-19,2.15,
+1DUZ,2000-01-19,1.8,
+1DZB,2000-02-23,2.0,
+1E27,2000-05-18,2.2,
+1E4J,2000-07-07,2.5,
+1E4K,2000-07-07,3.2,
+1E4W,2000-07-12,1.95,
+1E4X,2000-07-12,1.9,
+1ED3,2000-01-26,2.55,
+1EEQ,2000-02-01,1.5,
+1EEU,2000-02-03,1.6,
+1EEY,2000-02-04,2.25,
+1EEZ,2000-02-04,2.3,
+1EFQ,2000-02-09,1.6,
+1EFX,2000-02-10,3.0,
+1EGJ,2000-02-15,2.8,
+1EHL,2000-02-21,2.4,
+1EJO,2000-03-03,2.3,
+1EK3,2000-03-06,1.9,
+1EKU,2000-03-09,2.9,
+1EL0,2000-03-11,,
+1EMT,2000-03-17,2.25,
+1EMV,2000-03-20,1.7,
+1ES0,2000-04-07,2.6,
+1ET6,2000-04-12,1.9,
+1ET9,2000-04-12,1.9,
+1ETZ,2000-04-13,2.6,
+1EU3,2000-04-13,1.68,
+1EU4,2000-04-13,2.5,
+1EXU,2000-05-04,2.7,
+1F11,2000-05-18,3.0,
+1F1M,2000-05-19,1.8,
+1F2Q,2000-05-28,2.4,
+1F2X,2000-05-30,2.1,
+1F3D,2000-06-02,1.87,
+1F3J,2000-06-04,3.1,
+1F3R,2000-06-06,,
+1F4W,2000-06-10,2.3,
+1F4X,2000-06-10,2.3,
+1F4Y,2000-06-10,2.8,
+1F6A,2000-06-20,3.5,
+1F6L,2000-06-22,2.8,
+1F8T,2000-07-05,2.2,
+1F90,2000-07-06,2.6,
+1FE8,2000-07-21,2.03,
+1FG2,2000-07-27,2.754,
+1FG9,2000-07-28,2.9,
+1FGV,1993-11-01,1.9,
+1FH5,2000-07-31,2.9,
+1FJ1,2000-08-07,2.68,
+1FL3,2000-08-11,2.45,
+1FL5,2000-08-11,2.1,
+1FL6,2000-08-11,2.8,
+1FM5,2000-08-16,2.27,
+1FN4,2000-08-21,2.8,
+1FNE,2000-08-21,1.9,
+1FNG,2000-08-21,1.9,
+1FNS,2000-08-23,2.0,
+1FO0,2000-08-24,2.5,
+1FP5,2000-08-30,2.3,
+1FR2,2000-09-07,1.6,
+1FSK,2000-09-11,2.9,
+1FV1,2000-09-18,1.9,
+1FYH,2000-09-29,2.04,
+1FYT,2000-10-03,2.6,
+1FZJ,2000-10-03,1.9,
+1FZK,2000-10-03,1.7,
+1FZM,2000-10-03,1.8,
+1FZO,2000-10-03,1.8,
+1G0X,2000-10-09,2.1,
+1G0Y,2000-10-09,3.0,
+1G5Z,2000-11-02,2.51,
+1G6R,2000-11-07,2.8,
+1G7P,2000-11-13,1.5,
+1G7Q,2000-11-13,1.6,
+1G84,2000-11-16,,
+1G8Q,2000-11-20,1.6,
+1G9E,2000-11-23,,
+1GCZ,2000-08-24,1.9,
+1GD0,2000-08-24,1.5,
+1GPO,1997-03-27,1.95,
+1GYF,1999-04-30,,
+1H0T,2002-06-27,,
+1H3T,2002-09-19,2.4,
+1H3U,2002-09-19,2.4,
+1H3V,2002-09-19,3.1,
+1H3W,2002-09-19,2.85,
+1H3X,2002-09-19,2.44,
+1H3Y,2002-09-19,4.1,
+1HA6,2001-03-28,,
+1HDM,1998-09-09,2.5,
+1HH6,2000-12-21,2.6,
+1HQ4,2000-12-14,2.7,
+1HQR,2000-12-19,3.2,
+1HSB,1993-03-30,1.9,
+1HXM,2001-01-16,3.12,
+1HYR,2001-01-21,2.7,
+1HZF,2001-01-24,2.3,
+1HZH,2001-01-24,2.7,
+1I1A,2001-01-31,2.8,
+1I1C,2001-01-31,2.7,
+1I1F,1999-04-16,2.8,
+1I1Y,1999-04-16,2.2,
+1I3R,2001-02-15,2.4,
+1I3U,2001-02-16,1.95,
+1I3V,2001-02-16,2.03,
+1I4F,2001-02-21,1.4,
+1I7R,2001-03-10,2.2,
+1I7T,2001-03-10,2.8,
+1I7U,2001-03-10,1.8,
+1I7Z,2001-03-12,2.3,
+1I85,2001-03-12,3.2,
+1I8I,2001-03-14,2.4,
+1I8K,2001-03-14,1.8,
+1I8L,2001-03-14,3.0,
+1I9E,2001-03-19,2.5,
+1I9I,2001-03-20,2.72,
+1I9J,2001-03-20,2.6,
+1IBG,1994-10-25,2.7,
+1IEH,2001-04-09,,
+1IFR,2001-04-13,1.4,
+1IL1,2001-05-07,2.2,
+1IM9,2001-05-10,2.8,
+1INQ,2001-05-14,2.2,
+1IQW,2001-08-10,2.5,
+1IT9,2002-01-11,2.8,
+1IV5,2002-03-14,2.6,
+1IW2,2002-04-11,1.9,
+1J05,2002-11-01,1.5,
+1J4V,2001-11-21,,
+1J86,2001-05-20,3.2,
+1J87,2001-05-20,3.2,
+1J88,2001-05-20,3.2,
+1J89,2001-05-20,4.1,
+1J8H,2001-05-21,2.4,
+1JA3,2001-05-29,3.0,
+1JBJ,2001-06-05,,
+1JE6,2001-06-15,2.5,
+1JF1,2001-06-19,1.85,
+1JFM,2001-06-21,2.85,
+1JFQ,2001-06-21,1.9,
+1JGD,2001-06-25,1.9,
+1JGE,2001-06-25,2.1,
+1JGL,2001-06-26,2.15,
+1JGU,2001-06-26,1.8,
+1JGV,2001-06-26,1.85,
+1JHK,2001-06-28,2.51,
+1JHT,2001-06-28,2.15,
+1JK8,2001-07-11,2.4,
+1JL4,2001-07-15,4.3,
+1JN6,2001-07-23,2.7,
+1JNH,2001-07-24,2.85,
+1JNJ,2001-07-24,,
+1JNL,2001-07-24,3.0,
+1JNN,2001-07-24,3.2,
+1JNP,2001-07-24,2.5,
+1JP5,2001-08-01,2.7,
+1JPF,2001-08-02,2.18,
+1JPG,2001-08-02,2.2,
+1JPS,2001-08-03,1.85,
+1JPT,2001-08-03,1.85,
+1JPY,2001-08-03,2.85,
+1JUF,2001-08-24,2.0,
+1JVK,2001-08-30,1.94,
+1JWM,2001-09-04,2.7,
+1JWS,2001-09-05,2.6,
+1JWU,2001-09-05,2.3,
+1K2D,2001-09-26,2.2,
+1K5N,2001-10-11,1.09,
+1K6Q,2001-10-17,2.4,
+1K8D,2001-10-23,2.3,
+1K8I,2001-10-24,3.1,
+1KA6,2001-10-31,,
+1KA7,2001-10-31,,
+1KBG,1998-08-28,2.2,
+1KC5,2001-11-07,2.5,
+1KCG,2001-11-08,2.6,
+1KCR,2001-11-11,2.9,
+1KCS,2001-11-11,2.5,
+1KCU,2001-11-11,2.2,
+1KCV,2001-11-11,1.8,
+1KFA,2001-11-20,2.8,
+1KGC,2001-11-26,1.5,
+1KJ2,2001-12-04,2.71,
+1KJ3,2001-12-04,2.3,
+1KJM,2001-12-04,2.35,
+1KJV,2001-12-05,1.48,
+1KN2,2001-12-18,1.9,
+1KN4,2001-12-18,1.9,
+1KPR,2002-01-02,2.8,
+1KPU,2002-01-02,1.5,
+1KPV,2002-01-02,1.71,
+1KT2,2002-01-15,2.8,
+1KTD,2002-01-15,2.4,
+1KTK,2002-01-16,3.0,
+1KTL,2002-01-16,3.1,
+1KTR,2002-01-17,2.7,
+1KZQ,2002-02-07,1.7,
+1L0X,2002-02-14,2.8,
+1L0Y,2002-02-14,2.5,
+1L2H,2002-02-21,1.54,
+1L3H,2002-02-27,,
+1L6X,2002-03-14,1.65,
+1L7I,2002-03-15,1.8,
+1L7T,2002-03-17,2.1,
+1L8W,2002-03-21,2.3,
+1LDS,2002-04-09,1.8,
+1LEG,2002-04-09,1.75,
+1LEK,2002-04-09,2.15,
+1LF7,2002-04-10,1.2,
+1LGV,2002-04-16,1.95,
+1LHZ,2002-04-17,2.3,
+1LJT,2002-04-22,2.0,
+1LK2,2002-04-23,1.35,
+1LK3,2002-04-23,1.91,
+1LMI,2002-05-01,1.5,
+1LO0,2002-05-05,2.0,
+1LO2,2002-05-06,2.0,
+1LO3,2002-05-06,2.3,
+1LO4,2002-05-06,2.4,
+1LP1,2002-05-07,2.3,
+1LP9,2002-05-07,2.0,
+1LQS,2002-05-13,2.7,
+1LY2,2002-06-06,1.8,
+1M05,2002-06-11,1.9,
+1M4K,2002-07-03,2.3,
+1M4V,2002-07-05,1.9,
+1M6O,2002-07-17,1.6,
+1M71,2002-07-18,2.8,
+1M7D,2002-07-19,2.3,
+1M7I,2002-07-19,2.5,
+1MCC,1993-02-25,2.7,
+1MCI,1993-02-25,2.7,
+1MCL,1993-02-25,2.7,
+1MCN,1993-02-25,2.7,
+1MD6,2002-08-07,1.6,
+1MEX,2002-08-08,1.25,
+1MH5,2002-08-19,2.1,
+1MHH,2002-08-20,2.1,
+1MHP,2002-08-20,2.8,
+1MHX,2002-08-21,1.8,
+1MI0,2002-08-21,1.85,
+1MI5,2002-08-21,2.5,
+1MIE,2002-08-23,1.95,
+1MJ7,2002-08-27,2.25,
+1MJ8,2002-08-27,1.75,
+1MJJ,2002-08-28,2.1,
+1MJN,2002-08-28,1.3,
+1MJU,2002-08-28,1.22,
+1MKF,2002-08-29,2.1,
+1ML0,2002-08-29,2.8,
+1MLB,1995-03-08,2.1,
+1MNU,1999-04-30,2.5,
+1MOE,2002-09-09,2.6,
+1MPU,2002-09-12,2.5,
+1MQ8,2002-09-15,3.3,
+1MQ9,2002-09-15,2.0,
+1MQA,2002-09-15,2.5,
+1MQK,2002-09-16,1.28,
+1MUJ,2002-09-23,2.15,
+1MVF,2002-09-25,1.65,
+1MVU,2002-09-26,1.78,
+1MWA,2002-09-27,2.4,
+1N0X,2002-10-15,1.8,
+1N1F,2002-10-17,1.95,
+1N2R,2002-10-24,1.7,
+1N3N,2002-10-29,3.0,
+1N4X,2002-11-02,1.7,
+1N59,2002-11-05,2.95,
+1N5A,2002-11-05,2.85,
+1N64,2002-11-08,2.34,
+1N6U,2002-11-12,,
+1N6V,2002-11-12,,
+1N7M,2002-11-15,1.8,
+1NAK,2002-11-27,2.57,
+1NAM,2002-11-28,2.7,
+1NAN,2002-11-28,2.3,
+1NBQ,2002-12-03,2.9,
+1NC2,2002-12-04,2.1,
+1NC4,2002-12-04,2.25,
+1NCN,2002-12-05,2.7,
+1NCW,2002-12-05,1.3,
+1ND0,2002-12-05,2.45,
+1NEZ,2002-12-12,2.1,
+1NGW,2002-12-18,2.6,
+1NGX,2002-12-18,1.8,
+1NGY,2002-12-18,2.2,
+1NGZ,2002-12-18,1.6,
+1NJ9,2002-12-30,2.35,
+1NKO,2003-01-03,1.45,
+1NL0,2003-01-06,2.2,
+1NLB,2003-01-07,1.6,
+1NPU,2003-01-20,2.0,
+1NTJ,2003-01-30,,
+1NTL,2003-01-30,,
+1NYO,2003-02-13,,
+1O0V,2002-09-06,2.6,
+1OAQ,2003-01-21,1.5,
+1OAR,2003-01-21,2.23,
+1OAU,2003-01-21,1.8,
+1OAX,2003-01-21,2.67,
+1OAY,2003-01-21,2.66,
+1OAZ,2003-01-21,2.78,
+1OB1,2003-01-22,2.9,
+1OCW,2003-02-11,2.0,
+1OEY,2003-04-02,2.0,
+1OF2,2003-04-04,2.2,
+1OGT,2003-05-13,1.47,
+1ONQ,2003-02-28,2.15,
+1OQE,2003-03-07,2.5,
+1OQO,2003-03-10,2.3,
+1OQX,2003-03-11,2.6,
+1OSG,2003-03-19,3.0,
+1OSX,2003-03-20,,
+1OVZ,2003-03-27,3.0,
+1OW0,2003-03-27,3.1,
+1P1Z,2003-04-14,3.26,
+1P4B,2003-04-22,2.35,
+1P4I,2003-04-23,2.8,
+1P4L,2003-04-23,2.9,
+1P6F,2003-04-29,2.2,
+1P7E,2003-05-01,,
+1P7F,2003-05-01,,
+1P7K,2003-05-02,1.75,
+1P7Q,2003-05-05,3.4,
+1PEW,2003-05-22,1.6,
+1PG7,2003-05-27,2.5,
+1PK6,2003-06-05,1.85,
+1PKO,2003-06-06,1.45,
+1PKQ,2003-06-06,3.0,
+1POQ,2003-06-16,,
+1PPQ,2003-06-17,,
+1PSZ,1998-10-13,2.0,
+1PW3,2003-06-30,1.9,
+1PW6,2003-06-30,2.6,
+1PY2,2003-07-07,2.8,
+1PY9,2003-07-08,1.8,
+1PZ5,2003-07-09,1.8,
+1Q0X,2003-07-17,1.6,
+1Q0Y,2003-07-17,2.0,
+1Q1J,2003-07-21,2.5,
+1Q2N,2003-07-25,,
+1Q72,2003-08-15,1.7,
+1Q94,2003-08-22,2.4,
+1Q9K,2003-08-25,1.96,
+1Q9L,2003-08-25,2.28,
+1Q9O,2003-08-25,1.79,
+1Q9W,2003-08-26,1.75,
+1QA9,1999-04-13,3.2,
+1QAC,1999-02-25,1.8,
+1QD0,1999-07-08,2.5,
+1QE6,1999-07-13,2.35,
+1QFO,1999-04-12,1.85,
+1QFW,1999-04-15,3.5,
+1QKZ,1999-08-17,1.95,
+1QNZ,1999-10-26,,
+1QP1,1999-05-30,2.06,
+1QQD,1999-06-03,2.7,
+1QQF,1999-06-04,1.45,
+1QR1,1999-06-17,2.4,
+1QRN,1999-06-14,2.8,
+1QSE,1999-06-21,2.8,
+1QSF,1999-06-21,2.8,
+1QSJ,1999-06-22,1.9,
+1QVO,2003-08-28,2.22,
+1QYG,2003-09-10,1.81,
+1R24,1998-11-05,3.1,
+1R3H,2003-10-02,2.5,
+1R5I,2003-10-10,2.6,
+1R70,2003-10-17,,
+1R88,2003-10-23,1.71,
+1RD4,2003-11-05,2.4,
+1RFD,2003-11-07,2.09,
+1RHH,2003-11-14,1.9,
+1RIH,2003-11-17,2.5,
+1RIU,2003-11-18,2.0,
+1RIV,2003-11-18,2.2,
+1RJL,2003-11-19,2.6,
+1RJY,2003-11-20,1.9,
+1RJZ,2003-11-20,2.6,
+1RK0,2003-11-20,2.61,
+1RK1,2003-11-20,2.1,
+1RU9,2003-12-11,2.5,
+1RUA,2003-12-11,1.75,
+1RUK,2003-12-11,1.4,
+1RUL,2003-12-11,1.88,
+1RUM,2003-12-11,1.48,
+1RUP,2003-12-11,1.4,
+1RUQ,2003-12-11,1.86,
+1RUR,2003-12-11,1.5,
+1RZ7,2003-12-24,2.0,
+1RZ8,2003-12-24,2.3,
+1RZF,2003-12-24,1.7,
+1RZG,2003-12-24,2.0,
+1RZI,2003-12-24,2.9,
+1S3K,2004-01-13,1.9,
+1S5I,2004-01-21,2.7,
+1S7Q,2004-01-30,1.99,
+1S7R,2004-01-30,2.95,
+1S7S,2004-01-30,1.99,
+1S7T,2004-01-30,2.3,
+1S7U,2004-01-30,2.2,
+1S7V,2004-01-30,2.2,
+1S7W,2004-01-30,2.4,
+1S7X,2004-01-30,2.41,
+1S8D,2004-02-02,2.2,
+1S9V,2004-02-05,2.22,
+1S9W,2004-02-05,2.2,
+1S9X,2004-02-05,2.5,
+1S9Y,2004-02-05,2.3,
+1SBB,1999-02-22,2.4,
+1SEQ,2004-02-18,1.78,
+1SHM,2004-02-26,1.9,
+1SJE,2004-03-03,2.45,
+1SJH,2004-03-03,2.25,
+1SJX,2004-03-04,2.2,
+1SK3,2004-03-04,2.8,
+1SK4,2004-03-04,1.65,
+1SMO,2004-03-09,1.47,
+1SS1,2004-03-23,,
+1SVZ,2004-03-30,1.89,
+1SXR,2004-03-31,1.56,
+1SYS,2004-04-01,2.4,
+1SYV,2004-04-02,1.7,
+1T04,2004-04-07,3.0,
+1T0M,2004-04-12,2.0,
+1T0N,2004-04-12,1.8,
+1T0P,2004-04-12,1.66,
+1T1W,2004-04-19,2.2,
+1T1X,2004-04-19,2.2,
+1T1Y,2004-04-19,2.0,
+1T1Z,2004-04-19,1.9,
+1T20,2004-04-19,2.2,
+1T21,2004-04-19,2.19,
+1T22,2004-04-19,2.2,
+1T2J,2004-04-21,1.5,
+1T2Q,2004-04-22,1.83,
+1T3F,2004-04-26,2.0,
+1T4K,2004-04-29,2.5,
+1T4Q,2004-04-30,2.1,
+1T5W,2004-05-05,2.4,
+1T5X,2004-05-05,2.5,
+1T66,2004-05-05,2.3,
+1T83,2004-05-11,3.0,
+1T89,2004-05-11,3.5,
+1T8C,2004-05-12,,
+1T8D,2004-05-12,,
+1TOO,2004-06-14,2.1,
+1TP0,2004-06-15,2.2,
+1TVB,2004-06-29,1.8,
+1TVH,2004-06-29,1.802,
+1TWE,2004-06-30,2.1,
+1TWM,2004-07-01,2.26,
+1TY0,2004-07-06,1.75,
+1TY2,2004-07-07,2.0,
+1TZG,2004-07-09,2.2,
+1TZH,2004-07-09,2.6,
+1TZI,2004-07-10,2.8,
+1U0Q,2004-07-14,1.6,
+1U3H,2004-07-21,2.42,
+1U58,2004-07-27,1.9,
+1U6A,2004-07-29,2.81,
+1U8H,2004-08-06,2.1,
+1U8I,2004-08-06,2.0,
+1U8J,2004-08-06,2.24,
+1U8K,2004-08-06,2.24,
+1U8L,2004-08-06,2.6,
+1U8M,2004-08-06,2.4,
+1U8N,2004-08-06,2.56,
+1U8O,2004-08-06,3.02,
+1U8P,2004-08-06,3.23,
+1U8Q,2004-08-06,2.24,
+1U91,2004-08-09,2.24,
+1U92,2004-08-09,2.24,
+1U93,2004-08-09,2.37,
+1U95,2004-08-09,2.24,
+1U9K,2004-08-09,1.76,
+1UB5,2003-03-30,2.0,
+1UB6,2003-03-30,2.12,
+1UCT,2003-04-21,2.1,
+1UFU,2003-06-10,3.0,
+1UGN,2003-06-17,1.8,
+1UJZ,2003-08-13,2.1,
+1UM4,2003-09-23,1.8,
+1UM5,2003-09-23,1.6,
+1UM6,2003-09-23,1.8,
+1UVQ,2004-01-22,1.8,
+1UWX,2004-02-12,2.2,
+1UYW,2004-03-03,2.0,
+1UZ6,2004-03-05,2.05,
+1UZ8,2004-03-05,1.8,
+1VDG,2004-03-22,2.8,
+1VER,2004-04-05,2.82,
+1VES,2004-04-05,2.18,
+1VF8,2004-04-09,1.31,
+1VGK,2004-04-27,2.06,
+1VPO,2004-11-15,2.15,
+1W0V,2004-06-14,2.27,
+1W0W,2004-06-14,2.11,
+1W2R,2004-07-08,,
+1W2S,2004-07-08,,
+1W72,2004-08-27,2.15,
+1WBX,2004-11-05,1.9,
+1WBY,2004-11-05,2.3,
+1WBZ,2004-11-05,2.0,
+1WCB,2004-11-12,2.5,
+1WGL,2004-05-28,,
+1WT5,2004-11-16,2.1,
+1WWL,2005-01-06,2.5,
+1WZ1,2005-02-21,1.85,
+1X7Q,2004-08-16,1.45,
+1X9Q,2004-08-24,1.5,
+1XAU,2004-08-26,1.8,
+1XCQ,2004-09-03,3.5,
+1XCT,2004-09-03,3.05,
+1XDD,2004-09-06,2.2,
+1XDG,2004-09-06,2.1,
+1XED,2004-09-10,1.9,
+1XEE,2004-09-10,,
+1XF3,2004-09-13,2.3,
+1XF4,2004-09-13,2.5,
+1XF5,2004-09-14,2.6,
+1XGP,2004-09-17,2.1,
+1XGQ,2004-09-17,2.1,
+1XGR,2004-09-17,2.1,
+1XGT,2004-09-17,2.1,
+1XGU,2004-09-17,2.1,
+1XGY,2004-09-17,2.71,
+1XH3,2004-09-17,1.48,
+1XR8,2004-10-14,2.3,
+1XT5,2004-10-21,1.15,
+1XUO,2004-10-26,1.8,
+1XXG,2004-11-05,2.2,
+1XZ0,2004-11-11,2.8,
+1Y0L,2004-11-15,2.5,
+1Y18,2004-11-17,2.8,
+1Y6K,2004-12-06,2.52,
+1Y6M,2004-12-06,2.8,
+1Y6N,2004-12-06,2.7,
+1YC7,2004-12-22,1.6,
+1YC8,2004-12-22,2.7,
+1YCK,2004-12-22,1.7,
+1YDP,2004-12-25,1.9,
+1YEI,1998-08-13,1.9,
+1YEJ,1998-08-13,1.85,
+1YEK,1998-08-13,2.1,
+1YJG,2005-01-14,2.22,
+1YMH,2005-01-21,2.6,
+1YMM,2005-01-21,3.5,
+1YN6,2005-01-23,2.2,
+1YN7,2005-01-24,2.2,
+1YNK,2005-01-24,2.1,
+1YNL,2005-01-24,1.7,
+1YNT,2005-01-25,3.1,
+1YPO,2005-01-31,3.0,
+1YPQ,2005-01-31,1.4,
+1YPU,2005-01-31,2.05,
+1YPZ,2005-01-31,3.4,
+1YQV,2005-02-02,1.7,
+1YUH,1996-01-30,3.0,
+1YXE,2005-02-21,,
+1YY8,2005-02-24,2.0,
+1Z2K,2005-03-08,,
+1Z5L,2005-03-18,2.2,
+1Z92,2005-03-31,2.8,
+1ZA6,2005-04-05,2.8,
+1ZAN,2005-04-06,1.7,
+1ZEA,2005-04-18,1.78,
+1ZGL,2005-04-21,2.8,
+1ZHB,2005-04-25,2.7,
+1ZHK,2005-04-26,1.6,
+1ZHL,2005-04-26,1.5,
+1ZIW,2005-04-27,2.1,
+1ZS8,2005-07-22,3.0,
+1ZSD,2005-05-24,1.7,
+1ZT1,2005-05-26,2.5,
+1ZT4,2005-05-26,3.0,
+1ZT7,2005-05-26,3.0,
+1ZVO,2005-06-02,,
+1ZVS,2005-06-02,2.8,
+2A0Z,2005-06-17,2.4,
+2A1W,2005-06-21,2.7,
+2A55,2005-06-30,,
+2A6D,2005-07-02,2.9,
+2A6I,2005-07-02,2.5,
+2A6J,2005-07-02,2.7,
+2A6K,2005-07-03,3.0,
+2A73,2005-07-04,3.3,
+2A74,2005-07-04,2.4,
+2A77,2005-07-04,1.8,
+2A83,2005-07-07,1.4,
+2A9M,2005-07-12,2.1,
+2A9N,2005-07-12,3.0,
+2AAB,2005-07-13,2.5,
+2ADG,2005-07-20,2.5,
+2ADI,2005-07-20,2.8,
+2ADJ,2005-07-20,2.9,
+2AEP,2005-07-23,2.1,
+2AGJ,2005-07-27,2.6,
+2AI0,2005-07-28,2.2,
+2AJ3,2005-08-01,2.03,
+2AJS,2005-08-02,1.7,
+2AJU,2005-08-02,1.5,
+2AJV,2005-08-02,1.5,
+2AJX,2005-08-02,1.85,
+2AJY,2005-08-02,2.1,
+2AJZ,2005-08-02,2.3,
+2AK1,2005-08-02,1.85,
+2AK4,2005-08-03,2.5,
+2AKR,2005-08-03,1.9,
+2AP2,1999-03-22,2.4,
+2APB,2005-08-16,1.8,
+2APF,2005-08-16,1.8,
+2APH,2005-08-16,2.1,
+2APT,2005-08-16,2.0,
+2APV,2005-08-16,1.9,
+2APW,2005-08-16,2.0,
+2APX,2005-08-16,1.8,
+2AQ1,2005-08-17,2.1,
+2AQ2,2005-08-17,1.8,
+2AQ3,2005-08-17,2.3,
+2ARJ,2005-08-19,2.88,
+2ATP,2005-08-25,2.4,
+2ATY,2005-08-26,,
+2AV1,2005-08-29,1.95,
+2AV7,2005-08-29,2.05,
+2AW2,2005-08-31,2.8,
+2AXH,2005-09-05,2.7,
+2AXJ,2005-09-05,2.65,
+2B0S,2005-09-14,2.3,
+2B1A,2005-09-15,2.348,
+2B1H,2005-09-15,2.0,
+2B2X,2005-09-19,2.2,
+2BC4,2005-10-18,2.27,
+2BCK,2005-10-19,2.8,
+2BDN,2005-10-20,2.53,
+2BJM,2005-02-04,2.15,
+2BL7,2005-03-02,2.2,
+2BMK,2005-03-14,2.3,
+2BO2,2005-04-07,2.6,
+2BOU,2005-04-14,1.9,
+2BOX,2005-04-14,2.5,
+2BRR,2005-05-11,1.95,
+2BVE,2005-06-27,2.2,
+2BX5,2005-07-22,2.7,
+2BZM,2005-08-18,,
+2C1O,2005-09-19,2.75,
+2C1P,2005-09-19,2.0,
+2CB3,2005-12-29,2.4,
+2CD0,1999-03-08,1.8,
+2CFE,2006-02-20,1.5,
+2CJU,2006-04-09,2.5,
+2CLV,2006-05-02,1.9,
+2CLZ,2006-05-03,1.9,
+2CMR,2006-05-11,2.0,
+2COQ,2005-05-18,2.1,
+2CPC,2005-05-19,,
+2CR2,2005-05-20,,
+2CRN,2005-05-20,,
+2CRY,2005-05-20,,
+2D03,2005-07-23,1.97,
+2D39,2005-09-26,1.9,
+2D3V,2005-10-03,1.85,
+2D4D,2005-10-17,2.1,
+2D4F,2005-10-18,1.7,
+2D7T,2005-11-29,1.7,
+2D9K,2005-12-10,,
+2DBG,2005-12-15,,
+2DDQ,2006-02-02,2.35,
+2DHK,2006-03-24,,
+2DHY,2006-03-27,,
+2DL2,1999-03-08,3.0,
+2DLF,1998-12-17,1.55,
+2DLI,1999-03-08,2.9,
+2DO4,2006-04-27,,
+2DQT,2006-05-30,1.8,
+2DQU,2006-05-30,1.7,
+2DRU,2006-06-15,2.6,
+2DTM,2006-07-13,2.25,
+2DTS,2006-07-14,2.2,
+2DYP,2006-09-15,2.5,
+2E27,2006-11-08,1.7,
+2E7L,2007-01-11,2.5,
+2EH7,2007-03-05,2.5,
+2EH8,2007-03-05,2.6,
+2EHF,2007-03-06,,
+2ESV,2005-10-27,2.6,
+2EYR,2005-11-09,2.4,
+2EYS,2005-11-09,2.21,
+2EYT,2005-11-09,2.6,
+2F08,2005-11-12,2.2,
+2F53,2005-11-25,2.1,
+2F54,2005-11-25,2.7,
+2F58,1998-10-23,2.8,
+2F74,2005-11-30,2.7,
+2F8O,2005-12-02,1.7,
+2FAT,2005-12-07,1.77,
+2FBO,2005-12-09,1.85,
+2FCB,1999-01-07,1.74,
+2FGW,1994-01-16,3.0,
+2FIK,2005-12-29,1.8,
+2FJF,2006-01-02,2.65,
+2FL5,2006-01-05,3.0,
+2FO4,2006-01-12,2.7,
+2FRG,2006-01-19,1.19,
+2FX7,2006-02-03,1.76,
+2FX8,2006-02-03,2.2,
+2FX9,2006-02-03,2.1,
+2FYY,2006-02-08,1.5,
+2FZ3,2006-02-09,1.9,
+2G2B,2006-02-15,,
+2G2R,2006-02-16,2.75,
+2G60,2006-02-23,1.85,
+2G75,2006-02-27,2.28,
+2G7I,2006-02-28,1.75,
+2G9H,2006-03-06,2.0,
+2GA0,2006-03-07,2.7,
+2GAZ,2006-03-09,2.61,
+2GCY,2006-03-14,2.5,
+2GIT,2006-03-29,1.7,
+2GJ6,2006-03-30,2.56,
+2GJJ,2006-03-31,2.1,
+2GJZ,2006-03-31,2.65,
+2GK0,2006-03-31,2.45,
+2GKI,2006-04-02,2.88,
+2GSG,2006-04-26,2.1,
+2GSI,2006-04-26,2.81,
+2GSX,2006-04-27,,
+2GT9,2006-04-27,1.75,
+2GTW,2006-04-28,1.548,
+2GTZ,2006-04-28,1.7,
+2GU9,2006-04-28,1.4,
+2GUO,2006-05-01,1.9,
+2GW5,2006-05-03,1.8,
+2H26,2006-05-18,1.8,
+2H2R,2006-05-19,1.5,
+2H2T,2006-05-19,1.3,
+2H32,2006-05-22,2.7,
+2H3N,2006-05-22,2.3,
+2H6P,2006-05-31,1.9,
+2HCI,2006-06-16,1.81,
+2HFF,2006-06-23,1.95,
+2HFG,2006-06-23,2.61,
+2HH0,2006-06-27,2.85,
+2HJK,2006-06-30,1.85,
+2HJL,2006-06-30,1.5,
+2HKF,2006-07-04,2.01,
+2HKH,2006-07-04,2.1,
+2HN7,2006-07-12,1.6,
+2HP4,2006-07-17,2.1,
+2HWZ,2006-08-02,1.8,
+2HYM,2006-08-07,,
+2I07,2006-08-10,4.0,
+2I24,2006-08-15,1.35,
+2I25,2006-08-15,1.8,
+2I26,2006-08-15,2.5,
+2I27,2006-08-15,1.92,
+2IAL,2006-09-08,1.92,
+2IAM,2006-09-08,2.8,
+2IAN,2006-09-08,2.8,
+2IC4,2006-09-12,,
+2ICC,2006-09-12,1.2,
+2ICE,2006-09-12,3.1,
+2ICF,2006-09-12,4.1,
+2ICW,2006-09-13,2.41,
+2IF7,2006-09-20,3.0,
+2IPK,2006-10-12,2.3,
+2IPT,2006-10-12,2.0,
+2IPU,2006-10-12,1.65,
+2IQ9,2006-10-13,2.3,
+2IQA,2006-10-13,2.0,
+2IT5,2006-10-19,2.4,
+2IT6,2006-10-19,1.95,
+2J4W,2006-09-07,2.5,
+2J5L,2006-09-18,2.9,
+2J6E,2006-09-28,3.0,
+2J8U,2006-10-27,2.88,
+2JA4,2006-11-21,2.21,
+2JB5,2006-12-03,2.8,
+2JB6,2006-12-03,2.85,
+2JCC,2006-12-21,2.5,
+2JG8,2007-02-09,2.05,
+2JG9,2007-02-09,1.9,
+2JJU,2008-04-22,1.19,
+2JJV,2008-04-22,1.8,
+2JKS,2008-08-29,1.9,
+2JOP,2007-03-19,,
+2JP0,2007-04-16,,
+2JRV,2007-06-29,,
+2JRW,2007-06-29,,
+2JSV,2007-07-16,,
+2JT9,2007-07-21,,
+2JVG,2007-09-20,,
+2JVH,2007-09-20,,
+2JWD,2007-10-09,,
+2JZP,2008-01-11,,
+2K3U,2008-05-16,,
+2KAC,2008-11-04,,
+2KDY,2009-01-20,,
+2KGY,2009-03-23,,
+2KJU,2009-06-10,,
+2KLK,2009-07-06,,
+2KMS,2009-08-04,,
+2KQ4,2009-10-27,,
+2KQM,2009-11-11,,
+2KQN,2009-11-11,,
+2KWD,2010-04-05,,
+2L9H,2011-02-09,,
+2LAG,2011-03-13,,
+2LKQ,2011-10-19,,
+2LMA,2011-11-29,,
+2LMS,2011-12-12,,
+2LNB,2011-12-20,,
+2LRA,2012-03-28,,
+2LS8,2012-04-23,,
+2LSQ,2012-05-04,,
+2M1W,2012-12-07,,
+2M1X,2012-12-07,,
+2M4F,2013-02-05,,
+2M5H,2013-02-25,,
+2M5V,2013-03-11,,
+2M63,2013-03-20,,
+2MAA,2013-07-02,,
+2MCP,1984-10-15,3.1,
+2MCR,2013-08-22,,
+2MCY,2013-08-27,,
+2MCZ,2013-08-27,,
+2MD0,2013-08-28,,
+2MIM,2013-12-15,,
+2MK3,2014-01-23,,
+2MK9,2014-02-04,,
+2MKA,2014-02-04,,
+2MKL,2014-02-10,,
+2MKW,2014-02-13,,
+2MMX,2014-03-20,,
+2MPA,1999-06-09,2.6,
+2MQG,2014-06-19,,
+2MTI,2014-08-19,,
+2MUA,2014-09-05,,
+2MUF,2014-09-09,,
+2MV8,2014-09-25,,
+2MV9,2014-09-25,,
+2N31,2015-05-19,,
+2N9K,2015-11-26,,
+2N9L,2015-11-30,,
+2NAN,2016-01-06,,
+2NDH,2016-05-27,,
+2NMS,2006-10-23,2.6,
+2NNA,2006-10-24,2.1,
+2NO8,2006-10-25,,
+2NOJ,2006-10-25,2.7,
+2NQC,2006-10-31,2.05,
+2NTF,2006-11-07,3.18,
+2NW2,2006-11-14,1.4,
+2NW3,2006-11-14,1.7,
+2NX5,2006-11-16,2.7,
+2O5X,2006-12-06,2.05,
+2O5Y,2006-12-06,2.85,
+2O5Z,2006-12-06,2.4,
+2O6Q,2006-12-08,2.5,
+2O6R,2006-12-08,2.3,
+2O6S,2006-12-08,1.5,
+2OCW,2006-12-21,,
+2OED,2006-12-29,,
+2OI9,2007-01-10,2.35,
+2OJE,2007-01-12,3.0,
+2OJZ,2007-01-15,2.73,
+2OL3,2007-01-18,2.9,
+2OLD,2007-01-19,2.6,
+2OMB,2007-01-21,2.9,
+2OMN,2007-01-22,2.2,
+2OP4,2007-01-26,2.85,
+2OQJ,2007-01-31,2.8,
+2OR7,2007-02-02,1.5,
+2OR8,2007-02-02,2.5,
+2OR9,2007-02-02,2.7,
+2ORB,2007-02-02,2.2,
+2OSL,2007-02-06,2.6,
+2OTP,2007-02-08,2.6,
+2OTT,2007-02-09,2.5,
+2OTU,2007-02-09,1.68,
+2OTW,2007-02-09,2.35,
+2P1Y,2007-03-06,2.42,
+2P24,2007-03-06,2.15,
+2P5E,2007-03-15,1.89,
+2P5W,2007-03-16,2.2,
+2PN5,2007-04-23,2.698,
+2PND,2007-04-24,1.0,
+2PTT,2007-05-08,1.63,
+2PTU,2007-05-08,2.38,
+2PTV,2007-05-08,1.66,
+2PW1,2007-05-10,2.6,
+2PW2,2007-05-10,2.55,
+2PXY,2007-05-14,2.23,
+2PYE,2007-05-16,2.3,
+2PYF,2007-05-16,2.2,
+2Q3A,2007-05-30,2.2,
+2Q6W,2007-06-05,2.25,
+2Q76,2007-06-06,2.0,
+2Q7Y,2007-06-07,1.95,
+2Q7Z,2007-06-08,,
+2Q86,2007-06-08,1.85,
+2Q87,2007-06-09,1.7,
+2Q8A,2007-06-10,2.4,
+2Q8B,2007-06-10,2.3,
+2QDN,2007-06-21,2.09,
+2QEJ,2007-06-26,3.2,
+2QFG,2007-06-27,,
+2QFH,2007-06-27,,
+2QHL,2007-07-02,1.56,
+2QJD,2007-07-06,2.44,
+2QL1,2007-07-12,2.534,
+2QMT,2007-07-16,1.05,
+2QOS,2007-07-20,1.81,
+2QQQ,2007-07-26,1.98,
+2QR0,2007-07-27,3.5,
+2QRI,2007-07-28,2.0,
+2QRS,2007-07-29,2.0,
+2QRT,2007-07-29,1.8,
+2QSC,2007-07-30,2.8,
+2QTE,2007-08-01,1.9,
+2QTJ,2007-08-02,,
+2QZD,2007-08-16,14.0,
+2QZF,2007-08-16,14.0,
+2QZH,2007-08-16,14.0,
+2R0W,2007-08-21,2.503,
+2R0Z,2007-08-21,2.096,
+2R1W,2007-08-23,1.7,
+2R1X,2007-08-23,1.6,
+2R1Y,2007-08-23,1.6,
+2R23,2007-08-24,1.65,
+2R2B,2007-08-24,1.6,
+2R2E,2007-08-24,2.4,
+2R2H,2007-08-25,2.0,
+2R2K,2007-08-26,3.25,
+2R32,2007-08-28,1.95,
+2R56,2007-09-03,2.8,
+2R90,2007-09-12,2.8,
+2R9U,2007-09-13,2.1,
+2RCJ,2007-09-20,,
+2RD7,2007-09-21,2.15,
+2RFX,2007-10-02,2.5,
+2RGS,2007-10-05,2.13,
+2RKQ,2007-10-17,1.5,
+2RLP,2007-07-28,,
+2RLQ,2007-07-29,,
+2RMM,2007-10-30,,
+2RPS,2008-07-28,,
+2RPV,2008-10-28,,
+2SPZ,1998-07-29,,
+2UUD,2007-03-02,2.9,
+2UWE,2007-03-20,2.4,
+2UWN,2007-03-22,2.35,
+2UX2,2007-03-26,1.8,
+2UYL,2007-04-10,2.5,
+2V17,2007-05-22,1.65,
+2V2W,2007-06-07,1.6,
+2V2X,2007-06-07,1.6,
+2V7H,2007-07-30,2.8,
+2V7N,2007-07-31,1.92,
+2V8E,2007-08-07,2.5,
+2VB5,2007-09-06,,
+2VE6,2007-10-17,2.65,
+2VH5,2007-11-19,2.7,
+2VL5,2008-01-08,2.1,
+2VLJ,2008-01-15,2.4,
+2VLK,2008-01-15,2.5,
+2VLL,2008-01-15,1.6,
+2VLM,2008-01-15,1.98,
+2VLR,2008-01-15,2.3,
+2VM6,2008-01-23,2.2,
+2VOK,2008-02-19,1.3,
+2VQ1,2008-03-10,2.5,
+2VUO,2008-05-27,1.95,
+2VWE,2008-06-23,3.4,
+2VXU,2008-07-10,2.36,
+2VXV,2008-07-10,1.49,
+2VXW,2008-07-12,1.7,
+2VYR,2008-07-28,2.0,
+2W0K,2008-08-19,2.35,
+2W0L,2008-08-19,2.2,
+2W59,2008-12-08,1.75,
+2W60,2008-12-16,1.5,
+2W65,2008-12-17,2.21,
+2W80,2009-01-08,2.35,
+2W81,2009-01-08,2.35,
+2W9D,2009-01-23,1.57,
+2W9E,2009-01-23,2.9,
+2WA0,2009-01-31,2.3,
+2WAH,2009-02-06,2.51,
+2WBJ,2009-03-02,3.0,
+2WCQ,2009-03-13,1.9,
+2WCR,2009-03-13,1.7,
+2WCY,2009-03-17,,
+2WII,2009-05-12,2.7,
+2WIN,2009-05-13,3.9,
+2WNP,2009-07-16,1.21,
+2WNU,2009-07-20,2.3,
+2WNV,2009-07-20,1.25,
+2WPT,2009-08-10,1.78,
+2WQR,2009-08-26,1.9,
+2WRY,2009-09-03,1.58,
+2WY7,2009-11-13,1.7,
+2WY8,2009-11-13,1.7,
+2X44,2010-01-28,2.6,
+2X4N,2010-02-02,2.34,
+2X4O,2010-02-02,2.3,
+2X4P,2010-02-02,2.3,
+2X4Q,2010-02-02,1.9,
+2X4R,2010-02-02,2.3,
+2X4S,2010-02-02,2.55,
+2X4T,2010-02-02,2.3,
+2X4U,2010-02-02,2.1,
+2X57,2010-02-05,2.1,
+2X5Y,2010-02-11,1.05,
+2X69,2010-02-15,2.65,
+2X6G,2010-02-17,2.18,
+2X6L,2010-02-17,2.602,
+2X6M,2010-02-18,1.62,
+2X70,2010-02-22,2.0,
+2X7A,2010-02-25,2.77,
+2X7L,2010-03-01,3.17,
+2X89,2010-03-07,2.16,
+2XA3,2010-03-29,1.5,
+2XA8,2010-03-30,2.42,
+2XCZ,2010-04-27,1.64,
+2XFX,2010-05-28,1.9,
+2XKN,2010-07-09,1.4,
+2XKS,2010-07-12,,
+2XKU,2010-07-12,,
+2XL4,2010-07-19,2.3,
+2XN9,2010-07-31,2.3,
+2XNA,2010-07-31,2.1,
+2XPG,2010-08-26,2.6,
+2XQB,2010-09-01,2.6,
+2XQW,2010-09-07,2.306,
+2XRA,2010-09-13,2.3,
+2XRB,2010-09-13,2.5,
+2XRC,2010-09-13,2.69,
+2XRD,2010-09-14,3.5,
+2XTM,2010-10-11,1.7,
+2XTN,2010-10-11,1.9,
+2XTO,2010-10-11,2.8,
+2XTP,2010-10-11,1.5,
+2XXC,2010-11-10,1.67,
+2XZ4,2010-11-23,1.72,
+2XZ8,2010-11-24,1.94,
+2XZA,2010-11-24,1.5,
+2XZC,2010-11-24,1.36,
+2XZQ,2010-12-01,2.4,
+2Y06,2010-11-30,2.5,
+2Y07,2010-11-30,2.4,
+2Y36,2010-12-18,2.7,
+2Y5T,2011-01-17,2.2,
+2Y7Q,2011-02-01,3.4,
+2Y7S,2011-02-01,1.9,
+2Y92,2011-02-11,3.01,
+2YBY,2011-03-30,1.58,
+2YEZ,2011-03-31,2.9,
+2YF2,2011-04-01,2.24,
+2YHF,2011-04-30,1.9,
+2YK1,2011-05-25,1.85,
+2YKL,2011-05-27,2.1,
+2YMX,2012-10-10,1.9,
+2YPA,2012-10-30,2.8,
+2YPB,2012-10-30,2.87,
+2YPK,2012-10-30,1.95,
+2YPV,2012-11-01,1.8,
+2YRP,2007-04-02,,
+2YUZ,2007-04-06,,
+2YWY,2007-04-23,2.71,
+2YWZ,2007-04-23,2.21,
+2YXF,2007-04-26,1.13,
+2YZ1,2007-05-02,1.4,
+2Z31,2007-05-30,2.7,
+2Z35,2007-06-01,2.2,
+2Z4Q,2007-06-22,2.3,
+2Z5V,2007-07-19,,
+2Z62,2007-07-22,1.7,
+2Z63,2007-07-22,2.0,
+2Z64,2007-07-22,2.84,
+2Z65,2007-07-22,2.7,
+2Z66,2007-07-22,1.9,
+2Z7X,2007-08-29,2.1,
+2Z80,2007-08-30,1.8,
+2Z81,2007-08-30,1.8,
+2Z82,2007-08-30,2.6,
+2Z8V,2007-09-11,2.35,
+2Z8W,2007-09-11,2.45,
+2Z91,2007-09-14,2.6,
+2Z92,2007-09-14,2.3,
+2Z93,2007-09-14,2.4,
+2Z9N,2007-09-21,3.2,
+2Z9T,2007-09-26,1.8,
+2ZCH,2007-11-08,2.83,
+2ZCK,2007-11-09,3.1,
+2ZCL,2007-11-09,3.25,
+2ZKH,2008-03-21,2.04,
+2ZOK,2008-05-22,2.1,
+2ZOL,2008-05-22,2.7,
+2ZPK,2008-07-16,1.8,
+2ZSV,2008-09-18,1.8,
+2ZSW,2008-09-18,2.8,
+2ZW0,2008-11-26,1.4,
+2ZW1,2008-11-26,1.6,
+32C2,1999-04-21,3.0,
+3A79,2009-09-20,2.9,
+3A7B,2009-09-20,2.53,
+3A7C,2009-09-20,2.4,
+3AAZ,2009-11-28,2.2,
+3AB0,2009-11-28,3.09,
+3AM8,2010-08-18,2.8,
+3ARB,2010-11-26,2.7,
+3ARD,2010-11-27,3.01,
+3ARE,2010-11-27,2.8,
+3ARF,2010-11-27,2.9,
+3ARG,2010-11-27,3.0,
+3AU1,2011-01-28,2.5,
+3AUV,2011-02-16,2.4,
+3AVE,2011-03-04,2.0,
+3AXL,2011-04-11,2.9,
+3AY4,2011-04-28,2.2,
+3B2D,2011-07-29,2.8,
+3B3I,2007-10-22,1.86,
+3B5G,2007-10-25,1.9,
+3B6S,2007-10-29,1.8,
+3B9K,2007-11-05,2.7,
+3B9V,2007-11-06,1.8,
+3BAE,2007-11-07,1.593,
+3BD3,2007-11-14,1.6,
+3BD4,2007-11-14,2.4,
+3BD5,2007-11-14,2.0,
+3BDB,2007-11-14,2.8,
+3BDX,2007-11-15,2.3,
+3BES,2007-11-20,2.2,
+3BEV,2007-11-20,2.1,
+3BEW,2007-11-20,2.6,
+3BGM,2007-11-27,1.6,
+3BH8,2007-11-28,1.65,
+3BH9,2007-11-28,1.7,
+3BHB,2007-11-28,2.2,
+3BI9,2007-11-30,2.95,
+3BIA,2007-11-30,2.2,
+3BIB,2007-11-30,2.5,
+3BIK,2007-11-30,2.65,
+3BIS,2007-11-30,2.64,
+3BJ9,2007-12-03,2.0,
+3BKC,2007-12-06,1.9,
+3BKJ,2007-12-06,1.59,
+3BKM,2007-12-07,1.6,
+3BKY,2007-12-07,2.61,
+3BO8,2007-12-17,1.8,
+3BOV,2007-12-17,1.77,
+3BP4,2007-12-18,1.85,
+3BP7,2007-12-18,1.8,
+3BPC,2007-12-18,1.85,
+3BQU,2007-12-20,3.0,
+3BT1,2007-12-27,2.8,
+3BT2,2007-12-27,2.5,
+3BUY,2008-01-03,2.6,
+3BVN,2008-01-07,2.55,
+3BW9,2008-01-08,1.75,
+3BWA,2008-01-08,1.3,
+3BXN,2008-01-14,1.864,
+3BZ4,2008-01-17,1.8,
+3BZE,2008-01-17,2.5,
+3BZF,2008-01-17,2.5,
+3C08,2008-01-18,2.15,
+3C2A,2008-01-24,2.1,
+3C2S,2008-01-25,2.3,
+3C2X,2008-01-26,1.83,
+3C5S,2008-02-01,2.0,
+3C6S,2008-02-05,1.8,
+3C8J,2008-02-12,2.6,
+3C8K,2008-02-12,2.9,
+3C9N,2008-02-18,1.87,
+3CC5,2008-02-24,1.91,
+3CCH,2008-02-25,2.6,
+3CCK,2008-02-26,1.8,
+3CDC,2008-02-26,1.53,
+3CDF,2008-02-26,1.53,
+3CDG,2008-02-26,3.4,
+3CDY,2008-02-27,2.43,
+3CFB,2008-03-03,1.6,
+3CFC,2008-03-03,1.7,
+3CFD,2008-03-03,2.5,
+3CFE,2008-03-03,2.99,
+3CFJ,2008-03-04,2.6,
+3CFK,2008-03-04,2.6,
+3CG9,2008-03-05,2.9,
+3CH1,2008-03-06,2.3,
+3CHN,2008-03-10,,
+3CIG,2008-03-11,2.66,
+3CII,2008-03-11,4.41,
+3CIQ,2008-03-11,2.9,
+3CK0,1999-06-14,3.0,
+3CLE,2008-03-18,2.5,
+3CLF,2008-03-18,2.0,
+3CM9,2008-03-21,,
+3CMO,2008-03-24,2.3,
+3COR,2008-03-29,3.1,
+3CPL,2008-03-31,2.5,
+3CU7,2008-04-16,3.105,
+3CUP,2008-04-16,3.09,
+3CVH,2008-04-18,2.9,
+3CVI,2008-04-18,1.8,
+3CXD,2008-04-24,2.8,
+3CZF,2008-04-29,1.2,
+3D0L,2008-05-01,2.35,
+3D0V,2008-05-02,2.05,
+3D18,2008-05-05,1.74,
+3D25,2008-05-07,1.3,
+3D2U,2008-05-08,2.21,
+3D34,2008-05-09,1.8,
+3D39,2008-05-09,2.81,
+3D3V,2008-05-12,2.8,
+3D5O,2008-05-16,2.8,
+3D69,2008-05-19,3.77,
+3D6G,2008-05-19,2.3,
+3DBX,2008-06-02,2.0,
+3DGG,2008-06-13,2.3,
+3DHJ,2008-06-18,2.0,
+3DHM,2008-06-18,1.8,
+3DIF,2008-06-20,2.4,
+3DJ9,2008-06-22,1.75,
+3DMM,2008-07-01,2.6,
+3DNK,2008-07-02,2.84,
+3DO3,2008-07-03,2.5,
+3DRO,2008-07-11,3.9,
+3DRQ,2008-07-11,2.0,
+3DRT,2008-07-11,3.3,
+3DSF,2008-07-12,2.8,
+3DTX,2008-07-16,2.1,
+3DUR,2008-07-17,1.86,
+3DUS,2008-07-17,1.95,
+3DUU,2008-07-17,1.95,
+3DV4,2008-07-18,1.95,
+3DV6,2008-07-18,1.95,
+3DVG,2008-07-18,2.6,
+3DVN,2008-07-18,2.7,
+3DWT,2008-07-23,2.9,
+3DX6,2008-07-23,1.701,
+3DX7,2008-07-23,1.6,
+3DX8,2008-07-23,2.1,
+3DX9,2008-07-24,2.75,
+3DXA,2008-07-23,3.5,
+3E2H,2008-08-05,3.8,
+3E3Q,2008-08-07,2.95,
+3E6F,2008-08-15,2.41,
+3E6H,2008-08-15,2.1,
+3E6J,2008-08-15,1.67,
+3E8U,2008-08-20,2.1,
+3EAK,2008-08-26,1.95,
+3ECB,2008-08-29,1.698,
+3EFD,2008-09-08,2.6,
+3EGS,2008-09-11,3.6,
+3EIP,1999-03-29,1.8,
+3EKC,2008-09-19,1.8,
+3EO0,2008-09-26,1.75,
+3EO9,2008-09-26,1.8,
+3EOT,2008-09-29,1.9,
+3EP1,2008-09-29,2.1,
+3ERY,2008-10-03,1.95,
+3ESU,2008-10-06,1.3,
+3ESV,2008-10-06,2.0,
+3ET9,2008-10-07,2.8,
+3EYF,2008-10-20,2.3,
+3EYO,2008-10-21,2.5,
+3EYQ,2008-10-21,2.4,
+3EYS,2008-10-21,1.95,
+3EYU,2008-10-21,2.71,
+3EYV,2008-10-22,2.5,
+3EZM,1998-12-15,1.5,
+3F12,2008-10-27,2.95,
+3F4M,2008-11-01,1.696,
+3F58,1998-10-23,2.8,
+3FCT,1999-06-13,2.4,
+3FEW,2008-12-01,2.45,
+3FF9,2008-12-02,1.8,
+3FFC,2008-12-03,2.8,
+3FJT,2008-12-15,2.5,
+3FMG,2008-12-22,3.4,
+3FN0,2008-12-22,1.8,
+3FN3,2008-12-23,2.7,
+3FO0,2008-12-27,2.5,
+3FO1,2008-12-27,2.2,
+3FO2,2008-12-27,2.18,
+3FO9,2008-12-29,1.9,
+3FOL,2008-12-30,2.5,
+3FOM,2008-12-30,2.1,
+3FON,2008-12-30,2.03,
+3FPR,2009-01-06,1.63,
+3FPT,2009-01-06,2.7,
+3FPU,2009-01-06,1.76,
+3FQN,2009-01-07,1.65,
+3FQR,2009-01-07,1.7,
+3FQT,2009-01-07,1.8,
+3FQU,2009-01-07,1.8,
+3FQW,2009-01-07,1.927,
+3FQX,2009-01-07,1.7,
+3FT2,2009-01-12,1.8,
+3FT3,2009-01-12,1.95,
+3FT4,2009-01-12,1.9,
+3FTG,2009-01-12,2.6,
+3FXI,2009-01-21,3.1,
+3FZU,2009-01-26,2.5,
+3G04,2009-01-27,2.55,
+3G08,2009-01-27,1.6,
+3G39,2009-02-02,1.55,
+3G5V,2009-02-05,2.001,
+3G5X,2009-02-05,2.3,
+3G5Y,2009-02-05,1.59,
+3G5Z,2009-02-05,2.6,
+3G6A,2009-02-06,2.1,
+3G6D,2009-02-06,3.2,
+3G6J,2009-02-06,3.1,
+3G7X,2009-02-11,1.55,
+3G8K,2009-02-12,2.0,
+3G8L,2009-02-12,2.5,
+3GAQ,2009-02-18,2.25,
+3GAU,2009-02-18,,
+3GAV,2009-02-18,,
+3GAW,2009-02-18,,
+3GBL,2009-02-20,2.1,
+3GGW,2009-03-02,1.7,
+3GHB,2009-03-03,2.25,
+3GHE,2009-03-03,2.4,
+3GIV,2009-03-06,2.0,
+3GIZ,2009-03-07,2.2,
+3GJE,2009-03-08,2.3,
+3GJF,2009-03-08,1.9,
+3GJZ,2009-03-09,2.1,
+3GK8,2009-03-10,2.0,
+3GKZ,2009-03-11,1.9,
+3GM0,2009-03-12,2.4,
+3GML,2009-03-14,1.7,
+3GMM,2009-03-14,1.8,
+3GMN,2009-03-14,1.7,
+3GMO,2009-03-14,1.6,
+3GMP,2009-03-14,1.7,
+3GMQ,2009-03-14,1.8,
+3GMR,2009-03-14,1.9,
+3GNM,2009-03-17,2.1,
+3GO1,2009-03-18,1.89,
+3GOD,2009-03-18,2.17,
+3GSN,2009-03-27,2.8,
+3GSO,2009-03-27,1.6,
+3GSQ,2009-03-27,2.12,
+3GSR,2009-03-27,1.95,
+3GSU,2009-03-27,1.8,
+3GSV,2009-03-27,1.9,
+3GSW,2009-03-27,1.81,
+3GSX,2009-03-27,2.1,
+3H3B,2009-04-16,2.45,
+3H3P,2009-04-16,2.7,
+3H7B,2009-04-24,1.88,
+3H8N,2009-04-29,2.5,
+3H9H,2009-04-30,2.0,
+3H9S,2009-04-30,2.7,
+3H9Y,2009-04-30,2.23,
+3H9Z,2009-04-30,2.45,
+3HA0,2009-04-30,2.8,
+3HAE,2009-05-01,2.9,
+3HC0,2009-05-05,1.9,
+3HC3,2009-05-05,1.72,
+3HC4,2009-05-05,1.62,
+3HCV,2009-05-06,1.95,
+3HE6,2009-05-07,2.9,
+3HE7,2009-05-08,2.8,
+3HG1,2009-05-13,3.0,
+3HI5,2009-05-18,2.5,
+3HKF,2009-05-23,2.5,
+3HMW,2009-05-29,3.0,
+3HNS,2009-06-01,2.0,
+3HNT,2009-06-01,1.8,
+3HNV,2009-06-01,2.0,
+3HPJ,2009-06-04,2.0,
+3HQA,2009-06-05,2.586,
+3HQB,2009-06-05,3.299,
+3HR5,2009-06-08,2.4,
+3HRZ,2009-06-10,2.2,
+3HS0,2009-06-10,3.0,
+3HUJ,2009-06-14,2.5,
+3HUP,2009-06-15,1.371,
+3HZK,2009-06-23,2.15,
+3HZM,2009-06-23,1.8,
+3HZV,2009-06-24,1.9,
+3HZY,2009-06-24,2.1,
+3I02,2009-06-24,2.6,
+3I2C,2009-06-29,2.8,
+3I6G,2009-07-07,2.201,
+3I6K,2009-07-07,2.8,
+3I6L,2009-07-07,2.4,
+3I75,2009-07-08,1.95,
+3I9G,2009-07-10,1.9,
+3IB4,2009-07-15,1.25,
+3IDG,2009-07-21,1.86,
+3IDI,2009-07-21,2.1,
+3IDJ,2009-07-21,2.24,
+3IDM,2009-07-21,2.24,
+3IDN,2009-07-21,2.25,
+3IDX,2009-07-22,2.5,
+3IDY,2009-07-22,3.2,
+3IE4,2009-07-22,1.45,
+3IET,2009-07-23,2.2,
+3IF1,2009-07-23,2.39,
+3IFL,2009-07-24,1.5,
+3IFN,2009-07-24,1.5,
+3IFO,2009-07-24,2.15,
+3IFP,2009-07-24,2.95,
+3IJH,2009-08-04,2.1,
+3IJS,2009-08-04,2.55,
+3IJY,2009-08-05,2.85,
+3IKC,2009-08-05,2.6,
+3ILP,2009-08-07,1.85,
+3ILQ,2009-08-07,2.05,
+3INO,2009-08-12,1.95,
+3INU,2009-08-12,2.5,
+3IT8,2009-08-27,2.8,
+3IU3,2009-08-29,2.9,
+3IU4,2009-08-29,1.75,
+3IXA,2009-09-03,2.1,
+3IXT,2009-09-04,2.75,
+3IY0,2009-04-07,12.5,
+3IY1,2009-04-09,18.0,
+3IY2,2009-04-09,18.0,
+3IY3,2009-04-09,11.1,
+3IY4,2009-04-09,11.7,
+3IY5,2009-04-09,18.0,
+3IY6,2009-04-09,12.0,
+3IY7,2009-04-09,14.0,
+3J0A,2011-06-02,26.0,
+3J24,2012-08-17,9.0,
+3J2X,2013-01-28,15.6,
+3J2Y,2013-01-28,14.9,
+3J2Z,2013-01-28,16.9,
+3J30,2013-01-28,16.0,
+3J3Z,2013-05-21,23.4,
+3J6J,2014-03-13,3.64,
+3J7E,2014-06-23,13.6,
+3J93,2014-12-02,8.8,
+3JBL,2015-09-05,4.7,
+3JTS,2009-09-14,2.801,
+3JTT,2009-09-14,2.8,
+3JUY,2009-09-15,2.5,
+3JVG,2009-09-16,2.2,
+3K2D,2009-09-30,2.6,
+3K3Q,2009-10-04,2.6,
+3K51,2009-10-06,2.45,
+3KAA,2009-10-19,3.002,
+3KCW,2009-10-22,2.0,
+3KDM,2009-10-23,1.5,
+3KGR,2009-10-29,1.8,
+3KJ4,2009-11-02,3.1,
+3KLA,2009-11-07,1.65,
+3KLS,2009-11-09,3.6,
+3KM9,2009-11-10,4.2,
+3KPH,2009-11-16,2.8,
+3KPL,2009-11-16,1.96,
+3KPM,2009-11-16,1.6,
+3KPN,2009-11-16,2.0,
+3KPO,2009-11-16,2.3,
+3KPP,2009-11-16,1.9,
+3KPR,2009-11-16,2.6,
+3KPS,2009-11-16,2.7,
+3KQG,2009-11-17,2.3,
+3KR3,2009-11-17,2.2,
+3KWW,2009-12-01,2.18,
+3KXF,2009-12-03,3.1,
+3KXV,2009-12-04,2.004,
+3KYK,2009-12-06,3.2,
+3KYM,2009-12-06,2.62,
+3KYN,2009-12-06,2.4,
+3KYO,2009-12-06,1.7,
+3KZJ,2009-12-08,1.65,
+3L1O,2009-12-14,2.0,
+3L3D,2009-12-16,1.8,
+3L3G,2009-12-16,2.1,
+3L3H,2009-12-17,2.7,
+3L3I,2009-12-17,1.7,
+3L3J,2009-12-17,2.4,
+3L3K,2009-12-17,2.6,
+3L3O,2009-12-17,3.405,
+3L5H,2009-12-21,3.6,
+3L5I,2009-12-22,1.9,
+3L5J,2009-12-22,3.042,
+3L5N,2009-12-22,7.536,
+3L5W,2009-12-22,2.0,
+3L5X,2009-12-22,1.9,
+3L7E,2009-12-28,2.5,
+3L7F,2009-12-28,2.6,
+3L95,2010-01-04,2.19,
+3L9J,2010-01-05,2.1,
+3LD8,2010-01-12,2.7,
+3LDB,2010-01-12,2.7,
+3LEF,2010-01-14,2.3,
+3LES,2010-01-15,2.77,
+3LEV,2010-01-15,2.5,
+3LEX,2010-01-15,1.97,
+3LEY,2010-01-15,1.99,
+3LF6,2010-01-15,1.9,
+3LF9,2010-01-16,2.0,
+3LG7,2010-01-19,2.5,
+3LH2,2010-01-21,2.65,
+3LHP,2010-01-22,2.7,
+3LKN,2010-01-27,2.0,
+3LKO,2010-01-27,1.8,
+3LKP,2010-01-27,1.8,
+3LKQ,2010-01-27,1.8,
+3LKR,2010-01-27,2.0,
+3LKS,2010-01-27,1.9,
+3LMJ,2010-01-30,2.2,
+3LN4,2010-02-01,1.296,
+3LN5,2010-02-02,1.9,
+3LN9,2010-02-02,1.8,
+3LQA,2010-02-08,3.4,
+3LQZ,2010-02-10,3.25,
+3LRG,2010-02-11,2.05,
+3LRH,2010-02-11,2.6,
+3LRS,2010-02-11,2.37,
+3LS4,2010-02-12,2.0,
+3LS5,2010-02-12,1.9,
+3LV3,2010-02-19,1.94,
+3LXX,2010-02-25,2.15,
+3M18,2010-03-04,1.95,
+3M19,2010-03-04,1.7,
+3M7O,2010-03-17,1.65,
+3M8O,2010-03-18,1.55,
+3MA7,2010-03-23,2.29,
+3MA9,2010-03-23,2.05,
+3MAC,2010-03-23,2.5,
+3MBE,2010-03-25,2.886,
+3MBX,2010-03-26,1.6,
+3MC0,2010-03-26,2.0,
+3MCK,2010-03-29,2.3,
+3MCL,2010-03-29,1.7,
+3MFF,2010-04-02,2.0,
+3MGO,2010-04-07,2.297,
+3MGT,2010-04-07,2.197,
+3MHD,2010-04-07,2.901,
+3MI8,2010-04-09,2.951,
+3MJ6,2010-04-12,2.19,
+3MJ7,2010-04-12,2.8,
+3MJ8,2010-04-12,2.94,
+3MJ9,2010-04-12,2.95,
+3MLR,2010-04-18,1.8,
+3MLS,2010-04-18,2.5,
+3MLT,2010-04-18,2.49,
+3MLU,2010-04-18,2.77,
+3MLV,2010-04-18,2.48,
+3MLW,2010-04-18,2.7,
+3MLX,2010-04-18,1.9,
+3MLY,2010-04-18,1.7,
+3MLZ,2010-04-18,2.99,
+3MME,2010-04-19,3.97,
+3MNV,2010-04-22,2.4,
+3MNW,2010-04-22,2.2,
+3MNZ,2010-04-22,1.8,
+3MO1,2010-04-22,1.8,
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+9BU8,2024-05-16,3.96,
+9C45,2024-06-03,3.2,
+9CBN,2024-06-19,3.33,
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+9CJ8,2024-07-05,3.74,
+9CK7,2024-07-08,3.45,
+9CK8,2024-07-08,3.04,
+9CO7,2024-07-16,3.32,
+9CO8,2024-07-16,2.99,
+9CO9,2024-07-16,3.44,
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+9CQ8,2024-07-19,3.45,
+9CZ7,2024-08-04,2.57,
+9CZA,2024-08-05,2.49,
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+9DWE,2024-10-09,2.8,
+9DZQ,2024-10-16,3.57,
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+9IJD,2024-06-22,2.76,
+9IJE,2024-06-22,2.34,
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+1GC1,1998-06-15,2.5,
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+1KWV,2002-01-30,2.0,
+1KWW,2002-01-30,1.9,
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+1KX1,2002-01-30,2.8,
+1KZA,2002-02-06,1.74,
+1KZB,2002-02-06,1.8,
+1KZC,2002-02-06,1.85,
+1KZD,2002-02-06,1.9,
+1KZE,2002-02-06,1.8,
+1NQ3,2003-01-21,2.2,
+1OSY,2003-03-20,1.7,
+1PYW,2003-07-09,2.1,
+1URL,2003-10-31,2.4,
+1XPH,2004-10-08,1.41,
+1YVH,2005-02-15,2.05,
+2AF5,2005-07-25,2.5,
+2F2L,2005-11-17,2.1,
+2FJG,2006-01-02,2.8,
+2FJH,2006-01-02,3.1,
+2GJ7,2006-03-30,5.0,
+2PO6,2007-04-25,3.2,
+2ZG1,2008-01-17,2.7,
+2ZG2,2008-01-17,2.85,
+2ZG3,2008-01-17,3.0,
+2ZX0,2008-12-19,1.9,
+2ZX1,2008-12-19,1.9,
+2ZX2,2008-12-19,1.8,
+2ZX3,2008-12-19,2.1,
+2ZX4,2008-12-19,2.7,
+3C22,2008-01-24,1.5,
+3C5Z,2008-02-01,2.55,
+3C60,2008-02-01,3.05,
+3C6L,2008-02-04,3.4,
+3K7U,2009-10-13,2.1,
+3K80,2009-10-13,2.4,
+3K81,2009-10-13,3.4,
+3L6F,2009-12-23,2.1,
+3RU8,2011-05-04,2.07,
+3S6C,2011-05-25,2.9,
+3STB,2011-07-09,2.5,
+3W11,2012-11-06,3.9,
+3W12,2012-11-06,4.301,
+3W13,2012-11-06,4.303,
+3ZDY,2012-12-03,2.45,
+3ZDZ,2012-12-03,2.75,
+3ZE0,2012-12-03,2.95,
+3ZE1,2012-12-03,3.0,
+3ZE2,2012-12-03,2.35,
+4BZ2,2013-07-23,2.03,
+4DK3,2012-02-03,2.76,
+4DK6,2012-02-03,2.65,
+4DKA,2012-02-03,1.97,
+4DTG,2012-02-21,1.8,
+4K12,2013-04-04,1.079,
+4K3J,2013-04-10,2.8,
+4OGA,2014-01-15,3.5,
+4R4F,2014-08-19,3.514,
+4R4H,2014-08-19,4.28,
+4R4N,2014-08-19,3.56,
+4RFO,2014-09-26,3.2,
+4S10,2015-01-07,2.614,
+4S1R,2015-01-14,3.214,
+4S1S,2015-01-14,3.39,
+4UTA,2014-07-18,3.0,
+5GS2,2016-08-13,3.592,
+5H5Z,2016-11-10,1.74,
+5H7C,2016-11-17,2.7,
+5KJR,2016-06-20,2.98,
+5KQV,2016-07-06,4.4,
+5UK4,2017-01-19,3.204,
+5UKB,2017-01-20,5.473,
+5W3O,2017-06-08,3.01,
+6C5H,2018-01-16,1.99,
+6C5J,2018-01-16,2.29,
+6Q1Z,2019-08-06,3.446,
+6Q20,2019-08-06,2.45,
+6Q23,2019-08-06,3.27,
+6U2F,2019-08-19,2.94,
+6U3I,2019-08-21,2.9,
+6VEP,2020-01-02,2.9,
+6WPW,2020-04-28,3.1,
+7JTR,2020-08-18,2.5,
+7M72,2021-03-26,2.4,
+7MTA,2021-05-13,4.1,
+7MTB,2021-05-13,4.0,
+7MX4,2021-05-18,1.73,
+7MXF,2021-05-19,2.0,
+7MXH,2021-05-19,2.11,
+7TQB,2022-01-26,3.1,
+7YIT,2022-07-18,3.3,
+8CX0,2022-05-19,2.7,
+8CX1,2022-05-19,3.3,
+8CX2,2022-05-19,3.2,
+8DF5,2022-06-21,2.7,
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+8EEU,2022-09-07,3.5,
+8EEV,2022-09-07,3.6,
+8GAB,2023-02-22,2.72,
+8J1Q,2023-04-13,3.3,
+8J26,2023-04-14,3.4,
+8T59,2023-06-12,2.0,
+8TS0,2023-08-10,1.7,
+8TTW,2023-08-15,2.96,
+8VRR,2024-01-22,2.36,
+8XGR,2023-12-15,3.2,
+8XSF,2024-01-09,2.16,
+8XSJ,2024-01-09,2.61,
+9JU1,2024-10-07,1.45,
+9KKU,2024-11-14,1.46,
+1FOE,2000-08-27,2.8,
+5H7D,2016-11-17,2.57,
+7V05,2022-05-09,3.4,
+8HA0,2022-10-26,2.62,
+8HAF,2022-10-26,3.25,
+8HAO,2022-10-26,3.76,
+8TOX,2023-08-04,2.3,
+5CTQ,2015-07-24,2.6,
+5CTR,2015-07-24,3.012,
+5CTT,2015-07-24,1.7,
+3Q1S,2010-12-17,2.15,
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+3S35,2011-05-17,2.2,
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+3S37,2011-05-17,2.7,
+3SE3,2011-06-10,4.0001,
+3SE4,2011-06-10,3.5001,
+3SQO,2011-07-05,2.7,
+3TBS,2011-08-08,2.49,
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+4ADF,2011-12-23,4.4,
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+4C56,2013-09-10,2.9,
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+4KRM,2013-05-16,2.655,
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+4MXV,2013-09-26,3.2,
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+4N90,2013-10-18,3.3,
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+4NKD,2013-11-12,3.303,
+4NKM,2013-11-12,3.71,
+4NKO,2013-11-12,3.496,
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+4NO3,2013-11-19,1.703,
+4NO5,2013-11-19,2.101,
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+4OD2,2014-01-09,3.2,
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+4RGM,2014-09-30,2.689,
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+6AD0,2018-07-28,3.9,
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+6LXJ,2020-02-11,2.903,
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+6MUG,2018-10-23,2.954,
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+2ADF,2005-07-20,1.9,
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+4JPK,2013-03-19,2.4,
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+4JPW,2013-03-19,2.904,
+4JR9,2013-03-21,2.6,
+4JRE,2013-03-21,2.8,
+4JZJ,2013-04-03,2.801,
+4JZN,2013-04-03,2.05,
+4JZO,2013-04-03,2.22,
+4L4T,2013-06-09,2.0,
+4L4V,2013-06-09,1.9,
+4L5F,2013-06-11,2.45,
+4LCW,2013-06-24,2.4,
+4LMQ,2013-07-10,2.773,
+4LSP,2013-07-23,2.15,
+4LSQ,2013-07-23,2.25,
+4LSR,2013-07-23,2.28,
+4LSS,2013-07-23,2.59,
+4LST,2013-07-23,2.55,
+4LSU,2013-07-23,2.3,
+4LSV,2013-07-23,3.0,
+4LVN,2013-07-26,2.25,
+4LVO,2013-07-26,2.26,
+4M5Z,2013-08-08,2.25,
+4M7L,2013-08-12,3.4,
+4MHH,2013-08-29,3.564,
+4MHJ,2013-08-29,6.98,
+4NCO,2013-10-24,4.7,
+4NM8,2013-11-14,4.0041,
+4NNP,2013-11-18,2.69,
+4NQV,2013-11-25,2.39,
+4NQX,2013-11-26,2.0,
+4NZR,2013-12-12,1.65,
+4NZT,2013-12-12,2.497,
+4O58,2013-12-19,2.7501,
+4O5I,2013-12-19,6.501,
+4OII,2014-01-19,3.0,
+4OLU,2014-01-25,2.202,
+4OLV,2014-01-25,2.5,
+4OLW,2014-01-25,2.709,
+4OLX,2014-01-25,2.2,
+4OLY,2014-01-25,2.351,
+4OLZ,2014-01-25,2.1,
+4OM0,2014-01-25,2.289,
+4OM1,2014-01-25,2.131,
+4OQT,2014-02-10,3.23,
+4ORZ,2014-02-12,2.0,
+4OT1,2014-02-13,2.11,
+4P59,2014-03-15,3.4,
+4P9H,2014-04-04,3.0,
+4PDC,2014-04-17,1.991,
+4PLK,2014-05-18,4.0,
+4PY8,2014-03-26,2.91,
+4Q0X,2014-04-02,2.9,
+4QKX,2014-06-10,3.3,
+4QYZ,2014-07-26,3.0303,
+4RFN,2014-09-26,3.21,
+4RWY,2014-12-08,2.128,
+4RX4,2014-12-08,3.45,
+4S1Q,2015-01-14,2.4,
+4TNV,2014-06-05,3.6,
+4TNW,2014-06-05,3.2,
+4TVP,2014-06-27,3.1,
+4UBD,2014-08-12,3.5,
+4UF7,2015-03-13,1.7,
+4UTB,2014-07-18,3.85,
+4UUJ,2014-07-29,2.4,
+4WEB,2014-09-09,2.4,
+4WJK,2014-09-30,1.85,
+4WK0,2014-10-01,1.78,
+4WK2,2014-10-01,2.5,
+4WK4,2014-10-01,2.5,
+4X42,2014-12-02,2.78,
+4XHJ,2015-01-05,3.156,
+4XI5,2015-01-06,3.9,
+4XMK,2015-01-14,3.179,
+4XMM,2015-01-14,7.384,
+4XNM,2015-01-15,2.51,
+4XNQ,2015-01-15,2.001,
+4XRC,2015-01-20,2.74,
+4XVS,2015-01-27,1.9,
+4XVT,2015-01-28,1.69,
+4Y5V,2015-02-12,2.604,
+4Y5X,2015-02-12,3.15,
+4Y5Y,2015-02-12,2.85,
+4YBL,2015-02-18,3.1,
+4YBQ,2015-02-19,3.27,
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+4YE4,2015-02-23,2.72,
+4YJZ,2015-03-03,2.72,
+4YK4,2015-03-03,2.8,
+4YWG,2015-03-20,2.998,
+4Z7N,2015-04-07,2.599,
+4Z7O,2015-04-07,2.85,
+4Z7Q,2015-04-07,2.7,
+4ZFF,2015-04-21,2.75,
+4ZFG,2015-04-21,2.27,
+4ZPT,2015-05-08,2.591,
+4ZPV,2015-05-08,3.2,
+4ZXB,2015-05-20,3.3,
+5A8H,2015-07-15,23.0,
+5AWW,2015-07-10,2.724,
+5BO1,2015-05-26,2.56,
+5BXF,2015-06-08,2.851,
+5C0R,2015-06-12,3.188,
+5C0S,2015-06-12,4.3,
+5CAY,2015-06-30,3.0,
+5CEZ,2015-07-08,3.031,
+5CJB,2015-07-14,2.398,
+5CJQ,2015-07-14,3.6,
+5CJS,2015-07-15,4.3,
+5CJX,2015-07-15,3.584,
+5DMI,2015-09-08,3.69,
+5DMJ,2015-09-08,2.79,
+5DO2,2015-09-10,2.409,
+5EN2,2015-11-09,1.821,
+5EOQ,2015-11-10,1.95,
+5EOR,2015-11-10,2.27,
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+5FCU,2015-12-15,1.85,
+5FHC,2015-12-21,6.704,
+5GMQ,2016-07-15,2.703,
+5GZN,2016-09-29,3.0,
+5GZO,2016-09-29,2.755,
+5H35,2016-10-20,2.642,
+5H77,2016-11-17,3.197,
+5HDB,2016-01-05,2.7012,
+5HDQ,2016-01-05,1.83,
+5HJ3,2016-01-12,3.3,
+5IES,2016-02-25,2.16,
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+5IHL,2016-02-29,3.3,
+5J3H,2016-03-30,3.27,
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+5JS9,2016-05-07,6.918,
+5JSA,2016-05-07,6.308,
+5JYL,2016-05-14,2.55,
+5JYM,2016-05-14,2.45,
+5JZI,2016-05-16,2.5,
+5KEL,2016-06-09,4.3,
+5KEM,2016-06-09,5.5,
+5KEN,2016-06-09,4.3,
+5KTE,2016-07-11,3.941,
+5KVD,2016-07-14,1.65,
+5KVE,2016-07-14,1.7,
+5KVF,2016-07-14,1.4,
+5KVG,2016-07-14,1.4,
+5KZP,2016-07-25,2.262,
+5LBS,2016-06-17,2.41,
+5LCV,2016-06-22,2.64,
+5N09,2017-02-02,3.9,
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+5T3X,2016-08-26,3.9,
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+5TJW,2016-10-05,3.231,
+5TOJ,2016-10-17,3.3,
+5TOK,2016-10-17,3.8,
+5TZN,2016-11-22,2.6,
+5U1F,2016-11-28,6.8,
+5U3J,2016-12-02,2.74,
+5U3K,2016-12-02,2.637,
+5U3L,2016-12-02,2.165,
+5U3M,2016-12-02,2.418,
+5U3N,2016-12-02,2.0,
+5U3O,2016-12-02,1.761,
+5U68,2016-12-07,3.083,
+5U7M,2016-12-12,3.025,
+5U7O,2016-12-12,3.031,
+5UDC,2016-12-26,3.45,
+5UDD,2016-12-26,4.3,
+5UG0,2017-01-06,3.4,
+5UGY,2017-01-10,2.801,
+5UJZ,2017-01-19,4.8,
+5UK0,2017-01-19,4.8,
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+5UK2,2017-01-19,4.8,
+5UM8,2017-01-26,3.935,
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+5USH,2017-02-13,2.3,
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+5UTY,2017-02-15,3.412,
+5V2A,2017-03-03,4.656,
+5V6L,2017-03-17,2.549,
+5V6M,2017-03-17,1.9,
+5V7J,2017-03-20,2.907,
+5V8L,2017-03-22,4.3,
+5V8M,2017-03-22,4.4,
+5VGJ,2017-04-11,3.456,
+5VIY,2017-04-17,6.2,
+5VJ6,2017-04-18,11.5,
+5VK2,2017-04-20,3.201,
+5VK6,2017-04-21,2.25,
+5VKE,2017-04-21,2.37,
+5VKH,2017-04-21,2.25,
+5VOB,2017-05-02,3.02,
+5VOC,2017-05-02,3.99,
+5VOD,2017-05-02,5.9,
+5W08,2017-05-30,2.6,
+5W0D,2017-05-30,1.899,
+5W0K,2017-05-31,3.1,
+5W1K,2017-06-03,3.99,
+5W1M,2017-06-03,3.91,
+5W23,2017-06-05,3.4,
+5W2B,2017-06-06,2.25,
+5W4L,2017-06-12,2.92,
+5W6D,2017-06-16,3.202,
+5W6G,2017-06-16,2.79,
+5WN9,2017-07-31,1.551,
+5WNA,2017-07-31,2.4,
+5WNB,2017-07-31,2.4,
+5X2M,2017-02-02,2.206,
+5X2N,2017-02-02,2.2,
+5X2O,2017-02-02,2.6,
+5X2P,2017-02-02,2.608,
+5X2Q,2017-02-02,2.6,
+5XBM,2017-03-20,3.501,
+5XHV,2017-04-24,3.35,
+5Y11,2017-07-19,2.1,
+5Y9C,2017-08-24,3.443,
+5Y9F,2017-08-24,3.35,
+5YHL,2017-09-28,4.2,
+5YWY,2017-11-30,3.2,
+6A0Z,2018-06-06,2.329,
+6A4K,2018-06-20,3.15,
+6AOD,2017-08-15,1.8,
+6B0N,2017-09-14,3.4,
+6B3M,2017-09-22,3.92,
+6B44,2017-09-25,2.9,
+6B46,2017-09-25,3.1,
+6B70,2017-10-03,3.7,
+6B9J,2017-10-10,2.9,
+6BCK,2017-10-20,2.7,
+6BF4,2017-10-25,2.382,
+6BLH,2017-11-10,2.0,
+6BLI,2017-11-10,2.12,
+6BP2,2017-11-21,3.172,
+6BRB,2017-11-30,2.82,
+6CE0,2018-02-09,4.602,
+6CMG,2018-03-05,2.7,
+6CMI,2018-03-05,2.72,
+6CVK,2018-03-28,2.38,
+6CWD,2018-03-30,3.33,
+6CWT,2018-03-30,3.151,
+6CXC,2018-04-02,3.9,
+6DFG,2018-05-14,4.42,
+6DFH,2018-05-14,3.85,
+6DZV,2018-07-05,4.2,
+6DZW,2018-07-05,4.3,
+6DZY,2018-07-05,4.1,
+6DZZ,2018-07-05,3.6,
+6E3H,2018-07-14,2.9,
+6E4X,2018-07-18,2.25,
+6E56,2018-07-19,2.0,
+6EA5,2018-08-02,4.75,
+6EA7,2018-08-02,4.25,
+6IEA,2018-09-13,2.0,
+6IEB,2018-09-13,2.409,
+6IEC,2018-09-13,3.2,
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+6IVZ,2018-12-04,2.4,
+6IW0,2018-12-04,3.6,
+6IW2,2018-12-04,2.9,
+6J5D,2019-01-10,1.8,
+6J5F,2019-01-10,1.801,
+6J5G,2019-01-10,3.291,
+6JMQ,2019-03-13,3.31,
+6JMR,2019-03-13,4.1,
+6JP7,2019-03-26,1.909,
+6KRZ,2019-08-22,3.05,
+6KS0,2019-08-22,2.79,
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+6KTR,2019-08-28,2.59775753879,
+6LBH,2019-11-14,3.7,
+6M3B,2020-03-03,2.2,
+6M3C,2020-03-03,3.7,
+6MAM,2018-08-28,4.1,
+6MFP,2018-09-11,3.0,
+6MFT,2018-09-12,2.315,
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+6MLM,2018-09-27,3.5,
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+6NIP,2018-12-31,4.16,
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+6NYP,2019-02-11,2.7,
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+6OKP,2019-04-14,3.28,
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+6P62,2019-05-31,3.57,
+6P65,2019-05-31,3.94,
+6P91,2019-06-09,4.0,
+6P95,2019-06-09,3.5,
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+6PCI,2019-06-17,4.12,
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+6PZW,2019-08-01,3.0,
+6PZY,2019-08-01,3.17,
+6PZZ,2019-08-01,3.6,
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+6U59,2019-08-27,3.86,
+6UBI,2019-09-11,1.903,
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+6UCF,2019-09-16,1.29,
+6UDA,2019-09-19,4.2,
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+6UMX,2019-10-10,2.79,
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+6UYD,2019-11-13,1.897,
+6UYE,2019-11-13,3.96,
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+6UYM,2019-11-13,2.848,
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+5XCX,2017-03-23,2.04,
+5XF0,2017-04-06,,
+5XGY,2017-04-18,2.45,
+5XHB,2017-04-20,1.9,
+5XHF,2017-04-20,3.205,
+5XHG,2017-04-20,1.76,
+5XJ3,2017-04-29,3.2,
+5XJ4,2017-04-29,2.3,
+5XJE,2017-05-01,2.4,
+5XJF,2017-05-01,2.5,
+5XKU,2017-05-09,1.78,
+5XLI,2017-05-10,1.696,
+5XMF,2017-05-15,2.1,
+5XMG,2017-05-15,2.8,
+5XMH,2017-05-15,2.8,
+5XMM,2017-05-15,2.9,
+5XO2,2017-05-25,2.201,
+5XOF,2017-05-28,1.963,
+5XOS,2017-05-31,1.697,
+5XOT,2017-05-31,2.787,
+5XOV,2017-05-31,2.684,
+5XP1,2017-05-31,2.88,
+5XPV,2017-06-05,1.9,
+5XPW,2017-06-05,2.003,
+5XQW,2017-06-07,2.2,
+5XQY,2017-06-07,2.9,
+5XRQ,2017-06-09,2.6,
+5XS3,2017-06-12,2.5,
+5XVN,2017-06-28,3.25,
+5XVO,2017-06-28,3.1,
+5XVP,2017-06-28,3.0,
+5XXY,2017-07-05,2.9,
+5XZ3,2017-07-11,1.86,
+5XZ4,2017-07-11,1.41,
+5Y2K,2017-07-26,2.1,
+5Y2M,2017-07-26,3.8,
+5Y3J,2017-07-29,1.81,
+5Y3K,2017-07-29,2.7,
+5Y3L,2017-07-29,2.6,
+5Y3M,2017-07-29,2.5,
+5Y3S,2017-07-30,2.451,
+5Y56,2017-08-07,2.653,
+5Y91,2017-08-22,1.901,
+5YAX,2017-09-02,2.5,
+5YC5,2017-09-06,2.71,
+5YD3,2017-09-11,1.35,
+5YD4,2017-09-11,1.35,
+5YD5,2017-09-11,1.96,
+5YFI,2017-09-21,1.848,
+5YLX,2017-10-20,2.2,
+5YMV,2017-10-22,2.197,
+5YMW,2017-10-22,1.997,
+5YOY,2017-10-31,2.727,
+5YSL,2017-11-14,2.5,
+5YUD,2017-11-21,4.28,
+5YUP,2017-11-22,1.81,
+5YWF,2017-11-29,2.206,
+5YWP,2017-11-29,4.6,
+5YXK,2017-12-05,1.9,
+5YXN,2017-12-06,2.03,
+5YXU,2017-12-07,2.7,
+5YY4,2017-12-07,1.59,
+5YZP,2017-12-15,1.581,
+5YZW,2017-12-15,2.001,
+5Z11,2017-12-22,2.35,
+5Z14,2017-12-25,2.8,
+5Z15,2017-12-25,2.9,
+5Z2C,2018-01-02,2.594,
+5Z4B,2018-01-10,,
+5Z7D,2018-01-28,4.5,
+5Z7Q,2018-01-30,1.85,
+5ZIA,2018-03-14,2.603,
+5ZLN,2018-03-28,2.3,
+5ZMJ,2018-04-04,1.81,
+5ZNG,2018-04-09,2.189,
+5ZSA,2018-04-28,2.5,
+5ZSB,2018-04-28,2.7,
+5ZSC,2018-04-28,2.2,
+5ZSD,2018-04-28,2.603,
+5ZSE,2018-04-28,2.201,
+5ZSF,2018-04-28,2.1,
+5ZSG,2018-04-28,2.3,
+5ZSH,2018-04-28,2.6,
+5ZSI,2018-04-28,2.7,
+5ZSJ,2018-04-28,2.4,
+5ZSL,2018-04-28,2.3,
+5ZSM,2018-04-28,2.5,
+5ZSN,2018-04-28,2.4,
+5ZV3,2018-05-09,2.093,
+6A0X,2018-06-06,2.3,
+6A2B,2018-06-10,2.8,
+6A3V,2018-06-17,3.391,
+6A3W,2018-06-17,2.0,
+6A67,2018-06-26,2.33,
+6A6H,2018-06-28,2.31,
+6A76,2018-07-02,1.5,
+6A77,2018-07-02,2.0,
+6A78,2018-07-02,2.1,
+6A79,2018-07-02,2.31,
+6A89,2018-07-06,2.11,
+6A97,2018-07-11,2.148,
+6A9K,2018-07-13,1.9,
+6AED,2018-08-04,3.797,
+6AEE,2018-08-04,3.303,
+6AL4,2017-08-07,2.45,
+6AL5,2017-08-07,3.0,
+6AM5,2017-08-09,2.394,
+6AMJ,2017-08-09,2.49,
+6AMM,2017-08-10,2.8,
+6AMT,2017-08-11,2.496,
+6AMU,2017-08-11,2.151,
+6ANA,2017-08-12,1.7,
+6AND,2017-08-12,1.75,
+6ANI,2017-08-13,2.4,
+6ANP,2017-08-14,2.45,
+6ANV,2017-08-14,2.265,
+6ANW,2017-08-14,2.486,
+6AO0,2017-08-15,2.35,
+6AO3,2017-08-15,1.76,
+6AO4,2017-08-15,2.901,
+6APB,2017-08-17,3.0,
+6APC,2017-08-17,1.7,
+6APD,2017-08-17,4.1,
+6APN,2017-08-17,2.22,
+6APO,2017-08-17,1.168,
+6APP,2017-08-17,1.75,
+6APQ,2017-08-17,1.9,
+6AQ7,2017-08-18,1.83,
+6ARP,2017-08-23,1.7,
+6ARQ,2017-08-23,2.88,
+6AT5,2017-08-27,1.5,
+6AT6,2017-08-28,1.417,
+6AT9,2017-08-28,2.9503,
+6ATF,2017-08-29,1.9,
+6ATG,2017-08-29,1.8,
+6ATI,2017-08-29,1.98,
+6ATT,2017-08-29,3.77,
+6ATZ,2017-08-29,2.7,
+6AU5,2017-08-30,2.484,
+6AVF,2017-09-02,2.028,
+6AVG,2017-09-02,2.6,
+6AVN,2017-09-03,2.5,
+6AXK,2017-09-07,2.103,
+6AXL,2017-09-07,2.4,
+6AXP,2017-09-07,2.484,
+6AYN,2017-09-08,2.48,
+6AYZ,2017-09-08,2.096,
+6AZ2,2017-09-09,2.477,
+6AZK,2017-09-11,2.477,
+6AZL,2017-09-11,2.482,
+6AZM,2017-09-11,1.6,
+6AZX,2017-09-13,2.1,
+6AZZ,2017-09-13,2.4,
+6B08,2017-09-14,2.2,
+6B0A,2017-09-14,2.5,
+6B0E,2017-09-14,3.3,
+6B0G,2017-09-14,1.9,
+6B0H,2017-09-14,2.7,
+6B0S,2017-09-15,1.95,
+6B0W,2017-09-15,1.9,
+6B3D,2017-09-21,2.271,
+6B5B,2017-09-29,5.2,
+6B5L,2017-09-29,2.4,
+6B5M,2017-09-29,1.79,
+6B5N,2017-09-29,1.98,
+6B5O,2017-09-29,2.194,
+6B5P,2017-09-29,2.297,
+6B5R,2017-09-29,1.775,
+6B5S,2017-09-29,1.983,
+6B5T,2017-09-29,2.222,
+6B6Z,2017-10-03,2.112,
+6B9Y,2017-10-11,2.14,
+6B9Z,2017-10-11,1.82,
+6BA5,2017-10-12,1.62,
+6BAE,2017-10-12,2.14,
+6BAH,2017-10-12,1.9,
+6BAN,2017-10-14,1.95,
+6BB4,2017-10-16,2.099,
+6BCS,2017-10-20,2.1,
+6BE2,2017-10-24,1.7,
+6BE3,2017-10-24,1.6,
+6BE4,2017-10-24,1.9,
+6BFQ,2017-10-26,2.6,
+6BFS,2017-10-26,2.0,
+6BFT,2017-10-27,2.55,
+6BGA,2017-10-27,2.307,
+6BHQ,2017-10-31,2.05,
+6BHY,2017-10-31,2.04,
+6BHZ,2017-10-31,1.75,
+6BI0,2017-10-31,2.057,
+6BI2,2017-10-31,1.801,
+6BIJ,2017-11-02,2.1,
+6BIL,2017-11-02,2.4,
+6BIN,2017-11-02,2.50000845062,
+6BIR,2017-11-02,2.3,
+6BIT,2017-11-03,2.191,
+6BIV,2017-11-03,2.9,
+6BIX,2017-11-03,2.2,
+6BIY,2017-11-03,2.05004900063,
+6BIZ,2017-11-03,2.1,
+6BJ2,2017-11-03,3.35,
+6BJ3,2017-11-03,1.898,
+6BJ8,2017-11-05,1.75,
+6BJZ,2017-11-07,1.45,
+6BKB,2017-11-08,2.799,
+6BKC,2017-11-08,2.6,
+6BKD,2017-11-08,3.25,
+6BLA,2017-11-09,1.55,
+6BLQ,2017-11-11,1.8,
+6BLR,2017-11-11,1.96,
+6BLX,2017-11-11,2.323,
+6BMH,2017-11-14,2.298,
+6BMK,2017-11-15,2.43,
+6BNK,2017-11-16,3.2,
+6BNL,2017-11-16,2.6,
+6BPB,2017-11-22,1.87,
+6BPD,2017-11-22,2.32,
+6BQB,2017-11-27,1.769,
+6BWV,2017-12-15,2.4,
+6BXA,2017-12-18,2.298,
+6BXC,2017-12-18,2.5,
+6BXD,2017-12-18,1.103,
+6BXE,2017-12-18,1.651,
+6BXP,2017-12-18,1.45,
+6BXQ,2017-12-18,1.58,
+6BZ4,2017-12-22,2.4,
+6BZU,2017-12-26,2.7,
+6BZV,2017-12-26,2.654,
+6BZW,2017-12-26,2.2,
+6BZY,2017-12-26,1.6,
+6C09,2017-12-28,2.95,
+6C15,2018-01-03,3.21,
+6C5M,2018-01-16,2.45,
+6C61,2018-01-17,2.43,
+6C68,2018-01-18,2.59,
+6C69,2018-01-18,1.937,
+6C6A,2018-01-18,2.45,
+6C6C,2018-01-18,2.08,
+6C6E,2018-01-18,2.18,
+6C6F,2018-01-18,1.67,
+6C6H,2018-01-18,2.0,
+6C6J,2018-01-18,1.79,
+6C6X,2018-01-19,1.99,
+6C6Y,2018-01-19,3.32,
+6C6Z,2018-01-19,2.1,
+6C80,2018-01-23,1.78,
+6C97,2018-01-25,2.0,
+6C98,2018-01-25,1.85,
+6C99,2018-01-25,2.0,
+6C9O,2018-01-28,1.2,
+6CA6,2018-01-29,2.43,
+6CA7,2018-01-29,1.643,
+6CA9,2018-01-29,2.702,
+6CB8,2018-02-02,3.8,
+6CBJ,2018-02-03,2.85,
+6CBP,2018-02-03,2.17,
+6CBV,2018-02-05,1.872,
+6CDM,2018-02-08,2.408,
+6CDO,2018-02-08,2.099,
+6CDP,2018-02-08,2.456,
+6CEZ,2018-02-13,2.399,
+6CFF,2018-02-14,2.396,
+6CH7,2018-02-22,3.8,
+6CH8,2018-02-22,4.1,
+6CH9,2018-02-22,4.85,
+6CHB,2018-02-22,6.801,
+6CHE,2018-02-22,1.1,
+6CHF,2018-02-22,2.4,
+6CJC,2018-02-26,2.575,
+6CJK,2018-02-26,1.795,
+6CJX,2018-02-27,2.44,
+6CK8,2018-02-27,2.05,
+6CKH,2018-02-28,2.1,
+6CNE,2018-03-08,1.2,
+6CNR,2018-03-08,2.09,
+6CNW,2018-03-09,0.92,
+6CO3,2018-03-10,2.384,
+6CPH,2018-03-13,1.7,
+6CPL,2018-03-13,2.45,
+6CPN,2018-03-13,2.0,
+6CPO,2018-03-13,2.4,
+6CPZ,2018-03-14,1.12,
+6CQJ,2018-03-15,2.75,
+6CQL,2018-03-15,2.4,
+6CQN,2018-03-15,2.5,
+6CQQ,2018-03-16,2.8,
+6CQR,2018-03-16,3.04,
+6CR1,2018-03-16,1.521,
+6CT7,2018-03-22,1.903,
+6CTE,2018-03-22,1.2,
+6CUG,2018-03-26,2.4,
+6CUH,2018-03-26,2.01,
+6CW6,2018-03-29,2.85,
+6CW9,2018-03-30,2.0,
+6CWB,2018-03-30,2.85,
+6CWE,2018-03-30,2.2,
+6CWG,2018-03-30,2.6,
+6CWK,2018-03-30,1.256,
+6CX5,2018-04-02,2.4,
+6CX7,2018-04-02,2.6,
+6CX9,2018-04-02,2.36,
+6CXA,2018-04-02,2.65,
+6CXE,2018-04-02,2.05,
+6CXF,2018-04-02,2.5,
+6CXG,2018-04-03,2.298,
+6CXL,2018-04-03,3.586,
+6CXO,2018-04-03,2.2,
+6CY7,2018-04-04,2.2,
+6CYF,2018-04-05,2.78,
+6CYW,2018-04-06,1.95,
+6D01,2018-04-09,3.2,
+6D0X,2018-04-11,1.849,
+6D11,2018-04-11,3.4,
+6D29,2018-04-13,1.88,
+6D2B,2018-04-13,2.04,
+6D2P,2018-04-13,2.6,
+6D2R,2018-04-13,1.83,
+6D2T,2018-04-13,1.9,
+6D48,2018-04-17,1.776,
+6D49,2018-04-17,1.801,
+6D4A,2018-04-17,1.751,
+6D4E,2018-04-18,2.8,
+6D4I,2018-04-18,2.95,
+6D4M,2018-04-18,3.47,
+6D4N,2018-04-18,3.25,
+6D58,2018-04-19,2.39,
+6D64,2018-04-20,1.7,
+6D78,2018-04-24,2.347,
+6D7G,2018-04-24,2.75,
+6D9G,2018-04-29,2.3,
+6DB5,2018-05-02,2.599,
+6DB6,2018-05-02,1.978,
+6DB7,2018-05-02,2.213,
+6DBA,2018-05-02,1.3,
+6DBD,2018-05-03,1.755,
+6DBE,2018-05-03,1.65,
+6DBF,2018-05-03,1.55,
+6DBG,2018-05-03,1.51,
+6DC3,2018-05-04,3.501,
+6DC4,2018-05-04,1.7,
+6DC5,2018-05-04,3.5,
+6DC7,2018-05-04,1.901,
+6DC8,2018-05-04,1.799,
+6DC9,2018-05-04,2.999,
+6DCA,2018-05-04,2.599,
+6DCV,2018-05-08,1.9,
+6DCW,2018-05-08,2.0,
+6DDM,2018-05-10,1.3,
+6DDR,2018-05-10,1.9,
+6DDV,2018-05-10,2.05,
+6DE7,2018-05-11,4.123,
+6DEZ,2018-05-13,3.2,
+6DF0,2018-05-13,2.3,
+6DF1,2018-05-13,2.3,
+6DF2,2018-05-13,2.6,
+6DFI,2018-05-14,2.48,
+6DFJ,2018-05-14,2.07,
+6DFQ,2018-05-15,2.6,
+6DFS,2018-05-15,3.1,
+6DFV,2018-05-15,1.71,
+6DFW,2018-05-15,3.2,
+6DFX,2018-05-15,2.03,
+6DG2,2018-05-16,1.96,
+6DHB,2018-05-19,1.7,
+6DIG,2018-05-23,2.0,
+6DKP,2018-05-30,2.966,
+6DL8,2018-05-31,3.805,
+6DLA,2018-05-31,2.004,
+6DLB,2018-05-31,2.2,
+6DLW,2018-06-03,3.9,
+6DN0,2018-06-05,2.0,
+6DNK,2018-06-06,1.95,
+6DRI,2018-06-11,,
+6DSI,2018-06-14,2.49,
+6DW2,2018-06-26,1.7,
+6DWA,2018-06-26,1.922,
+6DWC,2018-06-26,2.27,
+6DWI,2018-06-26,2.39,
+6DYX,2018-07-02,1.5,
+6DZN,2018-07-05,2.1,
+6DZR,2018-07-05,2.4,
+6E1I,2018-07-09,1.99,
+6E4Y,2018-07-18,2.24,
+6E4Z,2018-07-18,2.202,
+6E62,2018-07-23,2.7,
+6E63,2018-07-23,2.6,
+6E64,2018-07-23,3.15,
+6E65,2018-07-23,1.5,
+6E7D,2018-07-26,2.9,
+6E8V,2018-07-31,3.79,
+6E9G,2018-08-01,2.904,
+6E9H,2018-08-01,2.0,
+6E9I,2018-08-01,2.5,
+6E9K,2018-08-01,2.193,
+6E9Q,2018-08-01,3.4,
+6E9U,2018-08-01,2.295,
+6EAQ,2018-08-03,2.22,
+6EDU,2018-08-11,4.06,
+6EH4,2017-09-12,1.26,
+6EH5,2017-09-12,1.29,
+6EH6,2017-09-12,1.78,
+6EH7,2017-09-12,1.89,
+6EH8,2017-09-12,2.51,
+6EH9,2017-09-12,2.49,
+6EHG,2017-09-13,2.65,
+6EHV,2017-09-15,2.54,
+6EHW,2017-09-15,2.19,
+6EHX,2017-09-15,2.2,
+6EHY,2017-09-15,2.25,
+6EI2,2017-09-16,1.61,
+6ELC,2017-09-28,1.41,
+6ELE,2017-09-28,1.78,
+6ELJ,2017-09-29,1.9,
+6ELL,2017-09-29,1.9,
+6EMJ,2017-10-02,2.3,
+6ENY,2017-10-07,5.8,
+6EQA,2017-10-12,3.16,
+6EQB,2017-10-12,2.81,
+6ERE,2017-10-18,2.25,
+6EV1,2017-11-01,3.043,
+6EV2,2017-11-01,2.403,
+6EWA,2017-11-03,2.39,
+6EWC,2017-11-03,3.2,
+6EWO,2017-11-06,2.3,
+6EYN,2017-11-13,2.4,
+6EYO,2017-11-13,3.7,
+6EZW,2017-11-16,1.59842847381,
+6F03,2017-11-17,2.2,
+6F0D,2017-11-19,1.90000753152,
+6F1E,2017-11-21,2.296,
+6F2Z,2017-11-27,2.3,
+6F7T,2017-12-11,2.6,
+6FAX,2017-12-18,2.99,
+6FCZ,2017-12-21,10.0,
+6FG1,2018-01-09,2.03,
+6FG2,2018-01-09,2.788,
+6FGB,2018-01-10,2.9,
+6FGM,2018-01-11,,
+6FGO,2018-01-11,2.5,
+6FL0,2018-01-25,2.9,
+6FMH,2018-01-31,2.8,
+6FOE,2018-02-07,2.6,
+6FPV,2018-02-12,1.64,
+6FR3,2018-02-15,1.35,
+6FR4,2018-02-15,1.28,
+6FR5,2018-02-15,1.37,
+6FR6,2018-02-15,2.98,
+6FR7,2018-02-15,2.31,
+6FR8,2018-02-15,2.38,
+6FR9,2018-02-15,1.62,
+6FRA,2018-02-15,1.73,
+6FRB,2018-02-15,1.75,
+6FRC,2018-02-15,1.59,
+6FRJ,2018-02-16,1.4,
+6FS1,2018-02-18,1.6,
+6FS2,2018-02-18,2.55,
+6FUM,2018-02-27,1.76,
+6FUN,2018-02-27,1.58,
+6FUO,2018-02-27,1.7,
+6FUP,2018-02-27,1.72,
+6FUQ,2018-02-27,1.6,
+6FUR,2018-02-27,1.73,
+6FXN,2018-03-09,2.9,
+6FY0,2018-03-10,2.57,
+6FY1,2018-03-10,3.132,
+6FY2,2018-03-10,2.301,
+6FY3,2018-03-10,2.6,
+6FZQ,2018-03-15,1.7,
+6FZR,2018-03-15,1.8,
+6G19,2018-03-20,3.68,
+6G1E,2018-03-21,1.88,
+6G1S,2018-03-21,3.93,
+6G1X,2018-03-22,3.93,
+6G3J,2018-03-26,2.45,
+6G3K,2018-03-26,2.9,
+6G9Q,2018-04-11,1.89,
+6G9R,2018-04-11,2.7,
+6GB5,2018-04-13,2.3,
+6GB6,2018-04-13,1.78,
+6GB7,2018-04-13,2.15,
+6GC2,2018-04-17,2.55,
+6GF2,2018-04-29,,
+6GFE,2018-04-30,1.8,
+6GFF,2018-04-30,3.1,
+6GGM,2018-05-03,2.734,
+6GH1,2018-05-04,2.1,
+6GH4,2018-05-04,2.16,
+6GHG,2018-05-07,1.88,
+6GHN,2018-05-08,2.542,
+6GJS,2018-05-16,1.95,
+6GJZ,2018-05-17,4.06,
+6GK2,2018-05-18,4.9,
+6GK7,2018-05-18,2.95,
+6GK8,2018-05-18,2.85,
+6GKH,2018-05-21,4.06,
+6GKM,2018-05-21,3.87,
+6GL1,2018-05-22,2.623,
+6GL3,2018-05-22,2.77,
+6GQ4,2018-06-07,1.65,
+6GRQ,2018-06-12,3.3,
+6GRS,2018-06-12,3.4,
+6GRT,2018-06-12,4.504,
+6GRZ,2018-06-13,2.1,
+6GZP,2018-07-04,2.1,
+6H03,2018-07-06,5.6,
+6H04,2018-07-06,5.6,
+6H06,2018-07-06,2.63,
+6H0E,2018-07-09,1.95,
+6H2Y,2018-07-17,2.65,
+6H3H,2018-07-18,1.92,
+6H4K,2018-07-21,2.05,
+6H61,2018-07-25,4.02,
+6H66,2018-07-26,4.16,
+6H6A,2018-07-26,2.0,
+6H6D,2018-07-27,2.4,
+6H6H,2018-07-27,2.4,
+6H7J,2018-07-31,2.8,
+6H7L,2018-07-31,2.7,
+6H7M,2018-07-31,2.76,
+6H7N,2018-07-31,2.5,
+6HBY,2018-08-13,1.95,
+6HG4,2018-08-22,3.32,
+6HG9,2018-08-23,3.62,
+6HGA,2018-08-23,2.6,
+6HGO,2018-08-23,2.1,
+6HGU,2018-08-23,1.5,
+6HIG,2018-08-29,2.2,
+6HKG,2018-09-06,1.87,
+6HXU,2018-10-18,1.19,
+6HXW,2018-10-18,2.78,
+6HYG,2018-10-21,2.31,
+6I04,2018-10-25,3.1,
+6I07,2018-10-25,2.35,
+6I8C,2018-11-20,1.92,
+6I8G,2018-11-20,2.344,
+6I8H,2018-11-20,3.682,
+6IAP,2018-11-27,2.9,
+6IAS,2018-11-27,1.75,
+6IBL,2018-11-30,2.7,
+6ID4,2018-09-08,2.4,
+6IDG,2018-09-10,2.0,
+6IDH,2018-09-10,2.5,
+6IDM,2018-09-10,3.2,
+6IEX,2018-09-17,2.314,
+6IF5,2018-09-18,2.0,
+6IFJ,2018-09-20,2.4,
+6IGU,2018-09-26,2.11,
+6II4,2018-10-03,3.3,
+6II8,2018-10-03,3.32,
+6II9,2018-10-03,3.5,
+6ILC,2018-10-17,2.2,
+6ILE,2018-10-17,2.9,
+6ILF,2018-10-17,2.7,
+6ILG,2018-10-18,2.6,
+6INN,2018-10-26,3.001,
+6INO,2018-10-26,3.054,
+6INU,2018-10-27,2.65,
+6INV,2018-10-27,3.3,
+6IOE,2018-10-30,2.9,
+6ION,2018-10-30,2.75,
+6IQG,2018-11-08,2.998,
+6IQH,2018-11-08,2.999,
+6IRL,2018-11-13,2.1,
+6ISA,2018-11-16,2.0,
+6ISB,2018-11-16,2.5,
+6ISC,2018-11-16,2.2,
+6ITP,2018-11-24,1.572,
+6ITQ,2018-11-24,1.526,
+6IUF,2018-11-28,2.052,
+6IUT,2018-11-30,2.3,
+6IUV,2018-11-30,2.332,
+6IWG,2018-12-05,1.8,
+6IWH,2018-12-05,1.95,
+6IZB,2018-12-19,1.899,
+6IZE,2018-12-19,2.29,
+6J14,2018-12-27,1.4,
+6J15,2018-12-27,2.6,
+6J1V,2018-12-29,2.0,
+6J1W,2018-12-29,1.501,
+6J29,2018-12-31,1.6,
+6J2A,2018-12-31,1.4,
+6J2D,2019-01-01,2.313,
+6J2E,2019-01-01,2.1,
+6J2F,2019-01-01,1.9,
+6J2G,2019-01-01,2.41,
+6J2H,2019-01-01,2.3,
+6J2I,2019-01-01,2.3,
+6J2J,2019-01-01,2.5,
+6J4I,2019-01-09,,
+6J7W,2019-01-18,2.6,
+6J8L,2019-01-19,2.3,
+6JB9,2019-01-25,1.15,
+6JBT,2019-01-26,2.47,
+6JC2,2019-01-27,2.65,
+6JJP,2019-02-26,2.9,
+6JLI,2019-03-06,1.778,
+6JOZ,2019-03-25,1.35,
+6JP3,2019-03-25,1.66,
+6JQ2,2019-03-28,2.4,
+6JQ3,2019-03-28,2.5,
+6JTN,2019-04-11,1.9,
+6JTO,2019-04-11,1.7,
+6JTP,2019-04-11,1.9,
+6JU0,2019-04-12,2.601,
+6JV7,2019-04-16,1.309,
+6JV8,2019-04-16,1.582,
+6JWC,2019-04-19,2.297,
+6JXR,2019-04-24,3.7,
+6K0Y,2019-05-08,1.7,
+6K4Z,2019-05-27,1.65,
+6K60,2019-05-31,3.149,
+6K7O,2019-06-08,3.004,
+6K7T,2019-06-08,1.6,
+6K7U,2019-06-08,1.601,
+6KA7,2019-06-21,3.0,
+6KDH,2019-07-02,2.47,
+6KDI,2019-07-02,2.7,
+6KI0,2019-07-16,2.0,
+6KIR,2019-07-19,1.55,
+6KIS,2019-07-19,1.54,
+6KIT,2019-07-19,1.57,
+6KMC,2019-07-31,1.84,
+6KMT,2019-08-01,2.6,
+6KMU,2019-08-01,2.1,
+6KMV,2019-08-01,3.35,
+6KMZ,2019-08-01,3.61,
+6KN0,2019-08-02,2.793,
+6KN1,2019-08-02,1.9,
+6KR0,2019-08-20,2.3,
+6KRU,2019-08-22,2.3,
+6KRV,2019-08-22,3.3,
+6KS2,2019-08-23,1.753,
+6KVA,2019-09-03,2.2,
+6KVF,2019-09-04,2.79,
+6KVM,2019-09-04,1.897,
+6KX0,2019-09-09,2.404,
+6KX1,2019-09-09,1.773,
+6KX9,2019-09-10,2.902,
+6KXG,2019-09-11,2.805,
+6KXS,2019-09-12,3.4,
+6KYA,2019-09-17,2.89,
+6KYV,2019-09-20,3.0,
+6L7Z,2019-11-03,,
+6L8T,2019-11-07,1.766,
+6L91,2019-11-07,1.842,
+6L98,2019-11-08,1.77,
+6L9B,2019-11-08,1.95,
+6L9D,2019-11-08,1.73,
+6L9K,2019-11-10,1.8,
+6L9L,2019-11-10,2.399,
+6L9M,2019-11-10,2.6,
+6L9N,2019-11-10,2.6,
+6LAH,2019-11-12,1.87,
+6LAM,2019-11-12,1.8,
+6LB2,2019-11-13,1.69380954073,
+6LBE,2019-11-14,2.6,
+6LCS,2019-11-19,2.6,
+6LDV,2019-11-23,1.9,
+6LDW,2019-11-23,1.6,
+6LDX,2019-11-23,1.8,
+6LDY,2019-11-23,1.77,
+6LFV,2019-12-03,1.9,
+6LFW,2019-12-03,1.41,
+6LFX,2019-12-03,1.43,
+6LHF,2019-12-08,2.7,
+6LHG,2019-12-08,2.8,
+6LHH,2019-12-08,2.71,
+6LIR,2019-12-12,2.091,
+6LJI,2019-12-16,1.843,
+6LKT,2019-12-20,1.8,
+6LNB,2019-12-28,3.18,
+6LNC,2019-12-28,3.21,
+6LRA,2020-01-15,1.9,
+6LT6,2020-01-21,2.15,
+6LTG,2020-01-22,1.63,
+6LUO,2020-01-30,2.302,
+6LUP,2020-01-30,2.302,
+6LVX,2020-02-06,2.77,
+6LVY,2020-02-06,2.6,
+6LVZ,2020-02-06,2.83,
+6LW0,2020-02-06,2.6,
+6LW1,2020-02-06,2.8,
+6LWT,2020-02-08,1.9,
+6LX3,2020-02-10,3.15,
+6LXW,2020-02-12,3.27,
+6LZ4,2020-02-18,2.49,
+6LZ9,2020-02-18,2.8,
+6M1B,2020-02-25,1.88,
+6M24,2020-02-26,2.29,
+6M2J,2020-02-27,2.2,
+6M2K,2020-02-27,2.59,
+6M58,2020-03-10,2.95,
+6M87,2018-08-21,2.609,
+6MB2,2018-08-29,5.0,
+6MB3,2018-08-29,3.37,
+6MED,2018-09-06,2.04,
+6MEE,2018-09-06,1.36,
+6MEF,2018-09-06,2.9,
+6MEG,2018-09-06,1.41,
+6MEH,2018-09-06,1.99,
+6MEI,2018-09-06,2.9,
+6MEJ,2018-09-06,2.8,
+6MEK,2018-09-06,3.1,
+6MF8,2018-09-10,,
+6MFF,2018-09-10,2.6,
+6MFG,2018-09-10,2.0,
+6MFJ,2018-09-11,2.62,
+6MG4,2018-09-12,1.75,
+6MG5,2018-09-12,1.8,
+6MGE,2018-09-13,2.95,
+6MGP,2018-09-14,2.13,
+6MH2,2018-09-17,2.8,
+6MHG,2018-09-17,3.57,
+6MHR,2018-09-18,2.8,
+6MI2,2018-09-19,2.72,
+6MIV,2018-09-20,2.05,
+6MIY,2018-09-20,2.75,
+6MJ3,2018-09-20,3.8,
+6MJ4,2018-09-20,2.0,
+6MJ6,2018-09-20,2.45,
+6MJA,2018-09-20,2.35,
+6MJI,2018-09-20,2.3,
+6MJJ,2018-09-21,1.93,
+6MJO,2018-09-21,1.9,
+6MKD,2018-09-25,3.2,
+6MKR,2018-09-26,3.355,
+6MNF,2018-10-01,2.758,
+6MNG,2018-10-01,2.662,
+6MNM,2018-10-02,3.1,
+6MNN,2018-10-02,2.83,
+6MNO,2018-10-02,2.9,
+6MNQ,2018-10-02,1.804,
+6MNR,2018-10-02,2.201,
+6MNS,2018-10-02,2.7,
+6MP0,2018-10-05,2.0,
+6MP1,2018-10-05,2.211,
+6MPP,2018-10-08,,
+6MQC,2018-10-09,1.99,
+6MQE,2018-10-09,2.459,
+6MQM,2018-10-10,3.484,
+6MQR,2018-10-10,2.45,
+6MQS,2018-10-10,2.997,
+6MRA,2018-10-12,1.7,
+6MSS,2018-10-18,3.0,
+6MSY,2018-10-18,1.999,
+6MT3,2018-10-19,1.21,
+6MT4,2018-10-19,1.55,
+6MT5,2018-10-19,1.55,
+6MT6,2018-10-19,1.31,
+6MTL,2018-10-19,1.35,
+6MTM,2018-10-19,3.0,
+6MTO,2018-10-21,2.634,
+6MTP,2018-10-21,2.036,
+6MTQ,2018-10-21,2.7,
+6MTR,2018-10-21,1.798,
+6MTS,2018-10-21,2.437,
+6MTT,2018-10-21,1.7,
+6MTX,2018-10-22,2.051,
+6MTY,2018-10-22,2.951,
+6MU3,2018-10-22,2.327,
+6MUA,2018-10-22,2.91,
+6MUB,2018-10-22,2.503,
+6MV5,2018-10-24,2.1,
+6MVL,2018-10-26,1.61,
+6MWR,2018-10-30,3.3,
+6MX0,2018-10-30,1.73,
+6MX3,2018-10-30,1.362,
+6MXR,2018-10-31,2.04,
+6MXS,2018-10-31,1.95,
+6MY4,2018-11-01,1.69,
+6MY5,2018-11-01,1.73,
+6MYD,2018-11-01,1.399,
+6N16,2018-11-08,2.302,
+6N2U,2018-11-14,1.254,
+6N2X,2018-11-14,3.0,
+6N32,2018-11-14,2.2,
+6N35,2018-11-14,1.747,
+6N77,2018-11-27,1.64,
+6N78,2018-11-27,1.83,
+6N79,2018-11-27,2.27,
+6N7A,2018-11-27,1.33,
+6N7B,2018-11-27,1.81,
+6N7C,2018-11-27,1.69,
+6N7D,2018-11-27,1.78,
+6N7U,2018-11-28,2.03,
+6N81,2018-11-28,2.579,
+6N8D,2018-11-29,3.1,
+6N9N,2018-12-03,3.3,
+6N9O,2018-12-03,3.5,
+6N9P,2018-12-03,2.23,
+6N9T,2018-12-04,2.576,
+6NB5,2018-12-06,3.0,
+6NB8,2018-12-06,1.5,
+6NC2,2018-12-10,5.2,
+6NC3,2018-12-10,4.5,
+6NCA,2018-12-11,3.30000082539,
+6NCP,2018-12-11,2.76,
+6NEX,2018-12-18,2.15,
+6NF2,2018-12-18,3.7,
+6NF7,2018-12-19,2.9,
+6NFN,2018-12-20,2.63,
+6NG3,2018-12-21,2.88,
+6NG9,2018-12-21,1.954,
+6NGG,2018-12-21,1.95,
+6NHA,2018-12-21,2.381,
+6NHW,2018-12-24,,
+6NHY,2018-12-24,,
+6NIH,2018-12-27,2.3,
+6NIJ,2018-12-29,5.7,
+6NIS,2018-12-31,2.113,
+6NIX,2019-01-01,2.1,
+6NM6,2019-01-10,2.739,
+6NMR,2019-01-11,2.42,
+6NMS,2019-01-11,2.11,
+6NMT,2019-01-11,1.83,
+6NMU,2019-01-11,2.55,
+6NMV,2019-01-11,2.61,
+6NNF,2019-01-14,2.762,
+6NNJ,2019-01-15,2.6,
+6NNV,2019-01-15,1.92,
+6NOJ,2019-01-16,2.33,
+6NOS,2019-01-16,2.701,
+6NOU,2019-01-16,1.914,
+6NOV,2019-01-16,2.14,
+6NP9,2019-01-17,1.27,
+6NPR,2019-01-18,2.37,
+6NPY,2019-01-18,3.8,
+6NRY,2019-01-24,2.184,
+6NS7,2019-01-24,2.4,
+6NT5,2019-01-28,4.1,
+6NT6,2019-01-28,4.0,
+6NT7,2019-01-28,4.0,
+6NT8,2019-01-28,6.5,
+6NT9,2019-01-28,3.3,
+6NUX,2019-02-03,2.2,
+6NYH,2019-02-11,2.1,
+6NYQ,2019-02-12,1.85,
+6NZ7,2019-02-13,2.95,
+6O23,2019-02-22,2.0,
+6O24,2019-02-22,1.4,
+6O25,2019-02-22,2.9,
+6O26,2019-02-22,1.8,
+6O28,2019-02-22,1.93,
+6O29,2019-02-22,2.4,
+6O2A,2019-02-22,2.15,
+6O2B,2019-02-22,2.1,
+6O2C,2019-02-22,2.017,
+6O3D,2019-02-26,1.402,
+6O3G,2019-02-26,3.645,
+6O3J,2019-02-26,3.416,
+6O3K,2019-02-26,1.451,
+6O3L,2019-02-26,1.98,
+6O3O,2019-02-27,2.8,
+6O3U,2019-02-27,3.105,
+6O41,2019-02-27,2.465,
+6O42,2019-02-27,2.6,
+6O4Y,2019-03-01,1.58,
+6O4Z,2019-03-01,1.5,
+6O51,2019-03-01,1.55,
+6O53,2019-03-01,1.4,
+6O6S,2019-03-07,2.65,
+6O6T,2019-03-07,2.31,
+6O6Y,2019-03-07,1.96,
+6O6Z,2019-03-07,2.1,
+6O70,2019-03-07,2.3,
+6O73,2019-03-07,3.0,
+6O74,2019-03-07,2.71,
+6O7D,2019-03-07,2.81,
+6O89,2019-03-09,2.09,
+6O8B,2019-03-09,3.4,
+6O8C,2019-03-09,3.17,
+6O8D,2019-03-09,3.547,
+6O94,2019-03-13,1.98,
+6O95,2019-03-13,1.77,
+6O9B,2019-03-13,2.2,
+6O9C,2019-03-13,2.45,
+6O9D,2019-03-13,2.51,
+6O9H,2019-03-13,2.1,
+6O9I,2019-03-13,2.6,
+6OAW,2019-03-18,2.2,
+6OBD,2019-03-20,2.2,
+6OBZ,2019-03-21,1.73,
+6OC3,2019-03-21,2.85,
+6OC7,2019-03-22,1.296,
+6OC8,2019-03-22,2.109,
+6OCB,2019-03-22,2.1,
+6OE9,2019-03-27,1.94,
+6OED,2019-03-27,2.461,
+6OEJ,2019-03-27,3.45,
+6OEL,2019-03-27,3.1,
+6OFI,2019-03-29,3.85,
+6OGX,2019-04-03,2.77,
+6OHG,2019-04-05,2.385,
+6OJP,2019-04-11,2.17,
+6OKM,2019-04-14,2.1,
+6OKN,2019-04-14,3.25,
+6OKQ,2019-04-14,3.2,
+6OL5,2019-04-15,2.9,
+6OL6,2019-04-15,2.6,
+6OL7,2019-04-15,2.419,
+6OM1,2019-04-17,2.66,
+6OM2,2019-04-17,2.77,
+6OMG,2019-04-18,2.1,
+6OO0,2019-04-22,2.1,
+6OOR,2019-04-23,2.45,
+6OPA,2019-04-24,4.084,
+6OPD,2019-04-24,1.791,
+6OSH,2019-05-01,1.117,
+6OSN,2019-05-01,1.083,
+6OSY,2019-05-02,4.3,
+6OT1,2019-05-02,3.5,
+6OVN,2019-05-08,1.77,
+6OVO,2019-05-08,2.49,
+6OZ2,2019-05-15,2.55,
+6OZ3,2019-05-15,3.15,
+6OZ4,2019-05-15,4.05,
+6P23,2019-05-20,1.595,
+6P27,2019-05-21,1.593,
+6P2C,2019-05-21,1.396,
+6P2F,2019-05-21,1.482,
+6P2S,2019-05-22,1.65,
+6P3B,2019-05-23,2.02,
+6P4C,2019-05-27,1.85,
+6P4Y,2019-05-29,1.799,
+6P50,2019-05-29,2.9,
+6P60,2019-05-31,2.498,
+6P64,2019-05-31,3.05,
+6P67,2019-06-03,2.9,
+6P6D,2019-06-03,2.31,
+6P79,2019-06-05,1.583,
+6P7H,2019-06-05,1.782,
+6P8D,2019-06-07,2.102,
+6P8M,2019-06-07,3.594,
+6P8N,2019-06-07,3.202,
+6P9H,2019-06-10,3.003,
+6P9I,2019-06-10,2.4,
+6P9J,2019-06-10,2.2,
+6P9N,2019-06-10,2.65,
+6PA1,2019-06-11,3.01,
+6PAG,2019-06-11,2.501,
+6PBH,2019-06-13,1.89,
+6PBV,2019-06-14,1.566,
+6PBW,2019-06-14,2.058,
+6PDR,2019-06-19,1.555,
+6PDS,2019-06-19,1.893,
+6PDU,2019-06-19,1.953,
+6PDX,2019-06-19,3.993,
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+6Y26,2020-02-15,1.2,
+6Y27,2020-02-15,1.38,
+6Y28,2020-02-15,1.69,
+6Y29,2020-02-15,1.28,
+6Y2A,2020-02-15,1.25,
+6Y2B,2020-02-15,1.37,
+6Y41,2020-02-19,1.79,
+6Y43,2020-02-19,1.6,
+6Y49,2020-02-19,1.65,
+6Y54,2020-02-24,2.67,
+6Y5D,2020-02-25,4.1,
+6Y5E,2020-02-25,3.15,
+6Y6C,2020-02-26,2.26,
+6YAX,2020-03-14,2.8,
+6YCR,2020-03-18,1.54,
+6YHQ,2020-03-30,1.89,
+6YIO,2020-04-01,1.83,
+6YJP,2020-04-04,3.1,
+6YMQ,2020-04-09,3.07,
+6YO6,2020-04-14,6.0,
+6YSC,2020-04-22,2.05,
+6YSQ,2020-04-23,3.3,
+6YT7,2020-04-24,1.55,
+6YTB,2020-04-24,1.65,
+6YXK,2020-05-03,2.0,
+6YXL,2020-05-03,2.1,
+6YXM,2020-05-03,2.85,
+6YYE,2020-05-04,3.36,
+6Z1O,2020-05-14,3.2,
+6Z1Z,2020-05-14,1.7,
+6Z2G,2020-05-15,1.95,
+6Z3K,2020-05-20,2.7,
+6Z3X,2020-05-22,1.74,
+6Z6V,2020-05-29,2.19,
+6Z9V,2020-06-04,2.01,
+6Z9W,2020-06-04,2.7,
+6Z9X,2020-06-04,2.68,
+6ZDX,2020-06-15,3.0,
+6ZEC,2020-06-16,1.65,
+6ZFO,2020-06-17,4.4,
+6ZH1,2020-06-20,2.2,
+6ZJG,2020-06-29,2.45,
+6ZJZ,2020-06-29,2.489,
+6ZKW,2020-06-30,2.26,
+6ZKX,2020-06-30,2.17,
+6ZKY,2020-06-30,2.65,
+6ZKZ,2020-06-30,2.3,
+6ZPP,2020-07-09,1.5,
+6ZTD,2020-07-18,3.43,
+6ZTF,2020-07-20,1.55,
+6ZTR,2020-07-20,2.1,
+6ZVF,2020-07-24,1.9,
+6ZWA,2020-07-28,1.68,
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+7AAH,2020-09-04,1.4,
+7AD6,2020-09-14,2.75,
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+7AJ6,2020-09-28,1.9,
+7AKK,2020-10-01,3.395,
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+7AMP,2020-10-09,2.64,
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+7AW6,2020-11-06,1.95,
+7AWE,2020-11-06,2.288,
+7B12,2020-11-23,2.43,
+7B1B,2020-11-24,4.23,
+7B1C,2020-11-24,3.74,
+7B1D,2020-11-24,3.41,
+7B2M,2020-11-27,3.39,
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+7BAG,2020-12-15,2.0,
+7BAH,2020-12-15,1.89,
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+7BBJ,2020-12-17,2.72,
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+7BST,2020-03-31,4.37,
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+7EDO,2021-03-16,2.7,
+7EH3,2021-03-28,,
+7EI1,2021-03-30,3.9,
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diff --git a/notebooks/immune_system_pdb_report_deposition_date.png b/notebooks/immune_system_pdb_report_deposition_date.png
new file mode 100644
index 00000000..b695c2bb
Binary files /dev/null and b/notebooks/immune_system_pdb_report_deposition_date.png differ
diff --git a/notebooks/immune_system_pdb_report_resolution.png b/notebooks/immune_system_pdb_report_resolution.png
new file mode 100644
index 00000000..04d8d8d2
Binary files /dev/null and b/notebooks/immune_system_pdb_report_resolution.png differ
diff --git a/notebooks/posebusters_benchmark_inference_results_plotting.ipynb b/notebooks/posebusters_benchmark_inference_results_plotting.ipynb
index 95acb197..b1cb48c4 100644
--- a/notebooks/posebusters_benchmark_inference_results_plotting.ipynb
+++ b/notebooks/posebusters_benchmark_inference_results_plotting.ipynb
@@ -68,6 +68,8 @@
     "    \"rfaa\",\n",
     "    \"chai-lab_ss\",\n",
     "    \"chai-lab\",\n",
+    "    \"boltz_ss\",\n",
+    "    \"boltz\",\n",
     "    \"alphafold3_ss\",\n",
     "    \"alphafold3\",\n",
     "]\n",
@@ -103,6 +105,7 @@
     "globals()[\"neuralplexer_output_dir\"] = os.path.join(\"..\", \"forks\", \"NeuralPLexer\", \"inference\")\n",
     "globals()[\"rfaa_output_dir\"] = os.path.join(\"..\", \"forks\", \"RoseTTAFold-All-Atom\", \"inference\")\n",
     "globals()[\"chai-lab_output_dir\"] = os.path.join(\"..\", \"forks\", \"chai-lab\", \"inference\")\n",
+    "globals()[\"boltz_output_dir\"] = os.path.join(\"..\", \"forks\", \"boltz\", \"inference\")\n",
     "globals()[\"alphafold3_output_dir\"] = os.path.join(\"..\", \"forks\", \"alphafold3\", \"inference\")\n",
     "for repeat_index in range(1, max_num_repeats_per_method + 1):\n",
     "    # PLIF metrics\n",
@@ -206,6 +209,34 @@
     "        )\n",
     "    )\n",
     "\n",
+    "    # Boltz (Single-Seq) results\n",
+    "    globals()[f\"boltz_ss_posebusters_bust_results_csv_filepath_{repeat_index}\"] = os.path.join(\n",
+    "        globals()[\"boltz_output_dir\"],\n",
+    "        f\"boltz_ss_posebusters_benchmark_outputs_{repeat_index}\",\n",
+    "        \"bust_results.csv\",\n",
+    "    )\n",
+    "    globals()[f\"boltz_ss_posebusters_relaxed_bust_results_csv_filepath_{repeat_index}\"] = (\n",
+    "        os.path.join(\n",
+    "            globals()[\"boltz_output_dir\"],\n",
+    "            f\"boltz_ss_posebusters_benchmark_outputs_{repeat_index}_relaxed\",\n",
+    "            \"bust_results.csv\",\n",
+    "        )\n",
+    "    )\n",
+    "\n",
+    "    # Boltz results\n",
+    "    globals()[f\"boltz_posebusters_bust_results_csv_filepath_{repeat_index}\"] = os.path.join(\n",
+    "        globals()[\"boltz_output_dir\"],\n",
+    "        f\"boltz_posebusters_benchmark_outputs_{repeat_index}\",\n",
+    "        \"bust_results.csv\",\n",
+    "    )\n",
+    "    globals()[f\"boltz_posebusters_relaxed_bust_results_csv_filepath_{repeat_index}\"] = (\n",
+    "        os.path.join(\n",
+    "            globals()[\"boltz_output_dir\"],\n",
+    "            f\"boltz_posebusters_benchmark_outputs_{repeat_index}_relaxed\",\n",
+    "            \"bust_results.csv\",\n",
+    "        )\n",
+    "    )\n",
+    "\n",
     "    # AlphaFold 3 (Single-Seq) results\n",
     "    globals()[f\"alphafold3_ss_posebusters_bust_results_csv_filepath_{repeat_index}\"] = (\n",
     "        os.path.join(\n",
@@ -245,6 +276,8 @@
     "    \"rfaa\": \"RFAA\",\n",
     "    \"chai-lab_ss\": \"Chai-1-Single-Seq\",\n",
     "    \"chai-lab\": \"Chai-1\",\n",
+    "    \"boltz_ss\": \"Boltz-1-Single-Seq\",\n",
+    "    \"boltz\": \"Boltz-1\",\n",
     "    \"alphafold3_ss\": \"AF3-Single-Seq\",\n",
     "    \"alphafold3\": \"AF3\",\n",
     "}\n",
@@ -257,6 +290,8 @@
     "    \"rfaa\": \"DL-based blind\",\n",
     "    \"chai-lab_ss\": \"DL-based blind\",\n",
     "    \"chai-lab\": \"DL-based blind\",\n",
+    "    \"boltz_ss\": \"DL-based blind\",\n",
+    "    \"boltz\": \"DL-based blind\",\n",
     "    \"alphafold3_ss\": \"DL-based blind\",\n",
     "    \"alphafold3\": \"DL-based blind\",\n",
     "}"
@@ -562,7 +597,7 @@
     "colors = [\"#AB8042\", \"#FB8072\", \"#BEBADA\", \"#FCCDE5\"]\n",
     "\n",
     "bar_width = 0.5\n",
-    "r1 = [item - 0.5 for item in range(2, 20, 2)]\n",
+    "r1 = [item - 0.5 for item in range(2, 24, 2)]\n",
     "r2 = [x + bar_width for x in r1]\n",
     "r3 = [x + bar_width for x in r2]\n",
     "\n",
@@ -954,7 +989,7 @@
     "\n",
     "# add labels, titles, ticks, etc.\n",
     "axis.set_ylabel(\"Percentage of predictions\")\n",
-    "axis.set_xlim(1, 19 + 0.1)\n",
+    "axis.set_xlim(1, 23 + 0.1)\n",
     "axis.set_ylim(0, 150)\n",
     "\n",
     "assert all(\n",
@@ -1100,7 +1135,7 @@
     "axis.grid(axis=\"y\", color=\"#EAEFF8\")\n",
     "axis.set_axisbelow(True)\n",
     "\n",
-    "axis.set_xticks([2, 2 + 1e-3, 4, 6, 8, 10, 11, 12, 14, 16, 18])\n",
+    "axis.set_xticks([2, 2 + 1e-3, 4, 6, 8, 10, 12, 13, 14, 16, 18, 20, 22])\n",
     "axis.set_xticks([1 + 0.1], minor=True)\n",
     "axis.set_xticklabels(\n",
     "    [\n",
@@ -1110,9 +1145,11 @@
     "        \"DynamicBind\",\n",
     "        \"NeuralPLexer\",\n",
     "        \"RFAA\",\n",
-    "        \"DL-based blind\",\n",
     "        \"Chai-1-Single-Seq\",\n",
+    "        \"DL-based blind\",\n",
     "        \"Chai-1\",\n",
+    "        \"Boltz-1-Single-Seq\",\n",
+    "        \"Boltz-1\",\n",
     "        \"AF3-Single-Seq\",\n",
     "        \"AF3\",\n",
     "    ]\n",
@@ -1126,7 +1163,7 @@
     "axis.tick_params(axis=\"y\", which=\"major\", left=\"off\", right=\"on\", color=\"#EAEFF8\")\n",
     "\n",
     "# vertical alignment of xtick labels\n",
-    "vert_alignments = [0.0, -0.1, 0.0, 0.0, 0.0, 0.0, -0.1, 0.0, 0.0, 0.0, 0.0]\n",
+    "vert_alignments = [0.0, -0.1, 0.0, 0.0, 0.0, 0.0, 0.0, -0.1, 0.0, 0.0, 0.0, 0.0, 0.0]\n",
     "for tick, y in zip(axis.get_xticklabels(), vert_alignments):\n",
     "    tick.set_y(y)\n",
     "\n",
diff --git a/notebooks/posebusters_benchmark_method_interaction_analysis.png b/notebooks/posebusters_benchmark_method_interaction_analysis.png
new file mode 100644
index 00000000..6f53c673
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diff --git a/notebooks/posebusters_benchmark_methods_generalization_analysis.png b/notebooks/posebusters_benchmark_methods_generalization_analysis.png
new file mode 100644
index 00000000..f9217ac3
Binary files /dev/null and b/notebooks/posebusters_benchmark_methods_generalization_analysis.png differ
diff --git a/notebooks/posebusters_benchmark_plif_emd_values.png b/notebooks/posebusters_benchmark_plif_emd_values.png
new file mode 100644
index 00000000..178233c3
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diff --git a/notebooks/posebusters_benchmark_plif_metrics.csv b/notebooks/posebusters_benchmark_plif_metrics.csv
new file mode 100644
index 00000000..296283be
--- /dev/null
+++ b/notebooks/posebusters_benchmark_plif_metrics.csv
@@ -0,0 +1,3389 @@
+,Category,Target,EMD,WM,Method_Histogram,Reference_Histogram
+0,P2Rank-Vina,8AAU_LH0,0.19047619047619052,0.9238095238095237,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1,P2Rank-Vina,7JHQ_VAJ,,0.0,,
+2,P2Rank-Vina,6ZCY_QF8,0.07692307692307687,0.9692307692307692,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+3,P2Rank-Vina,7UAW_MF6,0.75,0.7,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+4,P2Rank-Vina,6YMS_OZH,,0.0,,
+5,P2Rank-Vina,7UJ5_DGL,,0.0,,
+6,P2Rank-Vina,8EX2_Q2Q,0.08333333333333334,0.9666666666666667,"{'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1}","{'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+7,P2Rank-Vina,7R9N_F97,0.055555555555555525,0.9777777777777777,"{'UNL:ALA:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}"
+8,P2Rank-Vina,7UYB_OK0,,0.0,,
+9,P2Rank-Vina,7U0U_FK5,,0.0,,
+10,P2Rank-Vina,7ZU2_DHT,0.4,0.84,"{'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 6, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 6, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+11,P2Rank-Vina,6XHT_V2V,,0.0,,
+12,P2Rank-Vina,7OSO_0V1,,0.0,,
+13,P2Rank-Vina,8D19_GSH,0.5333333333333332,0.7866666666666667,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+14,P2Rank-Vina,7MGT_ZD4,0.47826086956521746,0.808695652173913,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+15,P2Rank-Vina,8C3N_ADP,0.12499999999999994,0.9500000000000001,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+16,P2Rank-Vina,6YYO_Q1K,,0.0,,
+17,P2Rank-Vina,8A1H_DLZ,,0.0,,
+18,P2Rank-Vina,7XQZ_FPF,0.22727272727272727,0.9090909090909091,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+19,P2Rank-Vina,7RH3_59O,0.21052631578947373,0.9157894736842105,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 1}"
+20,P2Rank-Vina,7OMX_CNA,0.09677419354838718,0.9612903225806452,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:HBAcceptor': 2, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 3, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+21,P2Rank-Vina,7LMO_NYO,0.3333333333333333,0.8666666666666667,"{'UNL:CYS:Hydrophobic': 2, 'UNL:CYS:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 3, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 4, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+22,P2Rank-Vina,7VBU_6I4,0.45,0.8200000000000001,"{'UNL:CYS:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+23,P2Rank-Vina,7TXK_LW8,,0.0,,
+24,P2Rank-Vina,7T1D_E7K,,0.0,,
+25,P2Rank-Vina,7R59_I5F,0.0,1.0,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+26,P2Rank-Vina,7ZCC_OGA,,0.0,,
+27,P2Rank-Vina,7V43_C4O,,0.0,,
+28,P2Rank-Vina,7BNH_BEZ,,0.0,,
+29,P2Rank-Vina,6WTN_RXT,0.5625,0.775,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+30,P2Rank-Vina,7QFM_AY3,0.3333333333333333,0.8666666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+31,P2Rank-Vina,7MSR_DCA,,0.0,,
+32,P2Rank-Vina,5SAK_ZRY,0.7857142857142856,0.6857142857142857,"{'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+33,P2Rank-Vina,7QTA_URI,,0.0,,
+34,P2Rank-Vina,7RSV_7IQ,,0.0,,
+35,P2Rank-Vina,8DSC_NCA,,0.0,,
+36,P2Rank-Vina,7AKL_RK5,0.15000000000000008,0.94,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3}"
+37,P2Rank-Vina,7XBV_APC,0.5789473684210527,0.7684210526315789,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+38,P2Rank-Vina,7CNS_PMV,0.55,0.78,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+39,P2Rank-Vina,7ZDY_6MJ,0.4444444444444444,0.8222222222222222,"{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 3}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+40,P2Rank-Vina,6Z4N_Q7B,,0.0,,
+41,P2Rank-Vina,7NFB_GEN,,0.0,,
+42,P2Rank-Vina,7R7R_AWJ,0.4117647058823529,0.8352941176470589,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+43,P2Rank-Vina,7V14_ORU,0.38888888888888895,0.8444444444444444,"{'UNL:ALA:Hydrophobic': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+44,P2Rank-Vina,6YR2_T1C,,0.0,,
+45,P2Rank-Vina,7JG0_GAR,0.2857142857142857,0.8857142857142857,"{'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:V:VdWContact': 1}"
+46,P2Rank-Vina,7EBG_J0L,1.0769230769230769,0.5692307692307692,"{'UNL:HIS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+47,P2Rank-Vina,8AY3_OE3,,0.0,,
+48,P2Rank-Vina,7M6K_YRJ,,0.0,,
+49,P2Rank-Vina,6YT6_PKE,0.29999999999999993,0.88,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+50,P2Rank-Vina,7Q27_8KC,,0.0,,
+51,P2Rank-Vina,8DHG_T78,,0.0,,
+52,P2Rank-Vina,8EXL_799,,0.0,,
+53,P2Rank-Vina,7FB7_8NF,,0.0,,
+54,P2Rank-Vina,7THI_PGA,0.3571428571428572,0.8571428571428571,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+55,P2Rank-Vina,6ZAE_ACV,0.18181818181818182,0.9272727272727272,"{'UNL:CYS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+56,P2Rank-Vina,7MGY_ZD1,,0.0,,
+57,P2Rank-Vina,7XPO_UPG,,0.0,,
+58,P2Rank-Vina,7SUC_COM,,0.0,,
+59,P2Rank-Vina,7BJJ_TVW,0.3333333333333333,0.8666666666666667,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+60,P2Rank-Vina,7K0V_VQP,0.923076923076923,0.6307692307692307,"{'UNL:ALA:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+61,P2Rank-Vina,7TE8_P0T,0.3478260869565217,0.8608695652173913,"{'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 3, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+62,P2Rank-Vina,7QF4_RBF,0.380952380952381,0.8476190476190476,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}"
+63,P2Rank-Vina,7UJ4_OQ4,0.28571428571428564,0.8857142857142858,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+64,P2Rank-Vina,7A9H_TPP,0.19230769230769224,0.9230769230769231,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+65,P2Rank-Vina,7LEV_0JO,,0.0,,
+66,P2Rank-Vina,7N6F_0I1,,0.0,,
+67,P2Rank-Vina,8EAB_VN2,,0.0,,
+68,P2Rank-Vina,6ZC3_JOR,,0.0,,
+69,P2Rank-Vina,7Q25_8J9,,0.0,,
+70,P2Rank-Vina,7C3U_AZG,0.4666666666666666,0.8133333333333334,"{'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2}"
+71,P2Rank-Vina,7ROR_69X,,0.0,,
+72,P2Rank-Vina,7MMH_ZJY,,0.0,,
+73,P2Rank-Vina,7TH4_FFO,,0.0,,
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+75,P2Rank-Vina,7YZU_DO7,0.27777777777777773,0.888888888888889,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 2}"
+76,P2Rank-Vina,5SB2_1K2,0.517241379310345,0.793103448275862,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+77,P2Rank-Vina,6M73_FNR,,0.0,,
+78,P2Rank-Vina,8B8H_OJQ,0.09677419354838712,0.9612903225806452,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 4}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}"
+79,P2Rank-Vina,7TOM_5AD,,0.0,,
+80,P2Rank-Vina,7VWF_K55,,0.0,,
+81,P2Rank-Vina,7XI7_4RI,0.13333333333333341,0.9466666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+82,P2Rank-Vina,7AN5_RDH,0.49999999999999994,0.8,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+83,P2Rank-Vina,7B2C_TP7,,0.0,,
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+86,P2Rank-Vina,7WKL_CAQ,0.4375,0.825,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 3, 'UNL:ASN:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+87,P2Rank-Vina,7WPW_F15,,0.0,,
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+90,P2Rank-Vina,7SZA_DUI,0.21052631578947367,0.9157894736842105,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+91,P2Rank-Vina,7PIH_7QW,0.17391304347826086,0.9304347826086956,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+92,P2Rank-Vina,7T3E_SLB,0.7058823529411764,0.7176470588235294,"{'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2}"
+93,P2Rank-Vina,7FRX_O88,,0.0,,
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+95,P2Rank-Vina,7C8Q_DSG,0.7500000000000001,0.7,"{'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:DSG:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+96,P2Rank-Vina,7ZF0_DHR,,0.0,,
+97,P2Rank-Vina,8G0V_YHT,0.36363636363636354,0.8545454545454546,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:GLU:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+98,P2Rank-Vina,7P5T_5YG,,0.0,,
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+100,P2Rank-Vina,6Z0R_Q4H,0.5714285714285714,0.7714285714285715,"{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1}","{'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1}"
+101,P2Rank-Vina,7XRL_FWK,,0.0,,
+102,P2Rank-Vina,7LOU_IFM,,0.0,,
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+105,P2Rank-Vina,7LT0_ONJ,0.3500000000000001,0.86,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}"
+106,P2Rank-Vina,7OLI_8HG,,0.0,,
+107,P2Rank-Vina,7Z1Q_NIO,0.5,0.8,"{'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+108,P2Rank-Vina,6YQW_82I,0.23076923076923067,0.9076923076923077,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+109,P2Rank-Vina,6T88_MWQ,,0.0,,
+110,P2Rank-Vina,7PRI_7TI,,0.0,,
+111,P2Rank-Vina,7OFF_VCB,,0.0,,
+112,P2Rank-Vina,7DQL_4CL,0.6666666666666666,0.7333333333333334,"{'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 3}"
+113,P2Rank-Vina,7O1T_5X8,,0.0,,
+114,P2Rank-Vina,7KM8_WPD,,0.0,,
+115,P2Rank-Vina,7ZXV_45D,0.23076923076923078,0.9076923076923077,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 5, 'UNL:MET:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL::Hydrophobic': 1, 'UNL::VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 5, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+116,P2Rank-Vina,7X5N_5M5,,0.0,,
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+118,P2Rank-Vina,7PJQ_OWH,0.2666666666666666,0.8933333333333333,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+119,P2Rank-Vina,8AQL_PLG,,0.0,,
+120,P2Rank-Vina,7VC5_9SF,,0.0,,
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+123,P2Rank-Vina,7TYP_KUR,0.4782608695652173,0.808695652173913,"{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 4}","{'UNL:ALA:Hydrophobic': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 2, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+124,P2Rank-Vina,7L03_F9F,,0.0,,
+125,P2Rank-Vina,7P1F_KFN,,0.0,,
+126,P2Rank-Vina,7O0N_CDP,,0.0,,
+127,P2Rank-Vina,7MYU_ZR7,0.3181818181818181,0.8727272727272728,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+128,P2Rank-Vina,6YSP_PAL,1.125,0.55,"{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 3, 'UNL:LYS:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 3, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 4, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2}"
+129,P2Rank-Vina,7XJN_NSD,,0.0,,
+130,P2Rank-Vina,7R6J_2I7,,0.0,,
+131,P2Rank-Vina,8HFN_XGC,0.46153846153846156,0.8153846153846154,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}","{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+132,P2Rank-Vina,7BTT_F8R,0.23529411764705888,0.9058823529411765,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+133,P2Rank-Vina,7MY1_IPE,0.2,0.92,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+134,P2Rank-Vina,8FO5_Y4U,0.4000000000000001,0.84,"{'UNL:GLU:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 1}","{'UNL:GLN:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2}"
+135,P2Rank-Vina,8AUH_L9I,,0.0,,
+136,P2Rank-Vina,7ECR_SIN,,0.0,,
+137,P2Rank-Vina,6TW5_9M2,,0.0,,
+138,P2Rank-Vina,7ELT_TYM,0.59375,0.7625,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 3}"
+139,P2Rank-Vina,7D5C_GV6,,0.0,,
+140,P2Rank-Vina,7W06_ITN,0.375,0.85,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 2}"
+141,P2Rank-Vina,6YJA_2BA,,0.0,,
+142,P2Rank-Vina,7P1M_4IU,0.23809523809523808,0.9047619047619048,"{'UNL:ASN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 2, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+143,P2Rank-Vina,7PGX_FMN,,0.0,,
+144,P2Rank-Vina,7UAS_MBU,0.3888888888888888,0.8444444444444446,"{'UNL:ALA:Hydrophobic': 4, 'UNL:ALA:VdWContact': 3, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3}","{'UNL:ASP:Hydrophobic': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+145,P2Rank-Vina,8GFD_ZHR,0.11111111111111116,0.9555555555555555,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+146,P2Rank-Vina,7CTM_BDP,,0.0,,
+147,P2Rank-Vina,7UQ3_O2U,0.6666666666666667,0.7333333333333333,"{'UNL:GLU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+148,P2Rank-Vina,7DKT_GLF,,0.0,,
+149,P2Rank-Vina,7CNQ_G8X,,0.0,,
+150,P2Rank-Vina,6Z1C_7EY,0.6,0.76,"{'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 3}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 2}"
+151,P2Rank-Vina,7M3H_YPV,0.1428571428571429,0.9428571428571428,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1}"
+152,P2Rank-Vina,7D6O_MTE,,0.0,,
+153,P2Rank-Vina,7N4W_P4V,0.28571428571428564,0.8857142857142858,"{'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+154,P2Rank-Vina,6Z2C_Q5E,0.4166666666666667,0.8333333333333333,"{'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+155,P2Rank-Vina,7CIJ_G0C,0.2,0.92,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2}"
+156,P2Rank-Vina,7USH_82V,,0.0,,
+157,P2Rank-Vina,7XG5_PLP,0.5625,0.775,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}"
+158,P2Rank-Vina,7PT3_3KK,,0.0,,
+159,P2Rank-Vina,7KB1_WBJ,,0.0,,
+160,P2Rank-Vina,7WUX_6OI,0.2941176470588236,0.8823529411764706,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1}"
+161,P2Rank-Vina,7OZ9_NGK,0.33333333333333326,0.8666666666666667,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1}","{'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1}"
+162,P2Rank-Vina,7N03_ZRP,0.5238095238095238,0.7904761904761904,"{'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+163,P2Rank-Vina,7BMI_U4B,0.13333333333333333,0.9466666666666667,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+164,P2Rank-Vina,7RZL_NPO,,0.0,,
+165,P2Rank-Vina,7QHL_D5P,,0.0,,
+166,P2Rank-Vina,7N7B_T3F,,0.0,,
+167,P2Rank-Vina,7Q5I_I0F,,0.0,,
+168,P2Rank-Vina,7BKA_4JC,,0.0,,
+169,P2Rank-Vina,7NXO_UU8,0.5882352941176472,0.7647058823529411,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+170,P2Rank-Vina,6XG5_TOP,,0.0,,
+171,P2Rank-Vina,6XBO_5MC,,0.0,,
+172,P2Rank-Vina,8DKO_TFB,,0.0,,
+173,P2Rank-Vina,7LJN_GTP,0.17391304347826086,0.9304347826086956,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+174,P2Rank-Vina,7MOI_HPS,0.5294117647058825,0.788235294117647,"{'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 1}"
+175,P2Rank-Vina,8G6P_API,,0.0,,
+176,P2Rank-Vina,7ULC_56B,0.5185185185185185,0.7925925925925926,"{'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+177,P2Rank-Vina,7RC3_SAH,,0.0,,
+178,P2Rank-Vina,7SFO_98L,0.4999999999999999,0.8,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1}"
+179,P2Rank-Vina,8DP2_UMA,,0.0,,
+180,P2Rank-Vina,7ZZW_KKW,,0.0,,
+181,P2Rank-Vina,7XFA_D9J,0.14285714285714296,0.9428571428571428,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}"
+182,P2Rank-Vina,7NP6_UK8,0.35483870967741926,0.8580645161290323,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+183,P2Rank-Vina,7F5D_EUO,0.2777777777777777,0.888888888888889,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+184,P2Rank-Vina,6TW7_NZB,,0.0,,
+185,P2Rank-Vina,7FHA_ADX,0.6190476190476191,0.7523809523809524,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 1}"
+186,P2Rank-Vina,7ES1_UDP,0.35,0.86,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+187,P2Rank-Vina,7OEO_V9Z,0.13636363636363638,0.9454545454545454,"{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}"
+188,P2Rank-Vina,7DUA_HJ0,0.6499999999999999,0.74,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+189,P2Rank-Vina,7BCP_GCO,0.05882352941176472,0.9764705882352941,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 2, 'UNL:SER:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1}"
+190,P2Rank-Vina,7P2I_MFU,,0.0,,
+191,P2Rank-Vina,7WDT_NGS,0.28571428571428575,0.8857142857142857,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+192,P2Rank-Vina,8AEM_LVF,,0.0,,
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+198,P2Rank-Vina,7W05_GMP,0.4666666666666667,0.8133333333333334,"{'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+199,P2Rank-Vina,7UJF_R3V,0.4285714285714284,0.8285714285714286,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 9, 'UNL:LEU:VdWContact': 8, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+200,P2Rank-Vina,7LOE_Y84,0.5714285714285714,0.7714285714285715,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3}"
+201,P2Rank-Vina,8AIE_M7L,1.0,0.6,"{'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 3, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+202,P2Rank-Vina,7JY3_VUD,,0.0,,
+203,P2Rank-Vina,6XM9_V55,,0.0,,
+204,P2Rank-Vina,7POM_7VZ,0.21052631578947367,0.9157894736842105,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 4, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:HIS:HBDonor': 2, 'UNL:HIS:VdWContact': 4, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+205,P2Rank-Vina,7M31_TDR,,0.0,,
+206,P2Rank-Vina,8EYE_X4I,,0.0,,
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+211,P2Rank-Vina,7N4N_0BK,,0.0,,
+212,P2Rank-Vina,7UMW_NAD,,0.0,,
+213,P2Rank-Vina,7U3J_L6U,0.4482758620689655,0.8206896551724138,"{'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 3}"
+214,P2Rank-Vina,6Z14_Q4Z,,0.0,,
+215,P2Rank-Vina,6ZK5_IMH,0.20000000000000004,0.9199999999999999,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+216,P2Rank-Vina,7QGP_DJ8,0.8421052631578948,0.6631578947368421,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+217,P2Rank-Vina,7L5F_XNG,0.6842105263157894,0.7263157894736842,"{'UNL:ALA:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+218,P2Rank-Vina,7FT9_4MB,,0.0,,
+219,P2Rank-Vina,7OP9_06K,,0.0,,
+220,P2Rank-Vina,7JXX_VP7,,0.0,,
+221,P2Rank-Vina,7CL8_TES,,0.0,,
+222,P2Rank-Vina,7TM6_GPJ,,0.0,,
+223,P2Rank-Vina,7WQQ_5Z6,0.6,0.76,"{'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 2, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 4, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 4, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 4, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:Hydrophobic': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 4, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+224,P2Rank-Vina,7WL4_JFU,0.09523809523809523,0.9619047619047619,"{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+225,P2Rank-Vina,7SCW_GSP,0.39999999999999997,0.8400000000000001,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 4, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+226,P2Rank-Vina,7L7C_XQ1,,0.0,,
+227,P2Rank-Vina,7PUV_84Z,,0.0,,
+228,P2Rank-Vina,7KQU_YOF,,0.0,,
+229,P2Rank-Vina,7Z2O_IAJ,0.2631578947368421,0.8947368421052632,"{'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}"
+230,P2Rank-Vina,7PRM_81I,0.608695652173913,0.7565217391304349,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+231,P2Rank-Vina,8FLV_ZB9,0.5714285714285714,0.7714285714285715,"{'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+232,P2Rank-Vina,7NLV_UJE,0.4545454545454547,0.8181818181818181,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 2, 'UNL:SER:VdWContact': 4, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+233,P2Rank-Vina,7T0D_FPP,,0.0,,
+234,P2Rank-Vina,7MWU_ZPM,,0.0,,
+235,P2Rank-Vina,7L00_XCJ,,0.0,,
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+239,P2Rank-Vina,7TUO_KL9,0.18518518518518517,0.9259259259259259,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+240,P2Rank-Vina,7ED2_A3P,0.5789473684210525,0.768421052631579,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+241,P2Rank-Vina,7ZL5_IWE,,0.0,,
+242,P2Rank-Vina,8F8E_XJI,0.36363636363636365,0.8545454545454545,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+243,P2Rank-Vina,7OZC_G6S,0.44444444444444453,0.8222222222222222,"{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:HIS:VdWContact': 3, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+244,P2Rank-Vina,7Q2B_M6H,0.1538461538461539,0.9384615384615385,"{'UNL:GLU:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+245,P2Rank-Vina,6VTA_AKN,,0.0,,
+246,P2Rank-Vina,7V3N_AKG,0.44444444444444453,0.8222222222222222,"{'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+247,P2Rank-Vina,8F4J_PHO,,0.0,,
+248,P2Rank-Vina,7ZOC_T8E,0.23529411764705882,0.9058823529411765,"{'UNL:ASN:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 4, 'UNL:HIS:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+249,P2Rank-Vina,7WCF_ACP,0.375,0.85,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 3, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+250,P2Rank-Vina,7NUT_GLP,0.1875,0.925,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1}"
+251,P2Rank-Vina,7E4L_MDN,0.49999999999999994,0.8,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+252,P2Rank-Vina,7TS6_KMI,,0.0,,
+253,P2Rank-Vina,7NF3_4LU,,0.0,,
+254,P2Rank-Vina,8D5D_5DK,,0.0,,
+255,P2Rank-Vina,7JMV_4NC,0.6111111111111112,0.7555555555555555,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+256,P2Rank-Vina,7A9E_R4W,0.9090909090909092,0.6363636363636364,"{'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+257,P2Rank-Vina,7TBU_S3P,0.3846153846153846,0.8461538461538461,"{'UNL:ARG:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1}"
+258,P2Rank-Vina,7TB0_UD1,,0.0,,
+259,P2Rank-Vina,7MFP_Z7P,,0.0,,
+260,P2Rank-Vina,6M2B_EZO,0.20000000000000007,0.9199999999999999,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+261,P2Rank-Vina,7NPL_UKZ,0.6551724137931034,0.7379310344827587,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+262,P2Rank-Vina,7KZ9_XN7,,0.0,,
+263,P2Rank-Vina,7QE4_NGA,,0.0,,
+264,P2Rank-Vina,8AP0_PRP,,0.0,,
+265,P2Rank-Vina,7V3S_5I9,0.625,0.75,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 3, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3}"
+266,P2Rank-Vina,7C0U_FGO,,0.0,,
+267,P2Rank-Vina,7UXS_OJC,,0.0,,
+268,P2Rank-Vina,7X9K_8OG,,0.0,,
+269,P2Rank-Vina,8BOM_QU6,0.39285714285714285,0.8428571428571429,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+270,P2Rank-Vina,8BTI_RFO,,0.0,,
+271,P2Rank-Vina,7RWS_4UR,0.23999999999999994,0.904,"{'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+272,P2Rank-Vina,6YQV_8K2,,0.0,,
+273,P2Rank-Vina,7PK0_BYC,,0.0,,
+274,P2Rank-Vina,5SIS_JSM,0.26086956521739124,0.8956521739130435,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+275,P2Rank-Vina,7NSW_HC4,0.6111111111111112,0.7555555555555555,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+276,P2Rank-Vina,7F8T_FAD,,0.0,,
+277,P2Rank-Vina,5SD5_HWI,,0.0,,
+278,P2Rank-Vina,7CUO_PHB,0.14285714285714285,0.9428571428571428,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+279,P2Rank-Vina,7R3D_APR,0.30434782608695643,0.8782608695652174,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 4}"
+280,P2Rank-Vina,7WJB_BGC,,0.0,,
+281,P2Rank-Vina,7A1P_QW2,0.19999999999999996,0.92,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+282,P2Rank-Vina,6ZPB_3D1,0.25,0.9,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+283,P2Rank-Vina,7UTW_NAI,,0.0,,
+284,P2Rank-Vina,7WUY_76N,,0.0,,
+285,P2Rank-Vina,8A2D_KXY,0.30769230769230765,0.8769230769230769,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3}"
+286,P2Rank-Vina,7NR8_UOE,,0.0,,
+287,P2Rank-Vina,7KC5_BJZ,0.6153846153846154,0.7538461538461538,"{'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+288,P2Rank-Vina,7QPP_VDX,0.38095238095238093,0.8476190476190476,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+289,P2Rank-Vina,7VKZ_NOJ,0.411764705882353,0.8352941176470587,"{'UNL:ASP:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 2}"
+290,P2Rank-Vina,7F51_BA7,0.1290322580645162,0.9483870967741935,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 2}"
+291,P2Rank-Vina,7PL1_SFG,,0.0,,
+292,P2Rank-Vina,7VB8_STL,,0.0,,
+293,P2Rank-Vina,8FAV_4Y5,,0.0,,
+294,P2Rank-Vina,7CD9_FVR,0.5238095238095238,0.7904761904761904,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3}"
+295,P2Rank-Vina,7N7H_CTP,,0.0,,
+296,P2Rank-Vina,7ODY_DGI,,0.0,,
+297,P2Rank-Vina,8CSD_C5P,,0.0,,
+298,P2Rank-Vina,7OFK_VCH,,0.0,,
+299,P2Rank-Vina,7SDD_4IP,0.5384615384615384,0.7846153846153846,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+300,P2Rank-Vina,7OPG_06N,,0.0,,
+301,P2Rank-Vina,7ZTL_BCN,,0.0,,
+302,P2Rank-Vina,7SIU_9ID,0.3043478260869565,0.8782608695652174,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+303,P2Rank-Vina,7LCU_XTA,,0.0,,
+304,P2Rank-Vina,7NGW_UAW,0.5454545454545453,0.7818181818181819,"{'UNL:ALA:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+305,P2Rank-Vina,7VYJ_CA0,,0.0,,
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+307,P2Rank-Vina,8HO0_3ZI,,0.0,,
+308,DiffDock-L,8AAU_LH0,0.42105263157894735,0.8315789473684211,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+309,DiffDock-L,7JHQ_VAJ,0.3076923076923077,0.8769230769230769,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+310,DiffDock-L,6ZCY_QF8,0.09523809523809529,0.9619047619047619,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+311,DiffDock-L,7UAW_MF6,0.4230769230769231,0.8307692307692307,"{'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+312,DiffDock-L,6YMS_OZH,0.08000000000000002,0.968,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+313,DiffDock-L,7UJ5_DGL,0.40000000000000013,0.84,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+314,DiffDock-L,8EX2_Q2Q,0.15384615384615385,0.9384615384615385,"{'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
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+316,DiffDock-L,7UYB_OK0,0.1333333333333333,0.9466666666666667,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
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+330,DiffDock-L,7VBU_6I4,0.5714285714285714,0.7714285714285715,"{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
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+333,DiffDock-L,7R59_I5F,0.09090909090909091,0.9636363636363636,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+334,DiffDock-L,7ZCC_OGA,0.27272727272727276,0.8909090909090909,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
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+340,DiffDock-L,5SAK_ZRY,0.6666666666666667,0.7333333333333333,"{'UNL:ASP:VdWContact': 3, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
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+346,DiffDock-L,7CNS_PMV,0.9473684210526315,0.6210526315789474,"{'UNL:ASN:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+347,DiffDock-L,7ZDY_6MJ,0.39999999999999997,0.8400000000000001,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 3}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+348,DiffDock-L,6Z4N_Q7B,0.3529411764705882,0.8588235294117648,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2}"
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+352,DiffDock-L,6YR2_T1C,0.24999999999999997,0.9,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
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+354,DiffDock-L,7EBG_J0L,0.5833333333333333,0.7666666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+355,DiffDock-L,8AY3_OE3,0.23529411764705876,0.9058823529411765,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
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+368,DiffDock-L,7K0V_VQP,0.18518518518518529,0.9259259259259259,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
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+370,DiffDock-L,7QF4_RBF,0.20000000000000007,0.9199999999999999,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}"
+371,DiffDock-L,7UJ4_OQ4,0.3999999999999999,0.8400000000000001,"{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 4, 'UNL:TYR:VdWContact': 4}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+372,DiffDock-L,7A9H_TPP,0.20689655172413796,0.9172413793103448,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+373,DiffDock-L,7LEV_0JO,0.43999999999999995,0.8240000000000001,"{'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 4, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 2}"
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+400,DiffDock-L,7T3E_SLB,0.875,0.65,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PRO:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2}"
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+405,DiffDock-L,8G0V_YHT,0.24999999999999992,0.9,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+406,DiffDock-L,7P5T_5YG,,0.0,,
+407,DiffDock-L,7NU0_DCL,0.09090909090909091,0.9636363636363636,"{'UNL:ASP:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+408,DiffDock-L,6Z0R_Q4H,0.7692307692307692,0.6923076923076923,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:SER:VdWContact': 2}","{'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1}"
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+410,DiffDock-L,7LOU_IFM,0.11764705882352944,0.9529411764705882,"{'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:UDP:VdWContact': 1}"
+411,DiffDock-L,7ROU_66I,0.2000000000000001,0.9199999999999999,"{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
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+422,DiffDock-L,7KM8_WPD,0.1739130434782608,0.9304347826086957,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+423,DiffDock-L,7ZXV_45D,0.38461538461538464,0.8461538461538461,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 4, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL::Hydrophobic': 1, 'UNL::VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 5, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
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+425,DiffDock-L,7VQ9_ISY,0.21052631578947362,0.9157894736842106,"{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+426,DiffDock-L,7PJQ_OWH,0.26666666666666666,0.8933333333333333,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+427,DiffDock-L,8AQL_PLG,0.23529411764705876,0.9058823529411765,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 4, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 4, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+428,DiffDock-L,7VC5_9SF,0.3125,0.875,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+429,DiffDock-L,7AFX_R9K,0.21428571428571427,0.9142857142857143,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1}"
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+444,DiffDock-L,7ECR_SIN,0.5714285714285714,0.7714285714285715,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
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+449,DiffDock-L,6YJA_2BA,0.4,0.84,"{'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
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+454,DiffDock-L,7CTM_BDP,0.4999999999999999,0.8,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CSD:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1}"
+455,DiffDock-L,7UQ3_O2U,0.0,1.0,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+456,DiffDock-L,7DKT_GLF,0.23076923076923067,0.9076923076923077,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+457,DiffDock-L,7CNQ_G8X,,0.0,,
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+459,DiffDock-L,7M3H_YPV,0.5333333333333333,0.7866666666666666,"{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:THR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1}"
+460,DiffDock-L,7D6O_MTE,,0.0,,
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+462,DiffDock-L,6Z2C_Q5E,0.5,0.8,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 3, 'UNL:PRO:VdWContact': 3}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+463,DiffDock-L,7CIJ_G0C,0.3333333333333333,0.8666666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2}"
+464,DiffDock-L,7USH_82V,0.15384615384615385,0.9384615384615385,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}"
+465,DiffDock-L,7XG5_PLP,0.1428571428571429,0.9428571428571428,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}"
+466,DiffDock-L,7PT3_3KK,0.41666666666666674,0.8333333333333333,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+467,DiffDock-L,7KB1_WBJ,0.04347826086956519,0.9826086956521739,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+468,DiffDock-L,7WUX_6OI,0.2222222222222222,0.9111111111111111,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1}"
+469,DiffDock-L,7OZ9_NGK,0.4444444444444445,0.8222222222222222,"{'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1}"
+470,DiffDock-L,7N03_ZRP,0.1904761904761904,0.9238095238095239,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
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+472,DiffDock-L,7RZL_NPO,0.09999999999999998,0.96,"{'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+473,DiffDock-L,7QHL_D5P,0.1578947368421052,0.9368421052631579,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
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+475,DiffDock-L,7Q5I_I0F,0.11764705882352944,0.9529411764705882,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}"
+476,DiffDock-L,7BKA_4JC,,0.0,,
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+478,DiffDock-L,6XG5_TOP,0.07142857142857142,0.9714285714285714,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1}"
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+481,DiffDock-L,7LJN_GTP,0.1578947368421052,0.9368421052631579,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+482,DiffDock-L,7MOI_HPS,0.07692307692307698,0.9692307692307692,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 1}"
+483,DiffDock-L,8G6P_API,0.4736842105263157,0.8105263157894738,"{'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1}"
+484,DiffDock-L,7ULC_56B,0.4761904761904762,0.8095238095238095,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+485,DiffDock-L,7RC3_SAH,0.12499999999999997,0.95,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+486,DiffDock-L,7SFO_98L,0.42105263157894735,0.8315789473684211,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1}"
+487,DiffDock-L,8DP2_UMA,0.21739130434782616,0.9130434782608695,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}"
+488,DiffDock-L,7ZZW_KKW,0.1875,0.925,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:VdWContact': 2}"
+489,DiffDock-L,7XFA_D9J,0.33333333333333326,0.8666666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}"
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+491,DiffDock-L,7F5D_EUO,0.11764705882352944,0.9529411764705882,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+492,DiffDock-L,6TW7_NZB,0.09090909090909091,0.9636363636363636,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+493,DiffDock-L,7FHA_ADX,0.36842105263157887,0.8526315789473684,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 1}"
+494,DiffDock-L,7ES1_UDP,0.22222222222222224,0.9111111111111111,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+495,DiffDock-L,7OEO_V9Z,0.11764705882352944,0.9529411764705882,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}"
+496,DiffDock-L,7DUA_HJ0,0.125,0.95,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+497,DiffDock-L,7BCP_GCO,0.21428571428571425,0.9142857142857143,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1}"
+498,DiffDock-L,7P2I_MFU,0.09090909090909094,0.9636363636363636,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2}"
+499,DiffDock-L,7WDT_NGS,0.5714285714285715,0.7714285714285714,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 4, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+500,DiffDock-L,8AEM_LVF,0.2500000000000001,0.8999999999999999,"{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:MET:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+501,DiffDock-L,7WY1_D0L,,0.0,,
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+503,DiffDock-L,7P4C_5OV,0.18181818181818174,0.9272727272727272,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 3, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:VdWContact': 2}"
+504,DiffDock-L,7MWN_WI5,0.17391304347826086,0.9304347826086956,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+505,DiffDock-L,7ZHP_IQY,0.21739130434782603,0.9130434782608696,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+506,DiffDock-L,7W05_GMP,0.5714285714285714,0.7714285714285715,"{'UNL:ASN:HBDonor': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+507,DiffDock-L,7UJF_R3V,0.375,0.85,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 5, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+508,DiffDock-L,7LOE_Y84,0.3571428571428571,0.8571428571428572,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3}"
+509,DiffDock-L,8AIE_M7L,0.263157894736842,0.8947368421052632,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 4, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 4, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 3, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+510,DiffDock-L,7JY3_VUD,,0.0,,
+511,DiffDock-L,6XM9_V55,0.0714285714285714,0.9714285714285714,"{'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
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+518,DiffDock-L,7UY4_SMI,0.26666666666666666,0.8933333333333333,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
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+522,DiffDock-L,6Z14_Q4Z,0.1428571428571429,0.9428571428571428,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+523,DiffDock-L,6ZK5_IMH,0.2631578947368421,0.8947368421052632,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+524,DiffDock-L,7QGP_DJ8,0.2272727272727274,0.9090909090909091,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+525,DiffDock-L,7L5F_XNG,0.5,0.8,"{'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+526,DiffDock-L,7FT9_4MB,0.6153846153846154,0.7538461538461538,"{'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:THR:Hydrophobic': 3, 'UNL:THR:VdWContact': 4, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+527,DiffDock-L,7OP9_06K,,0.0,,
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+529,DiffDock-L,7CL8_TES,,0.0,,
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+543,DiffDock-L,7L00_XCJ,,0.0,,
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+555,DiffDock-L,8F4J_PHO,,0.0,,
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+560,DiffDock-L,7TS6_KMI,,0.0,,
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+571,DiffDock-L,7QE4_NGA,0.5555555555555556,0.7777777777777778,"{'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+572,DiffDock-L,8AP0_PRP,0.7857142857142856,0.6857142857142857,"{'UNL:ARG:VdWContact': 2, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
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+574,DiffDock-L,7C0U_FGO,0.21739130434782622,0.9130434782608695,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 3}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 4}"
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+577,DiffDock-L,8BOM_QU6,0.20000000000000004,0.9199999999999999,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+578,DiffDock-L,8BTI_RFO,0.0,1.0,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+579,DiffDock-L,7RWS_4UR,0.25000000000000006,0.9,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+580,DiffDock-L,6YQV_8K2,0.25,0.9,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+581,DiffDock-L,7PK0_BYC,0.20000000000000007,0.9199999999999999,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 4, 'UNL:GLN:VdWContact': 5, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+582,DiffDock-L,5SIS_JSM,0.21739130434782614,0.9130434782608695,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+583,DiffDock-L,7NSW_HC4,0.7777777777777778,0.6888888888888889,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+584,DiffDock-L,7F8T_FAD,0.12903225806451613,0.9483870967741935,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 4, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+585,DiffDock-L,5SD5_HWI,0.25,0.9,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+586,DiffDock-L,7CUO_PHB,0.111111111111111,0.9555555555555556,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+587,DiffDock-L,7R3D_APR,0.050000000000000044,0.98,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 4}"
+588,DiffDock-L,7WJB_BGC,0.1538461538461539,0.9384615384615385,"{'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+589,DiffDock-L,7A1P_QW2,0.050000000000000044,0.98,"{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+590,DiffDock-L,6ZPB_3D1,0.16666666666666666,0.9333333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
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+593,DiffDock-L,8A2D_KXY,0.1538461538461538,0.9384615384615385,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3}"
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+595,DiffDock-L,7KC5_BJZ,0.5333333333333333,0.7866666666666666,"{'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 4, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+596,DiffDock-L,7QPP_VDX,0.3333333333333334,0.8666666666666667,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+597,DiffDock-L,7VKZ_NOJ,0.3076923076923077,0.8769230769230769,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 2}"
+598,DiffDock-L,7F51_BA7,0.24137931034482762,0.903448275862069,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 2}"
+599,DiffDock-L,7PL1_SFG,0.08333333333333334,0.9666666666666667,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+600,DiffDock-L,7VB8_STL,0.2142857142857143,0.9142857142857143,"{'UNL:GLU:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+601,DiffDock-L,8FAV_4Y5,0.31034482758620685,0.8758620689655172,"{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 3, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+602,DiffDock-L,7CD9_FVR,0.12,0.952,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3}"
+603,DiffDock-L,7N7H_CTP,0.5384615384615384,0.7846153846153846,"{'UNL:ASN:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 3, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 4, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+604,DiffDock-L,7ODY_DGI,0.1904761904761904,0.9238095238095239,"{'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2}"
+605,DiffDock-L,8CSD_C5P,0.46666666666666673,0.8133333333333332,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 2, 'UNL:SER:VdWContact': 3, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+606,DiffDock-L,7OFK_VCH,0.22727272727272724,0.9090909090909091,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+607,DiffDock-L,7SDD_4IP,0.6666666666666666,0.7333333333333334,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+608,DiffDock-L,7OPG_06N,0.42857142857142855,0.8285714285714285,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3}"
+609,DiffDock-L,7ZTL_BCN,0.0,1.0,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+610,DiffDock-L,7SIU_9ID,0.423076923076923,0.8307692307692308,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+611,DiffDock-L,7LCU_XTA,0.3043478260869565,0.8782608695652174,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+612,DiffDock-L,7NGW_UAW,0.18181818181818166,0.9272727272727274,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+613,DiffDock-L,7VYJ_CA0,0.26315789473684204,0.8947368421052632,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+614,DiffDock-L,7QHG_T3B,0.034482758620689724,0.9862068965517241,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+615,DiffDock-L,8HO0_3ZI,,0.0,,
+616,DynamicBind,8AAU_LH0,0.5263157894736843,0.7894736842105263,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+617,DynamicBind,7JHQ_VAJ,0.25,0.9,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+618,DynamicBind,6ZCY_QF8,0.1818181818181819,0.9272727272727272,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+619,DynamicBind,7UAW_MF6,0.3846153846153846,0.8461538461538461,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+620,DynamicBind,6YMS_OZH,0.33333333333333337,0.8666666666666667,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+621,DynamicBind,7UJ5_DGL,0.7222222222222221,0.7111111111111111,"{'UNL:CYS:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+622,DynamicBind,8EX2_Q2Q,0.38461538461538464,0.8461538461538461,"{'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+623,DynamicBind,7R9N_F97,,0.0,,
+624,DynamicBind,7UYB_OK0,0.4666666666666667,0.8133333333333334,"{'UNL:ASP:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 4, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+625,DynamicBind,7U0U_FK5,,0.0,,
+626,DynamicBind,7ZU2_DHT,,0.0,,
+627,DynamicBind,6XHT_V2V,,0.0,,
+628,DynamicBind,7OSO_0V1,0.45454545454545453,0.8181818181818181,"{'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2}"
+629,DynamicBind,8D19_GSH,,0.0,,
+630,DynamicBind,7MGT_ZD4,0.37037037037037035,0.8518518518518519,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+631,DynamicBind,8C3N_ADP,0.11538461538461536,0.9538461538461539,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 4, 'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+632,DynamicBind,6YYO_Q1K,0.08333333333333326,0.9666666666666667,"{'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1}"
+633,DynamicBind,8A1H_DLZ,,0.0,,
+634,DynamicBind,7XQZ_FPF,0.06666666666666665,0.9733333333333334,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+635,DynamicBind,7RH3_59O,0.07692307692307693,0.9692307692307692,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 1}"
+636,DynamicBind,7OMX_CNA,0.3333333333333333,0.8666666666666667,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:HBAcceptor': 2, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 3, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+637,DynamicBind,7LMO_NYO,0.5909090909090908,0.7636363636363637,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 4, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+638,DynamicBind,7VBU_6I4,,0.0,,
+639,DynamicBind,7TXK_LW8,0.6428571428571429,0.7428571428571429,"{'UNL:ASN:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+640,DynamicBind,7T1D_E7K,,0.0,,
+641,DynamicBind,7R59_I5F,0.30000000000000004,0.88,"{'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+642,DynamicBind,7ZCC_OGA,0.4,0.84,"{'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+643,DynamicBind,7V43_C4O,0.6666666666666667,0.7333333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 4, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}"
+644,DynamicBind,7BNH_BEZ,0.4444444444444444,0.8222222222222222,"{'UNL:ILE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+645,DynamicBind,6WTN_RXT,0.24999999999999994,0.9,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+646,DynamicBind,7QFM_AY3,0.2857142857142856,0.8857142857142858,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+647,DynamicBind,7MSR_DCA,0.16666666666666674,0.9333333333333333,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 6, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 3, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 3, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+648,DynamicBind,5SAK_ZRY,0.6000000000000001,0.76,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+649,DynamicBind,7QTA_URI,0.49999999999999994,0.8,"{'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}"
+650,DynamicBind,7RSV_7IQ,0.18181818181818185,0.9272727272727272,"{'UNL:GLN:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1}"
+651,DynamicBind,8DSC_NCA,0.5,0.8,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1}"
+652,DynamicBind,7AKL_RK5,,0.0,,
+653,DynamicBind,7XBV_APC,,0.0,,
+654,DynamicBind,7CNS_PMV,1.1052631578947372,0.5578947368421051,"{'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+655,DynamicBind,7ZDY_6MJ,0.4285714285714286,0.8285714285714285,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:TYR:VdWContact': 3}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+656,DynamicBind,6Z4N_Q7B,0.5,0.8,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2}"
+657,DynamicBind,7NFB_GEN,,0.0,,
+658,DynamicBind,7R7R_AWJ,0.20000000000000007,0.9199999999999999,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+659,DynamicBind,7V14_ORU,0.29411764705882354,0.8823529411764706,"{'UNL:ALA:Hydrophobic': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+660,DynamicBind,6YR2_T1C,,0.0,,
+661,DynamicBind,7JG0_GAR,0.25,0.9,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 2, 'UNL:MET:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:V:VdWContact': 1}"
+662,DynamicBind,7EBG_J0L,0.6153846153846154,0.7538461538461538,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+663,DynamicBind,8AY3_OE3,0.3684210526315789,0.8526315789473684,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+664,DynamicBind,7M6K_YRJ,0.23529411764705882,0.9058823529411765,"{'UNL:ARG:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+665,DynamicBind,6YT6_PKE,0.29999999999999993,0.88,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+666,DynamicBind,7Q27_8KC,0.3500000000000001,0.86,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+667,DynamicBind,8DHG_T78,0.36666666666666675,0.8533333333333333,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+668,DynamicBind,8EXL_799,0.34782608695652173,0.8608695652173913,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:MET:Hydrophobic': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}"
+669,DynamicBind,7FB7_8NF,0.29411764705882354,0.8823529411764706,"{'UNL:ASP:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1}"
+670,DynamicBind,7THI_PGA,0.8333333333333333,0.6666666666666667,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+671,DynamicBind,6ZAE_ACV,0.11111111111111113,0.9555555555555555,"{'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 3}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+672,DynamicBind,7MGY_ZD1,0.0,1.0,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+673,DynamicBind,7XPO_UPG,0.36363636363636365,0.8545454545454545,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+674,DynamicBind,7SUC_COM,,0.0,,
+675,DynamicBind,7BJJ_TVW,0.125,0.95,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+676,DynamicBind,7K0V_VQP,,0.0,,
+677,DynamicBind,7TE8_P0T,0.18518518518518523,0.9259259259259259,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+678,DynamicBind,7QF4_RBF,0.55,0.78,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}"
+679,DynamicBind,7UJ4_OQ4,0.2499999999999999,0.9,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+680,DynamicBind,7A9H_TPP,0.17241379310344834,0.9310344827586207,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+681,DynamicBind,7LEV_0JO,0.45833333333333326,0.8166666666666667,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 4, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 2}"
+682,DynamicBind,7N6F_0I1,,0.0,,
+683,DynamicBind,8EAB_VN2,0.875,0.65,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 3, 'UNL:SER:VdWContact': 5, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:HBAcceptor': 2, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+684,DynamicBind,6ZC3_JOR,0.47058823529411764,0.8117647058823529,"{'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBAcceptor': 2, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+685,DynamicBind,7Q25_8J9,,0.0,,
+686,DynamicBind,7C3U_AZG,0.3571428571428571,0.8571428571428572,"{'UNL:ALA:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2}"
+687,DynamicBind,7ROR_69X,0.7096774193548386,0.7161290322580646,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+688,DynamicBind,7MMH_ZJY,,0.0,,
+689,DynamicBind,7TH4_FFO,,0.0,,
+690,DynamicBind,8D39_QDB,0.2857142857142856,0.8857142857142858,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+691,DynamicBind,7YZU_DO7,0.49999999999999994,0.8,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 2}"
+692,DynamicBind,5SB2_1K2,0.20000000000000004,0.9199999999999999,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+693,DynamicBind,6M73_FNR,0.2777777777777778,0.8888888888888888,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 4}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+694,DynamicBind,8B8H_OJQ,0.3793103448275863,0.8482758620689654,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}"
+695,DynamicBind,7TOM_5AD,0.06896551724137928,0.9724137931034483,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+696,DynamicBind,7VWF_K55,0.47999999999999987,0.808,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 3}","{'UNL:ARG:Hydrophobic': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 1}"
+697,DynamicBind,7XI7_4RI,0.21428571428571425,0.9142857142857143,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+698,DynamicBind,7AN5_RDH,0.6666666666666667,0.7333333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+699,DynamicBind,7B2C_TP7,,0.0,,
+700,DynamicBind,7B94_ANP,0.13043478260869565,0.9478260869565217,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+701,DynamicBind,7NF0_BYN,0.39999999999999997,0.8400000000000001,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1}"
+702,DynamicBind,7WKL_CAQ,0.17647058823529416,0.9294117647058824,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+703,DynamicBind,7WPW_F15,0.10526315789473695,0.9578947368421052,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+704,DynamicBind,8SLG_G5A,0.3157894736842106,0.8736842105263157,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 4, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 3, 'UNL:GLU:VdWContact': 5, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+705,DynamicBind,7RNI_60I,0.33333333333333326,0.8666666666666667,"{'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 3}"
+706,DynamicBind,7SZA_DUI,0.4117647058823529,0.8352941176470589,"{'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+707,DynamicBind,7PIH_7QW,0.12500000000000003,0.95,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+708,DynamicBind,7T3E_SLB,,0.0,,
+709,DynamicBind,7FRX_O88,,0.0,,
+710,DynamicBind,8CNH_V6U,0.20000000000000007,0.9199999999999999,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+711,DynamicBind,7C8Q_DSG,0.4736842105263158,0.8105263157894737,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:DSG:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+712,DynamicBind,7ZF0_DHR,0.2727272727272727,0.8909090909090909,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 3}"
+713,DynamicBind,8G0V_YHT,,0.0,,
+714,DynamicBind,7P5T_5YG,0.4,0.84,"{'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+715,DynamicBind,7NU0_DCL,0.18181818181818177,0.9272727272727272,"{'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}","{'UNL:ASP:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+716,DynamicBind,6Z0R_Q4H,,0.0,,
+717,DynamicBind,7XRL_FWK,0.35,0.86,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+718,DynamicBind,7LOU_IFM,,0.0,,
+719,DynamicBind,7ROU_66I,0.6785714285714285,0.7285714285714286,"{'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+720,DynamicBind,6XCT_478,0.4,0.84,"{'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 5, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+721,DynamicBind,7LT0_ONJ,0.30000000000000004,0.88,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}"
+722,DynamicBind,7OLI_8HG,0.10526315789473684,0.9578947368421052,"{'UNL:ASP:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2}"
+723,DynamicBind,7Z1Q_NIO,0.27272727272727276,0.8909090909090909,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+724,DynamicBind,6YQW_82I,0.39999999999999997,0.8400000000000001,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+725,DynamicBind,6T88_MWQ,0.4615384615384615,0.8153846153846154,"{'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+726,DynamicBind,7PRI_7TI,0.125,0.95,"{'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:VdWContact': 1}"
+727,DynamicBind,7OFF_VCB,0.5,0.8,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+728,DynamicBind,7DQL_4CL,0.15384615384615385,0.9384615384615385,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 3}"
+729,DynamicBind,7O1T_5X8,,0.0,,
+730,DynamicBind,7KM8_WPD,0.21739130434782603,0.9130434782608696,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+731,DynamicBind,7ZXV_45D,0.3125,0.875,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 3}","{'UNL::Hydrophobic': 1, 'UNL::VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 5, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+732,DynamicBind,7X5N_5M5,0.20833333333333334,0.9166666666666666,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+733,DynamicBind,7VQ9_ISY,0.3125,0.875,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+734,DynamicBind,7PJQ_OWH,0.21428571428571425,0.9142857142857143,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+735,DynamicBind,8AQL_PLG,0.33333333333333337,0.8666666666666667,"{'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 4, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+736,DynamicBind,7VC5_9SF,0.2777777777777778,0.8888888888888888,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2}","{'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+737,DynamicBind,7AFX_R9K,0.2857142857142857,0.8857142857142857,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1}"
+738,DynamicBind,7RKW_5TV,0.23529411764705885,0.9058823529411765,"{'UNL:ALA:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+739,DynamicBind,7TYP_KUR,0.5185185185185186,0.7925925925925925,"{'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 2, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+740,DynamicBind,7L03_F9F,0.09999999999999998,0.96,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+741,DynamicBind,7P1F_KFN,0.3999999999999999,0.8400000000000001,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+742,DynamicBind,7O0N_CDP,0.8181818181818181,0.6727272727272727,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 4, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 5, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+743,DynamicBind,7MYU_ZR7,,0.0,,
+744,DynamicBind,6YSP_PAL,1.25,0.5,"{'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 3, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 4, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2}"
+745,DynamicBind,7XJN_NSD,0.9090909090909091,0.6363636363636364,"{'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+746,DynamicBind,7R6J_2I7,0.11764705882352944,0.9529411764705882,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 2, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+747,DynamicBind,8HFN_XGC,0.21428571428571436,0.9142857142857143,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+748,DynamicBind,7BTT_F8R,0.2666666666666667,0.8933333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+749,DynamicBind,7MY1_IPE,0.09090909090909083,0.9636363636363636,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+750,DynamicBind,8FO5_Y4U,0.6666666666666667,0.7333333333333333,"{'UNL:GLU:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:GLN:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2}"
+751,DynamicBind,8AUH_L9I,0.3846153846153847,0.8461538461538461,"{'UNL:ARG:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:CYS:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+752,DynamicBind,7ECR_SIN,0.4285714285714285,0.8285714285714286,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+753,DynamicBind,6TW5_9M2,0.29999999999999993,0.88,"{'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+754,DynamicBind,7ELT_TYM,0.4666666666666667,0.8133333333333334,"{'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 3}"
+755,DynamicBind,7D5C_GV6,0.17857142857142855,0.9285714285714286,"{'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+756,DynamicBind,7W06_ITN,0.2777777777777778,0.8888888888888888,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 2}"
+757,DynamicBind,6YJA_2BA,0.368421052631579,0.8526315789473684,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+758,DynamicBind,7P1M_4IU,0.5384615384615385,0.7846153846153846,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+759,DynamicBind,7PGX_FMN,0.47619047619047616,0.8095238095238095,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}"
+760,DynamicBind,7UAS_MBU,0.23529411764705888,0.9058823529411765,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3}","{'UNL:ASP:Hydrophobic': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+761,DynamicBind,8GFD_ZHR,0.2857142857142857,0.8857142857142857,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:SER:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+762,DynamicBind,7CTM_BDP,0.42857142857142866,0.8285714285714285,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CSD:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1}"
+763,DynamicBind,7UQ3_O2U,0.2,0.92,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+764,DynamicBind,7DKT_GLF,0.4000000000000001,0.84,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+765,DynamicBind,7CNQ_G8X,,0.0,,
+766,DynamicBind,6Z1C_7EY,0.05555555555555558,0.9777777777777777,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 2}"
+767,DynamicBind,7M3H_YPV,0.5384615384615385,0.7846153846153846,"{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 5, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1}"
+768,DynamicBind,7D6O_MTE,,0.0,,
+769,DynamicBind,7N4W_P4V,0.2631578947368421,0.8947368421052632,"{'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3}","{'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+770,DynamicBind,6Z2C_Q5E,,0.0,,
+771,DynamicBind,7CIJ_G0C,0.32,0.872,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2}"
+772,DynamicBind,7USH_82V,0.1538461538461538,0.9384615384615385,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}"
+773,DynamicBind,7XG5_PLP,0.3529411764705883,0.8588235294117647,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}"
+774,DynamicBind,7PT3_3KK,0.3125,0.875,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 4, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 4, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+775,DynamicBind,7KB1_WBJ,,0.0,,
+776,DynamicBind,7WUX_6OI,,0.0,,
+777,DynamicBind,7OZ9_NGK,0.3636363636363636,0.8545454545454545,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1}"
+778,DynamicBind,7N03_ZRP,0.3529411764705883,0.8588235294117647,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 3, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+779,DynamicBind,7BMI_U4B,0.5294117647058822,0.7882352941176471,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+780,DynamicBind,7RZL_NPO,0.7142857142857142,0.7142857142857143,{'UNL:ARG:VdWContact': 1},"{'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+781,DynamicBind,7QHL_D5P,0.05555555555555555,0.9777777777777777,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+782,DynamicBind,7N7B_T3F,0.23076923076923084,0.9076923076923077,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+783,DynamicBind,7Q5I_I0F,,0.0,,
+784,DynamicBind,7BKA_4JC,,0.0,,
+785,DynamicBind,7NXO_UU8,0.13636363636363627,0.9454545454545455,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+786,DynamicBind,6XG5_TOP,0.3076923076923076,0.8769230769230769,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1}"
+787,DynamicBind,6XBO_5MC,,0.0,,
+788,DynamicBind,8DKO_TFB,0.375,0.85,"{'UNL:ARG:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+789,DynamicBind,7LJN_GTP,0.23809523809523814,0.9047619047619048,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+790,DynamicBind,7MOI_HPS,0.27272727272727276,0.8909090909090909,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 1}"
+791,DynamicBind,8G6P_API,0.3157894736842105,0.8736842105263158,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1}"
+792,DynamicBind,7ULC_56B,0.29166666666666663,0.8833333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+793,DynamicBind,7RC3_SAH,0.04166666666666663,0.9833333333333334,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+794,DynamicBind,7SFO_98L,0.30000000000000004,0.88,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 5, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1}"
+795,DynamicBind,8DP2_UMA,0.28571428571428575,0.8857142857142857,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}"
+796,DynamicBind,7ZZW_KKW,0.36842105263157887,0.8526315789473684,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:VdWContact': 2}"
+797,DynamicBind,7XFA_D9J,0.09090909090909091,0.9636363636363636,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}"
+798,DynamicBind,7NP6_UK8,0.40740740740740744,0.837037037037037,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 4, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+799,DynamicBind,7F5D_EUO,0.25,0.9,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+800,DynamicBind,6TW7_NZB,0.4666666666666667,0.8133333333333334,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 4, 'UNL:TYR:VdWContact': 4, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+801,DynamicBind,7FHA_ADX,0.5789473684210528,0.7684210526315789,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 1}"
+802,DynamicBind,7ES1_UDP,0.6111111111111112,0.7555555555555555,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+803,DynamicBind,7OEO_V9Z,0.33333333333333337,0.8666666666666667,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}"
+804,DynamicBind,7DUA_HJ0,0.0,1.0,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+805,DynamicBind,7BCP_GCO,0.125,0.95,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1}"
+806,DynamicBind,7P2I_MFU,0.6363636363636364,0.7454545454545455,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 3}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2}"
+807,DynamicBind,7WDT_NGS,0.7857142857142858,0.6857142857142857,"{'UNL:GLU:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 3}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+808,DynamicBind,8AEM_LVF,0.33333333333333337,0.8666666666666667,"{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:MET:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+809,DynamicBind,7WY1_D0L,0.6363636363636362,0.7454545454545455,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 4, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+810,DynamicBind,7KRU_ATP,,0.0,,
+811,DynamicBind,7P4C_5OV,0.19999999999999996,0.92,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:VdWContact': 2}"
+812,DynamicBind,7MWN_WI5,0.13043478260869562,0.9478260869565217,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+813,DynamicBind,7ZHP_IQY,0.40909090909090906,0.8363636363636364,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+814,DynamicBind,7W05_GMP,0.7058823529411764,0.7176470588235294,"{'UNL:ARG:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+815,DynamicBind,7UJF_R3V,,0.0,,
+816,DynamicBind,7LOE_Y84,0.3571428571428571,0.8571428571428572,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3}"
+817,DynamicBind,8AIE_M7L,0.4000000000000001,0.84,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 3, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+818,DynamicBind,7JY3_VUD,0.2666666666666668,0.8933333333333333,"{'UNL:ARG:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+819,DynamicBind,6XM9_V55,0.0625,0.975,"{'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+820,DynamicBind,7POM_7VZ,0.5,0.8,"{'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:HIS:HBDonor': 2, 'UNL:HIS:VdWContact': 4, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+821,DynamicBind,7M31_TDR,,0.0,,
+822,DynamicBind,8EYE_X4I,0.31818181818181807,0.8727272727272728,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 5, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+823,DynamicBind,6YRV_PJ8,0.40909090909090906,0.8363636363636364,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 3, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+824,DynamicBind,7LZD_YHY,0.30434782608695654,0.8782608695652174,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3}","{'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:Hydrophobic': 4, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+825,DynamicBind,7EPV_FDA,0.3703703703703704,0.8518518518518519,"{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 3, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}"
+826,DynamicBind,7UY4_SMI,0.4285714285714285,0.8285714285714286,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+827,DynamicBind,7N4N_0BK,0.23529411764705874,0.9058823529411765,"{'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 4, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+828,DynamicBind,7UMW_NAD,0.5357142857142856,0.7857142857142858,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBAcceptor': 2, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+829,DynamicBind,7U3J_L6U,0.4399999999999999,0.8240000000000001,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 3}"
+830,DynamicBind,6Z14_Q4Z,0.25,0.9,"{'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+831,DynamicBind,6ZK5_IMH,0.5263157894736843,0.7894736842105263,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+832,DynamicBind,7QGP_DJ8,,0.0,,
+833,DynamicBind,7L5F_XNG,0.3157894736842105,0.8736842105263158,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+834,DynamicBind,7FT9_4MB,,0.0,,
+835,DynamicBind,7OP9_06K,,0.0,,
+836,DynamicBind,7JXX_VP7,0.24000000000000005,0.904,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+837,DynamicBind,7CL8_TES,0.6428571428571429,0.7428571428571429,"{'UNL:ALA:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+838,DynamicBind,7TM6_GPJ,0.75,0.7,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LYS:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 2}"
+839,DynamicBind,7WQQ_5Z6,0.5555555555555555,0.7777777777777778,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 3, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 4, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+840,DynamicBind,7WL4_JFU,0.3157894736842105,0.8736842105263158,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+841,DynamicBind,7SCW_GSP,0.3043478260869565,0.8782608695652174,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 4, 'UNL:LYS:HBAcceptor': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 4, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+842,DynamicBind,7L7C_XQ1,0.2666666666666666,0.8933333333333333,"{'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:GLN:Hydrophobic': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PRO:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}"
+843,DynamicBind,7PUV_84Z,0.0625,0.975,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+844,DynamicBind,7KQU_YOF,0.4736842105263159,0.8105263157894737,"{'UNL:HIS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+845,DynamicBind,7Z2O_IAJ,0.1666666666666666,0.9333333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}"
+846,DynamicBind,7PRM_81I,0.3809523809523808,0.8476190476190477,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 5, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+847,DynamicBind,8FLV_ZB9,,0.0,,
+848,DynamicBind,7NLV_UJE,0.5,0.8,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 4, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 2, 'UNL:SER:VdWContact': 4, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+849,DynamicBind,7T0D_FPP,,0.0,,
+850,DynamicBind,7MWU_ZPM,0.08333333333333337,0.9666666666666667,"{'UNL:ARG:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+851,DynamicBind,7L00_XCJ,0.23809523809523814,0.9047619047619048,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+852,DynamicBind,8C5M_MTA,,0.0,,
+853,DynamicBind,7Z7F_IF3,0.1333333333333333,0.9466666666666667,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+854,DynamicBind,7TSF_H4B,0.36363636363636365,0.8545454545454545,"{'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}"
+855,DynamicBind,7TUO_KL9,0.2916666666666667,0.8833333333333333,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+856,DynamicBind,7ED2_A3P,0.65,0.74,"{'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+857,DynamicBind,7ZL5_IWE,0.6470588235294117,0.7411764705882353,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1}"
+858,DynamicBind,8F8E_XJI,0.5,0.8,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:CYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+859,DynamicBind,7OZC_G6S,0.23529411764705885,0.9058823529411765,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:HIS:VdWContact': 3, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+860,DynamicBind,7Q2B_M6H,0.33333333333333337,0.8666666666666667,"{'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 3}","{'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+861,DynamicBind,6VTA_AKN,0.55,0.78,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1}"
+862,DynamicBind,7V3N_AKG,0.6470588235294118,0.7411764705882353,"{'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+863,DynamicBind,8F4J_PHO,,0.0,,
+864,DynamicBind,7ZOC_T8E,0.2666666666666666,0.8933333333333333,"{'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 4, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 4, 'UNL:HIS:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+865,DynamicBind,7WCF_ACP,0.07142857142857156,0.9714285714285714,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 3, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 3, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+866,DynamicBind,7NUT_GLP,0.3529411764705882,0.8588235294117648,"{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 3}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1}"
+867,DynamicBind,7E4L_MDN,0.6666666666666666,0.7333333333333334,"{'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+868,DynamicBind,7TS6_KMI,0.0,1.0,"{'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+869,DynamicBind,7NF3_4LU,0.30555555555555547,0.8777777777777778,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+870,DynamicBind,8D5D_5DK,0.4074074074074075,0.837037037037037,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+871,DynamicBind,7JMV_4NC,0.19047619047619047,0.9238095238095239,"{'UNL:ARG:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2}","{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+872,DynamicBind,7A9E_R4W,0.46153846153846145,0.8153846153846154,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+873,DynamicBind,7TBU_S3P,0.2,0.92,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1}"
+874,DynamicBind,7TB0_UD1,,0.0,,
+875,DynamicBind,7MFP_Z7P,,0.0,,
+876,DynamicBind,6M2B_EZO,0.42307692307692313,0.8307692307692307,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 4, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+877,DynamicBind,7NPL_UKZ,0.5185185185185184,0.7925925925925926,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 4, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+878,DynamicBind,7KZ9_XN7,0.7,0.72,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+879,DynamicBind,7QE4_NGA,,0.0,,
+880,DynamicBind,8AP0_PRP,,0.0,,
+881,DynamicBind,7V3S_5I9,,0.0,,
+882,DynamicBind,7C0U_FGO,0.20833333333333331,0.9166666666666666,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 4}"
+883,DynamicBind,7UXS_OJC,0.8421052631578946,0.6631578947368422,"{'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1}"
+884,DynamicBind,7X9K_8OG,,0.0,,
+885,DynamicBind,8BOM_QU6,0.19230769230769226,0.9230769230769231,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+886,DynamicBind,8BTI_RFO,0.05882352941176472,0.9764705882352941,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+887,DynamicBind,7RWS_4UR,0.2222222222222222,0.9111111111111111,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+888,DynamicBind,6YQV_8K2,0.0,1.0,"{'UNL:GLY:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+889,DynamicBind,7PK0_BYC,0.21052631578947367,0.9157894736842105,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 3, 'UNL:GLN:VdWContact': 4, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+890,DynamicBind,5SIS_JSM,0.24999999999999994,0.9,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+891,DynamicBind,7NSW_HC4,0.4761904761904761,0.8095238095238095,"{'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+892,DynamicBind,7F8T_FAD,0.17500000000000004,0.9299999999999999,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 4, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+893,DynamicBind,5SD5_HWI,0.19047619047619047,0.9238095238095239,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+894,DynamicBind,7CUO_PHB,0.125,0.95,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+895,DynamicBind,7R3D_APR,,0.0,,
+896,DynamicBind,7WJB_BGC,0.09090909090909083,0.9636363636363636,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+897,DynamicBind,7A1P_QW2,,0.0,,
+898,DynamicBind,6ZPB_3D1,0.4736842105263157,0.8105263157894738,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+899,DynamicBind,7UTW_NAI,0.3333333333333332,0.8666666666666667,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 3}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 3}"
+900,DynamicBind,7WUY_76N,,0.0,,
+901,DynamicBind,8A2D_KXY,,0.0,,
+902,DynamicBind,7NR8_UOE,0.11538461538461531,0.9538461538461539,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 1}"
+903,DynamicBind,7KC5_BJZ,0.7857142857142857,0.6857142857142857,"{'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 4, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 2}","{'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+904,DynamicBind,7QPP_VDX,0.5,0.8,"{'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+905,DynamicBind,7VKZ_NOJ,0.5,0.8,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 3}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 2}"
+906,DynamicBind,7F51_BA7,0.48275862068965514,0.806896551724138,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 2}"
+907,DynamicBind,7PL1_SFG,0.3809523809523809,0.8476190476190477,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+908,DynamicBind,7VB8_STL,0.39130434782608703,0.8434782608695652,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+909,DynamicBind,8FAV_4Y5,0.3214285714285714,0.8714285714285714,"{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 3, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+910,DynamicBind,7CD9_FVR,0.3478260869565218,0.8608695652173912,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3}"
+911,DynamicBind,7N7H_CTP,0.5185185185185186,0.7925925925925925,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 3, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 4, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+912,DynamicBind,7ODY_DGI,,0.0,,
+913,DynamicBind,8CSD_C5P,0.6666666666666667,0.7333333333333333,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 2, 'UNL:SER:VdWContact': 3, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+914,DynamicBind,7OFK_VCH,0.22727272727272724,0.9090909090909091,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+915,DynamicBind,7SDD_4IP,0.6428571428571429,0.7428571428571429,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+916,DynamicBind,7OPG_06N,,0.0,,
+917,DynamicBind,7ZTL_BCN,0.29999999999999993,0.88,"{'UNL:LEU:VdWContact': 3, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+918,DynamicBind,7SIU_9ID,0.2,0.92,"{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 4, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+919,DynamicBind,7LCU_XTA,0.8235294117647058,0.6705882352941177,"{'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+920,DynamicBind,7NGW_UAW,0.15789473684210525,0.9368421052631579,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+921,DynamicBind,7VYJ_CA0,,0.0,,
+922,DynamicBind,7QHG_T3B,0.4444444444444445,0.8222222222222222,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 4, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+923,DynamicBind,8HO0_3ZI,0.5333333333333333,0.7866666666666666,"{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+924,NeuralPLexer,8AAU_LH0,0.2222222222222222,0.9111111111111111,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
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+929,NeuralPLexer,7UJ5_DGL,0.15,0.94,"{'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
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+936,NeuralPLexer,7OSO_0V1,0.4,0.84,"{'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:VdWContact': 2}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2}"
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+943,NeuralPLexer,7RH3_59O,0.41666666666666663,0.8333333333333334,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 1}"
+944,NeuralPLexer,7OMX_CNA,0.7407407407407408,0.7037037037037037,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:HBAcceptor': 2, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 3, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+945,NeuralPLexer,7LMO_NYO,0.15999999999999998,0.936,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 4, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+946,NeuralPLexer,7VBU_6I4,0.8571428571428572,0.6571428571428571,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+947,NeuralPLexer,7TXK_LW8,0.3125,0.875,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+948,NeuralPLexer,7T1D_E7K,0.4782608695652174,0.808695652173913,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 7, 'UNL:PHE:VdWContact': 5, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+949,NeuralPLexer,7R59_I5F,0.09090909090909088,0.9636363636363636,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+950,NeuralPLexer,7ZCC_OGA,0.45454545454545453,0.8181818181818181,"{'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+951,NeuralPLexer,7V43_C4O,0.6666666666666666,0.7333333333333334,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 4, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}"
+952,NeuralPLexer,7BNH_BEZ,0.875,0.65,"{'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+953,NeuralPLexer,6WTN_RXT,0.11111111111111113,0.9555555555555555,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+954,NeuralPLexer,7QFM_AY3,0.11764705882352944,0.9529411764705882,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+955,NeuralPLexer,7MSR_DCA,0.8260869565217391,0.6695652173913044,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 3, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+956,NeuralPLexer,5SAK_ZRY,,0.0,,
+957,NeuralPLexer,7QTA_URI,1.0,0.6,{},"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}"
+958,NeuralPLexer,7RSV_7IQ,0.8333333333333334,0.6666666666666666,"{'UNL:ASP:VdWContact': 3, 'UNL:HIS:VdWContact': 1}","{'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1}"
+959,NeuralPLexer,8DSC_NCA,0.5714285714285714,0.7714285714285715,"{'UNL:ARG:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1}"
+960,NeuralPLexer,7AKL_RK5,0.2857142857142856,0.8857142857142858,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3}"
+961,NeuralPLexer,7XBV_APC,0.3000000000000001,0.88,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+962,NeuralPLexer,7CNS_PMV,0.7142857142857144,0.7142857142857142,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+963,NeuralPLexer,7ZDY_6MJ,0.1111111111111111,0.9555555555555556,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+964,NeuralPLexer,6Z4N_Q7B,0.6470588235294118,0.7411764705882353,"{'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2}"
+965,NeuralPLexer,7NFB_GEN,0.3529411764705882,0.8588235294117648,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1}"
+966,NeuralPLexer,7R7R_AWJ,0.5555555555555557,0.7777777777777777,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+967,NeuralPLexer,7V14_ORU,0.22727272727272724,0.9090909090909091,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:Hydrophobic': 2, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+968,NeuralPLexer,6YR2_T1C,0.26315789473684215,0.8947368421052632,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+969,NeuralPLexer,7JG0_GAR,0.3076923076923077,0.8769230769230769,"{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:V:VdWContact': 1}"
+970,NeuralPLexer,7EBG_J0L,0.7,0.72,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+971,NeuralPLexer,8AY3_OE3,0.5,0.8,"{'UNL:ALA:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 4}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+972,NeuralPLexer,7M6K_YRJ,0.5000000000000001,0.7999999999999999,"{'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+973,NeuralPLexer,6YT6_PKE,0.35,0.86,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+974,NeuralPLexer,7Q27_8KC,0.29166666666666663,0.8833333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+975,NeuralPLexer,8DHG_T78,0.5789473684210527,0.7684210526315789,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+976,NeuralPLexer,8EXL_799,0.6521739130434782,0.7391304347826088,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}"
+977,NeuralPLexer,7FB7_8NF,0.4285714285714286,0.8285714285714285,"{'UNL:ALA:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1}"
+978,NeuralPLexer,7THI_PGA,0.9166666666666665,0.6333333333333334,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+979,NeuralPLexer,6ZAE_ACV,0.11111111111111113,0.9555555555555555,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+980,NeuralPLexer,7MGY_ZD1,0.05555555555555555,0.9777777777777777,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+981,NeuralPLexer,7XPO_UPG,0.6470588235294117,0.7411764705882353,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+982,NeuralPLexer,7SUC_COM,,0.0,,
+983,NeuralPLexer,7BJJ_TVW,0.11111111111111116,0.9555555555555555,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+984,NeuralPLexer,7K0V_VQP,0.20689655172413787,0.9172413793103449,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+985,NeuralPLexer,7TE8_P0T,0.16666666666666663,0.9333333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+986,NeuralPLexer,7QF4_RBF,0.4500000000000001,0.82,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}"
+987,NeuralPLexer,7UJ4_OQ4,0.3809523809523808,0.8476190476190477,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+988,NeuralPLexer,7A9H_TPP,0.34782608695652173,0.8608695652173913,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+989,NeuralPLexer,7LEV_0JO,0.3181818181818183,0.8727272727272727,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 4, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 4, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 2}"
+990,NeuralPLexer,7N6F_0I1,0.31578947368421056,0.8736842105263158,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+991,NeuralPLexer,8EAB_VN2,0.7142857142857142,0.7142857142857143,"{'UNL:ASN:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 7, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:HBAcceptor': 2, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+992,NeuralPLexer,6ZC3_JOR,0.7142857142857143,0.7142857142857143,"{'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+993,NeuralPLexer,7Q25_8J9,,0.0,,
+994,NeuralPLexer,7C3U_AZG,0.30769230769230765,0.8769230769230769,"{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2}"
+995,NeuralPLexer,7ROR_69X,0.5000000000000001,0.7999999999999999,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 3, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+996,NeuralPLexer,7MMH_ZJY,0.4827586206896552,0.806896551724138,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+997,NeuralPLexer,7TH4_FFO,0.5625,0.775,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+998,NeuralPLexer,8D39_QDB,0.23076923076923084,0.9076923076923077,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+999,NeuralPLexer,7YZU_DO7,0.4000000000000001,0.84,"{'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 2}"
+1000,NeuralPLexer,5SB2_1K2,0.2692307692307692,0.8923076923076924,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1001,NeuralPLexer,6M73_FNR,0.2857142857142857,0.8857142857142857,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1002,NeuralPLexer,8B8H_OJQ,0.2857142857142858,0.8857142857142857,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}"
+1003,NeuralPLexer,7TOM_5AD,0.5217391304347827,0.7913043478260869,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1004,NeuralPLexer,7VWF_K55,0.3076923076923078,0.8769230769230769,"{'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 1}"
+1005,NeuralPLexer,7XI7_4RI,0.0,1.0,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1006,NeuralPLexer,7AN5_RDH,0.7142857142857144,0.7142857142857142,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+1007,NeuralPLexer,7B2C_TP7,,0.0,,
+1008,NeuralPLexer,7B94_ANP,0.12000000000000005,0.952,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1009,NeuralPLexer,7NF0_BYN,0.45161290322580644,0.8193548387096774,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1}"
+1010,NeuralPLexer,7WKL_CAQ,0.0,1.0,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1011,NeuralPLexer,7WPW_F15,0.2380952380952382,0.9047619047619048,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1012,NeuralPLexer,8SLG_G5A,0.6666666666666666,0.7333333333333334,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 3, 'UNL:GLU:VdWContact': 5, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+1013,NeuralPLexer,7RNI_60I,,0.0,,
+1014,NeuralPLexer,7SZA_DUI,0.36842105263157887,0.8526315789473684,"{'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+1015,NeuralPLexer,7PIH_7QW,0.18181818181818174,0.9272727272727272,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+1016,NeuralPLexer,7T3E_SLB,0.9285714285714285,0.6285714285714286,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2}"
+1017,NeuralPLexer,7FRX_O88,,0.0,,
+1018,NeuralPLexer,8CNH_V6U,0.2631578947368421,0.8947368421052632,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+1019,NeuralPLexer,7C8Q_DSG,,0.0,,
+1020,NeuralPLexer,7ZF0_DHR,0.25,0.9,"{'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 3}"
+1021,NeuralPLexer,8G0V_YHT,0.30434782608695654,0.8782608695652174,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1022,NeuralPLexer,7P5T_5YG,0.6363636363636365,0.7454545454545454,"{'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+1023,NeuralPLexer,7NU0_DCL,0.08333333333333334,0.9666666666666667,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1024,NeuralPLexer,6Z0R_Q4H,0.4615384615384617,0.8153846153846154,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1}"
+1025,NeuralPLexer,7XRL_FWK,0.3125,0.875,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1026,NeuralPLexer,7LOU_IFM,0.41666666666666674,0.8333333333333333,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:UDP:VdWContact': 1}"
+1027,NeuralPLexer,7ROU_66I,0.8275862068965517,0.6689655172413793,"{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+1028,NeuralPLexer,6XCT_478,0.380952380952381,0.8476190476190476,"{'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 5, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1029,NeuralPLexer,7LT0_ONJ,0.2727272727272727,0.8909090909090909,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}"
+1030,NeuralPLexer,7OLI_8HG,0.1499999999999999,0.9400000000000001,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2}"
+1031,NeuralPLexer,7Z1Q_NIO,0.27272727272727276,0.8909090909090909,"{'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+1032,NeuralPLexer,6YQW_82I,0.16666666666666666,0.9333333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1033,NeuralPLexer,6T88_MWQ,0.5384615384615383,0.7846153846153847,"{'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1034,NeuralPLexer,7PRI_7TI,0.41176470588235287,0.8352941176470589,"{'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 3}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:VdWContact': 1}"
+1035,NeuralPLexer,7OFF_VCB,0.5333333333333333,0.7866666666666666,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+1036,NeuralPLexer,7DQL_4CL,0.5454545454545454,0.7818181818181819,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 3}"
+1037,NeuralPLexer,7O1T_5X8,0.24000000000000005,0.904,"{'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:CYS:Hydrophobic': 2, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+1038,NeuralPLexer,7KM8_WPD,0.45000000000000007,0.82,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 4, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+1039,NeuralPLexer,7ZXV_45D,0.40740740740740744,0.837037037037037,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 3}","{'UNL::Hydrophobic': 1, 'UNL::VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 5, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+1040,NeuralPLexer,7X5N_5M5,0.08333333333333326,0.9666666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1041,NeuralPLexer,7VQ9_ISY,0.8125,0.675,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+1042,NeuralPLexer,7PJQ_OWH,0.1538461538461538,0.9384615384615385,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+1043,NeuralPLexer,8AQL_PLG,0.10526315789473678,0.9578947368421052,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 4, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 4, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1044,NeuralPLexer,7VC5_9SF,0.35714285714285715,0.8571428571428572,"{'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1045,NeuralPLexer,7AFX_R9K,0.5,0.8,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1}"
+1046,NeuralPLexer,7RKW_5TV,0.33333333333333337,0.8666666666666667,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+1047,NeuralPLexer,7TYP_KUR,0.4285714285714285,0.8285714285714286,"{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 4, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 6, 'UNL:VAL:VdWContact': 5}","{'UNL:ALA:Hydrophobic': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 2, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+1048,NeuralPLexer,7L03_F9F,0.08333333333333348,0.9666666666666666,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1049,NeuralPLexer,7P1F_KFN,1.0,0.6,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1050,NeuralPLexer,7O0N_CDP,0.625,0.75,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 5, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 5, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+1051,NeuralPLexer,7MYU_ZR7,0.2727272727272727,0.8909090909090909,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+1052,NeuralPLexer,6YSP_PAL,1.2941176470588234,0.48235294117647065,"{'UNL:ARG:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 3, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 4, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2}"
+1053,NeuralPLexer,7XJN_NSD,0.909090909090909,0.6363636363636365,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+1054,NeuralPLexer,7R6J_2I7,0.3478260869565218,0.8608695652173912,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 2, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1055,NeuralPLexer,8HFN_XGC,0.5454545454545454,0.7818181818181819,"{'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 4, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1056,NeuralPLexer,7BTT_F8R,0.125,0.95,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+1057,NeuralPLexer,7MY1_IPE,0.38888888888888895,0.8444444444444444,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+1058,NeuralPLexer,8FO5_Y4U,0.6,0.76,"{'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 4, 'UNL:TYR:VdWContact': 3}","{'UNL:GLN:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2}"
+1059,NeuralPLexer,8AUH_L9I,0.2666666666666667,0.8933333333333333,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:CYS:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+1060,NeuralPLexer,7ECR_SIN,0.5384615384615383,0.7846153846153847,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1061,NeuralPLexer,6TW5_9M2,0.17647058823529416,0.9294117647058824,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1062,NeuralPLexer,7ELT_TYM,0.3666666666666666,0.8533333333333334,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 3}"
+1063,NeuralPLexer,7D5C_GV6,0.22222222222222227,0.9111111111111111,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1064,NeuralPLexer,7W06_ITN,0.5,0.8,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 2}"
+1065,NeuralPLexer,6YJA_2BA,0.20833333333333337,0.9166666666666666,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1066,NeuralPLexer,7P1M_4IU,0.7499999999999998,0.7000000000000001,"{'UNL:ARG:VdWContact': 3, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+1067,NeuralPLexer,7PGX_FMN,0.28571428571428564,0.8857142857142858,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}"
+1068,NeuralPLexer,7UAS_MBU,0.25000000000000006,0.9,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+1069,NeuralPLexer,8GFD_ZHR,0.1875,0.925,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1070,NeuralPLexer,7CTM_BDP,0.6666666666666666,0.7333333333333334,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CSD:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1}"
+1071,NeuralPLexer,7UQ3_O2U,0.5,0.8,"{'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1072,NeuralPLexer,7DKT_GLF,0.5454545454545454,0.7818181818181819,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+1073,NeuralPLexer,7CNQ_G8X,,0.0,,
+1074,NeuralPLexer,6Z1C_7EY,0.3125,0.875,"{'UNL:ASP:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 2}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 2}"
+1075,NeuralPLexer,7M3H_YPV,0.7857142857142859,0.6857142857142856,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1}"
+1076,NeuralPLexer,7D6O_MTE,,0.0,,
+1077,NeuralPLexer,7N4W_P4V,0.4117647058823529,0.8352941176470589,"{'UNL:ALA:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1078,NeuralPLexer,6Z2C_Q5E,0.3846153846153846,0.8461538461538461,"{'UNL:ARG:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1079,NeuralPLexer,7CIJ_G0C,0.2000000000000001,0.9199999999999999,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2}"
+1080,NeuralPLexer,7USH_82V,0.4285714285714285,0.8285714285714286,"{'UNL:ASN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}"
+1081,NeuralPLexer,7XG5_PLP,0.23529411764705885,0.9058823529411765,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}"
+1082,NeuralPLexer,7PT3_3KK,0.3750000000000001,0.85,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 3, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 4, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1083,NeuralPLexer,7KB1_WBJ,0.4,0.84,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+1084,NeuralPLexer,7WUX_6OI,,0.0,,
+1085,NeuralPLexer,7OZ9_NGK,0.875,0.65,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1}","{'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1}"
+1086,NeuralPLexer,7N03_ZRP,0.4736842105263159,0.8105263157894737,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1087,NeuralPLexer,7BMI_U4B,1.0,0.6,"{'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+1088,NeuralPLexer,7RZL_NPO,0.25,0.9,"{'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1089,NeuralPLexer,7QHL_D5P,0.38095238095238104,0.8476190476190476,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 3, 'UNL:LYS:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+1090,NeuralPLexer,7N7B_T3F,0.3181818181818181,0.8727272727272728,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+1091,NeuralPLexer,7Q5I_I0F,0.12,0.952,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}"
+1092,NeuralPLexer,7BKA_4JC,0.11764705882352944,0.9529411764705882,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1093,NeuralPLexer,7NXO_UU8,0.09090909090909094,0.9636363636363636,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1094,NeuralPLexer,6XG5_TOP,0.25,0.9,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1}"
+1095,NeuralPLexer,6XBO_5MC,0.9999999999999999,0.6000000000000001,"{'UNL:ALA:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}"
+1096,NeuralPLexer,8DKO_TFB,0.2727272727272727,0.8909090909090909,"{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+1097,NeuralPLexer,7LJN_GTP,0.4210526315789473,0.8315789473684211,"{'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+1098,NeuralPLexer,7MOI_HPS,0.41666666666666674,0.8333333333333333,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 1}"
+1099,NeuralPLexer,8G6P_API,0.5333333333333334,0.7866666666666666,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1}"
+1100,NeuralPLexer,7ULC_56B,0.27272727272727265,0.890909090909091,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+1101,NeuralPLexer,7RC3_SAH,0.17391304347826086,0.9304347826086956,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+1102,NeuralPLexer,7SFO_98L,0.5263157894736841,0.7894736842105263,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 4, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1}"
+1103,NeuralPLexer,8DP2_UMA,0.28,0.888,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}"
+1104,NeuralPLexer,7ZZW_KKW,1.1875,0.525,"{'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:VdWContact': 2}"
+1105,NeuralPLexer,7XFA_D9J,0.14285714285714285,0.9428571428571428,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}"
+1106,NeuralPLexer,7NP6_UK8,0.5357142857142857,0.7857142857142857,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1107,NeuralPLexer,7F5D_EUO,0.2666666666666667,0.8933333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+1108,NeuralPLexer,6TW7_NZB,0.2666666666666666,0.8933333333333333,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+1109,NeuralPLexer,7FHA_ADX,0.40000000000000013,0.84,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 1}"
+1110,NeuralPLexer,7ES1_UDP,0.19999999999999998,0.92,"{'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1111,NeuralPLexer,7OEO_V9Z,0.16666666666666669,0.9333333333333333,"{'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}"
+1112,NeuralPLexer,7DUA_HJ0,1.0,0.6,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+1113,NeuralPLexer,7BCP_GCO,0.4000000000000001,0.84,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1}"
+1114,NeuralPLexer,7P2I_MFU,0.5454545454545454,0.7818181818181819,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2}"
+1115,NeuralPLexer,7WDT_NGS,1.0,0.6,"{'UNL:ASP:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+1116,NeuralPLexer,8AEM_LVF,0.6153846153846154,0.7538461538461538,"{'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:MET:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1117,NeuralPLexer,7WY1_D0L,0.39999999999999997,0.8400000000000001,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 4, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1118,NeuralPLexer,7KRU_ATP,0.25000000000000006,0.9,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 5, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 6, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2}"
+1119,NeuralPLexer,7P4C_5OV,0.5000000000000001,0.7999999999999999,"{'UNL:ASP:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:VdWContact': 2}"
+1120,NeuralPLexer,7MWN_WI5,0.22727272727272735,0.9090909090909091,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 4}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+1121,NeuralPLexer,7ZHP_IQY,0.2800000000000001,0.888,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1122,NeuralPLexer,7W05_GMP,0.8461538461538461,0.6615384615384615,"{'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+1123,NeuralPLexer,7UJF_R3V,0.4999999999999999,0.8,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+1124,NeuralPLexer,7LOE_Y84,0.5,0.8,"{'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3}"
+1125,NeuralPLexer,8AIE_M7L,0.47058823529411764,0.8117647058823529,"{'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 3, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+1126,NeuralPLexer,7JY3_VUD,0.1111111111111111,0.9555555555555556,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+1127,NeuralPLexer,6XM9_V55,0.0,1.0,"{'UNL:ARG:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1128,NeuralPLexer,7POM_7VZ,0.2631578947368422,0.8947368421052632,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:HIS:HBDonor': 2, 'UNL:HIS:VdWContact': 4, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+1129,NeuralPLexer,7M31_TDR,,0.0,,
+1130,NeuralPLexer,8EYE_X4I,0.4347826086956523,0.826086956521739,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:Hydrophobic': 3, 'UNL:GLU:VdWContact': 4, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 5, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1131,NeuralPLexer,6YRV_PJ8,0.20833333333333331,0.9166666666666666,"{'UNL:ALA:Hydrophobic': 4, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 3, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+1132,NeuralPLexer,7LZD_YHY,0.22222222222222227,0.9111111111111111,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:Hydrophobic': 4, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+1133,NeuralPLexer,7EPV_FDA,0.41666666666666663,0.8333333333333334,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 4, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}"
+1134,NeuralPLexer,7UY4_SMI,0.3571428571428571,0.8571428571428572,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+1135,NeuralPLexer,7N4N_0BK,0.4666666666666668,0.8133333333333332,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+1136,NeuralPLexer,7UMW_NAD,0.16666666666666663,0.9333333333333333,"{'UNL:ALA:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBAcceptor': 2, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1137,NeuralPLexer,7U3J_L6U,0.8461538461538461,0.6615384615384615,"{'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 3}"
+1138,NeuralPLexer,6Z14_Q4Z,0.41666666666666674,0.8333333333333333,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+1139,NeuralPLexer,6ZK5_IMH,0.42105263157894735,0.8315789473684211,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1140,NeuralPLexer,7QGP_DJ8,0.2727272727272727,0.8909090909090909,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+1141,NeuralPLexer,7L5F_XNG,0.7777777777777778,0.6888888888888889,"{'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1142,NeuralPLexer,7FT9_4MB,0.6,0.76,"{'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+1143,NeuralPLexer,7OP9_06K,,0.0,,
+1144,NeuralPLexer,7JXX_VP7,0.375,0.85,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1145,NeuralPLexer,7CL8_TES,0.6666666666666666,0.7333333333333334,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1146,NeuralPLexer,7TM6_GPJ,0.8571428571428572,0.6571428571428571,"{'UNL:ARG:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 2}"
+1147,NeuralPLexer,7WQQ_5Z6,0.3529411764705883,0.8588235294117647,"{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 4, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:Hydrophobic': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 4, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+1148,NeuralPLexer,7WL4_JFU,0.15000000000000005,0.94,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+1149,NeuralPLexer,7SCW_GSP,0.1071428571428571,0.9571428571428572,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 4, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+1150,NeuralPLexer,7L7C_XQ1,0.2666666666666667,0.8933333333333333,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 3, 'UNL:GLN:VdWContact': 3, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1}","{'UNL:GLN:Hydrophobic': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PRO:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}"
+1151,NeuralPLexer,7PUV_84Z,0.1764705882352941,0.9294117647058824,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1152,NeuralPLexer,7KQU_YOF,0.42105263157894735,0.8315789473684211,"{'UNL:GLY:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+1153,NeuralPLexer,7Z2O_IAJ,0.30769230769230765,0.8769230769230769,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}"
+1154,NeuralPLexer,7PRM_81I,0.40909090909090906,0.8363636363636364,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+1155,NeuralPLexer,8FLV_ZB9,0.13043478260869568,0.9478260869565217,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+1156,NeuralPLexer,7NLV_UJE,0.631578947368421,0.7473684210526316,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 2, 'UNL:SER:VdWContact': 4, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+1157,NeuralPLexer,7T0D_FPP,0.42857142857142866,0.8285714285714285,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 5}"
+1158,NeuralPLexer,7MWU_ZPM,0.18181818181818177,0.9272727272727272,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+1159,NeuralPLexer,7L00_XCJ,0.7,0.72,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1160,NeuralPLexer,8C5M_MTA,0.0,1.0,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1161,NeuralPLexer,7Z7F_IF3,0.4615384615384615,0.8153846153846154,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+1162,NeuralPLexer,7TSF_H4B,0.47058823529411764,0.8117647058823529,"{'UNL:ARG:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}"
+1163,NeuralPLexer,7TUO_KL9,0.1071428571428571,0.9571428571428572,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1164,NeuralPLexer,7ED2_A3P,0.611111111111111,0.7555555555555555,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+1165,NeuralPLexer,7ZL5_IWE,0.5,0.8,"{'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1}"
+1166,NeuralPLexer,8F8E_XJI,0.2608695652173912,0.8956521739130435,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+1167,NeuralPLexer,7OZC_G6S,0.6428571428571429,0.7428571428571429,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:HIS:VdWContact': 3, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+1168,NeuralPLexer,7Q2B_M6H,0.33333333333333337,0.8666666666666667,"{'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}","{'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1169,NeuralPLexer,6VTA_AKN,0.5454545454545454,0.7818181818181819,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1}"
+1170,NeuralPLexer,7V3N_AKG,0.6470588235294118,0.7411764705882353,"{'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1171,NeuralPLexer,8F4J_PHO,,0.0,,
+1172,NeuralPLexer,7ZOC_T8E,0.6153846153846152,0.7538461538461539,"{'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 4, 'UNL:HIS:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+1173,NeuralPLexer,7WCF_ACP,0.2083333333333333,0.9166666666666667,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 3, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+1174,NeuralPLexer,7NUT_GLP,0.375,0.85,"{'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1}"
+1175,NeuralPLexer,7E4L_MDN,0.5454545454545453,0.7818181818181819,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+1176,NeuralPLexer,7TS6_KMI,0.0714285714285714,0.9714285714285714,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1177,NeuralPLexer,7NF3_4LU,0.4827586206896552,0.806896551724138,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+1178,NeuralPLexer,8D5D_5DK,0.4782608695652173,0.808695652173913,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 5, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1179,NeuralPLexer,7JMV_4NC,0.4117647058823529,0.8352941176470589,"{'UNL:ARG:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2}","{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1180,NeuralPLexer,7A9E_R4W,0.75,0.7,"{'UNL:ARG:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+1181,NeuralPLexer,7TBU_S3P,0.2142857142857143,0.9142857142857143,"{'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1}"
+1182,NeuralPLexer,7TB0_UD1,0.3214285714285715,0.8714285714285714,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 2}"
+1183,NeuralPLexer,7MFP_Z7P,0.25,0.9,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:HBDonor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 5, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:Hydrophobic': 3, 'UNL:THR:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}"
+1184,NeuralPLexer,6M2B_EZO,0.3500000000000001,0.86,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1185,NeuralPLexer,7NPL_UKZ,0.4333333333333334,0.8266666666666667,"{'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 4}","{'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1186,NeuralPLexer,7KZ9_XN7,0.5833333333333333,0.7666666666666667,"{'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+1187,NeuralPLexer,7QE4_NGA,,0.0,,
+1188,NeuralPLexer,8AP0_PRP,0.6000000000000001,0.76,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+1189,NeuralPLexer,7V3S_5I9,0.4782608695652174,0.808695652173913,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 3, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3}"
+1190,NeuralPLexer,7C0U_FGO,0.5416666666666665,0.7833333333333334,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 4}"
+1191,NeuralPLexer,7UXS_OJC,0.38095238095238093,0.8476190476190476,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1}"
+1192,NeuralPLexer,7X9K_8OG,0.3913043478260869,0.8434782608695652,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+1193,NeuralPLexer,8BOM_QU6,0.2142857142857143,0.9142857142857143,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1194,NeuralPLexer,8BTI_RFO,0.5333333333333332,0.7866666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+1195,NeuralPLexer,7RWS_4UR,0.588235294117647,0.7647058823529412,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1196,NeuralPLexer,6YQV_8K2,0.625,0.75,"{'UNL:ARG:VdWContact': 1, 'UNL:LEU:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1197,NeuralPLexer,7PK0_BYC,0.27586206896551724,0.8896551724137931,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+1198,NeuralPLexer,5SIS_JSM,0.09523809523809523,0.9619047619047619,"{'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1199,NeuralPLexer,7NSW_HC4,0.6842105263157896,0.7263157894736841,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:Hydrophobic': 5, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+1200,NeuralPLexer,7F8T_FAD,0.37931034482758624,0.8482758620689654,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 4, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1201,NeuralPLexer,5SD5_HWI,0.5789473684210525,0.768421052631579,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+1202,NeuralPLexer,7CUO_PHB,0.05882352941176472,0.9764705882352941,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+1203,NeuralPLexer,7R3D_APR,0.1666666666666667,0.9333333333333333,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 4}"
+1204,NeuralPLexer,7WJB_BGC,0.1538461538461539,0.9384615384615385,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+1205,NeuralPLexer,7A1P_QW2,0.31578947368421045,0.8736842105263158,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+1206,NeuralPLexer,6ZPB_3D1,0.375,0.85,"{'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+1207,NeuralPLexer,7UTW_NAI,0.37037037037037046,0.8518518518518519,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 5, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 3}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 3}"
+1208,NeuralPLexer,7WUY_76N,0.55,0.78,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1209,NeuralPLexer,8A2D_KXY,0.16666666666666663,0.9333333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3}"
+1210,NeuralPLexer,7NR8_UOE,,0.0,,
+1211,NeuralPLexer,7KC5_BJZ,0.2142857142857143,0.9142857142857143,"{'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+1212,NeuralPLexer,7QPP_VDX,0.3500000000000001,0.86,"{'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+1213,NeuralPLexer,7VKZ_NOJ,0.6153846153846154,0.7538461538461538,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 3}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 2}"
+1214,NeuralPLexer,7F51_BA7,0.29629629629629634,0.8814814814814814,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 2}"
+1215,NeuralPLexer,7PL1_SFG,0.2400000000000001,0.9039999999999999,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+1216,NeuralPLexer,7VB8_STL,0.2666666666666666,0.8933333333333333,"{'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+1217,NeuralPLexer,8FAV_4Y5,0.6153846153846153,0.7538461538461538,"{'UNL:ALA:Hydrophobic': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 3, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1218,NeuralPLexer,7CD9_FVR,0.2857142857142857,0.8857142857142857,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3}"
+1219,NeuralPLexer,7N7H_CTP,0.16129032258064524,0.9354838709677419,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 4, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 3, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 4, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+1220,NeuralPLexer,7ODY_DGI,0.4,0.84,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2}"
+1221,NeuralPLexer,8CSD_C5P,0.5,0.8,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 2, 'UNL:SER:VdWContact': 3, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+1222,NeuralPLexer,7OFK_VCH,0.37499999999999994,0.8500000000000001,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+1223,NeuralPLexer,7SDD_4IP,0.46666666666666656,0.8133333333333334,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+1224,NeuralPLexer,7OPG_06N,0.1428571428571429,0.9428571428571428,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 4}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3}"
+1225,NeuralPLexer,7ZTL_BCN,0.14285714285714285,0.9428571428571428,"{'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+1226,NeuralPLexer,7SIU_9ID,0.3333333333333334,0.8666666666666667,"{'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 4, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+1227,NeuralPLexer,7LCU_XTA,0.7368421052631579,0.7052631578947368,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1228,NeuralPLexer,7NGW_UAW,0.4705882352941177,0.8117647058823529,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1229,NeuralPLexer,7VYJ_CA0,0.08695652173913038,0.9652173913043478,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1230,NeuralPLexer,7QHG_T3B,0.5000000000000001,0.7999999999999999,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 4, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+1231,NeuralPLexer,8HO0_3ZI,0.5,0.8,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1232,RFAA,8AAU_LH0,,0.0,,
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+1234,RFAA,6ZCY_QF8,0.3333333333333333,0.8666666666666667,"{'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+1235,RFAA,7UAW_MF6,,0.0,,
+1236,RFAA,6YMS_OZH,0.27272727272727265,0.890909090909091,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1237,RFAA,7UJ5_DGL,,0.0,,
+1238,RFAA,8EX2_Q2Q,0.1538461538461538,0.9384615384615385,"{'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+1239,RFAA,7R9N_F97,,0.0,,
+1240,RFAA,7UYB_OK0,,0.0,,
+1241,RFAA,7U0U_FK5,0.2413793103448277,0.9034482758620689,"{'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 4, 'UNL:TYR:VdWContact': 4, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU-:Hydrophobic': 1, 'UNL:GLU-:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE-:Hydrophobic': 1, 'UNL:PHE-:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:PRO-:Hydrophobic': 1, 'UNL:TRP-:HBAcceptor': 1, 'UNL:TRP-:Hydrophobic': 1, 'UNL:TRP-:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+1242,RFAA,7ZU2_DHT,,0.0,,
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+1244,RFAA,7OSO_0V1,,0.0,,
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+1246,RFAA,7MGT_ZD4,,0.0,,
+1247,RFAA,8C3N_ADP,0.5,0.8,"{'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+1248,RFAA,6YYO_Q1K,,0.0,,
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+1250,RFAA,7XQZ_FPF,,0.0,,
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+1252,RFAA,7OMX_CNA,,0.0,,
+1253,RFAA,7LMO_NYO,0.6999999999999998,0.7200000000000001,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:TYR:Hydrophobic': 5, 'UNL:TYR:VdWContact': 5, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 4, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1254,RFAA,7VBU_6I4,,0.0,,
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+1257,RFAA,7R59_I5F,0.29999999999999993,0.88,"{'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+1258,RFAA,7ZCC_OGA,,0.0,,
+1259,RFAA,7V43_C4O,0.5714285714285714,0.7714285714285715,"{'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 4, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}"
+1260,RFAA,7BNH_BEZ,,0.0,,
+1261,RFAA,6WTN_RXT,0.11764705882352944,0.9529411764705882,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
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+1263,RFAA,7MSR_DCA,0.7599999999999999,0.6960000000000001,"{'UNL:ALA:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 3, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 3, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
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+1371,RFAA,7D5C_GV6,0.24000000000000002,0.904,"{'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
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+1386,RFAA,6Z2C_Q5E,,0.0,,
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+1390,RFAA,7PT3_3KK,0.3125,0.875,"{'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBDonor': 2, 'UNL:ARG:VdWContact': 5, 'UNL:ASP:VdWContact': 4, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 5, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 4, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1391,RFAA,7KB1_WBJ,,0.0,,
+1392,RFAA,7WUX_6OI,,0.0,,
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+1394,RFAA,7N03_ZRP,0.04761904761904767,0.9809523809523809,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1395,RFAA,7BMI_U4B,,0.0,,
+1396,RFAA,7RZL_NPO,0.8125,0.675,"{'UNL:ALA:VdWContact': 3, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1397,RFAA,7QHL_D5P,,0.0,,
+1398,RFAA,7N7B_T3F,,0.0,,
+1399,RFAA,7Q5I_I0F,,0.0,,
+1400,RFAA,7BKA_4JC,,0.0,,
+1401,RFAA,7NXO_UU8,,0.0,,
+1402,RFAA,6XG5_TOP,,0.0,,
+1403,RFAA,6XBO_5MC,0.41176470588235287,0.8352941176470589,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}"
+1404,RFAA,8DKO_TFB,,0.0,,
+1405,RFAA,7LJN_GTP,,0.0,,
+1406,RFAA,7MOI_HPS,0.3529411764705882,0.8588235294117648,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 1}"
+1407,RFAA,8G6P_API,,0.0,,
+1408,RFAA,7ULC_56B,0.6842105263157896,0.7263157894736841,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 5, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+1409,RFAA,7RC3_SAH,,0.0,,
+1410,RFAA,7SFO_98L,,0.0,,
+1411,RFAA,8DP2_UMA,,0.0,,
+1412,RFAA,7ZZW_KKW,,0.0,,
+1413,RFAA,7XFA_D9J,,0.0,,
+1414,RFAA,7NP6_UK8,0.7037037037037037,0.7185185185185186,"{'UNL:ALA:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1415,RFAA,7F5D_EUO,,0.0,,
+1416,RFAA,6TW7_NZB,,0.0,,
+1417,RFAA,7FHA_ADX,,0.0,,
+1418,RFAA,7ES1_UDP,,0.0,,
+1419,RFAA,7OEO_V9Z,0.47058823529411764,0.8117647058823529,"{'UNL:ASN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}"
+1420,RFAA,7DUA_HJ0,,0.0,,
+1421,RFAA,7BCP_GCO,,0.0,,
+1422,RFAA,7P2I_MFU,0.3125,0.875,"{'UNL:ALA:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2}"
+1423,RFAA,7WDT_NGS,,0.0,,
+1424,RFAA,8AEM_LVF,,0.0,,
+1425,RFAA,7WY1_D0L,,0.0,,
+1426,RFAA,7KRU_ATP,,0.0,,
+1427,RFAA,7P4C_5OV,0.33333333333333337,0.8666666666666667,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:VdWContact': 2}"
+1428,RFAA,7MWN_WI5,,0.0,,
+1429,RFAA,7ZHP_IQY,,0.0,,
+1430,RFAA,7W05_GMP,,0.0,,
+1431,RFAA,7UJF_R3V,,0.0,,
+1432,RFAA,7LOE_Y84,0.5000000000000001,0.7999999999999999,"{'UNL:ALA:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3}"
+1433,RFAA,8AIE_M7L,,0.0,,
+1434,RFAA,7JY3_VUD,,0.0,,
+1435,RFAA,6XM9_V55,0.7500000000000001,0.7,"{'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 4, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2}","{'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1436,RFAA,7POM_7VZ,,0.0,,
+1437,RFAA,7M31_TDR,,0.0,,
+1438,RFAA,8EYE_X4I,,0.0,,
+1439,RFAA,6YRV_PJ8,,0.0,,
+1440,RFAA,7LZD_YHY,0.6875,0.725,"{'UNL:ARG:VdWContact': 1, 'UNL:MET:VdWContact': 2, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 5, 'UNL:TYR:VdWContact': 4}","{'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:Hydrophobic': 4, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+1441,RFAA,7EPV_FDA,0.19230769230769224,0.9230769230769231,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:HBAcceptor': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}"
+1442,RFAA,7UY4_SMI,0.38888888888888895,0.8444444444444444,"{'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 5, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+1443,RFAA,7N4N_0BK,0.2777777777777778,0.8888888888888888,"{'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+1444,RFAA,7UMW_NAD,0.4642857142857143,0.8142857142857143,"{'UNL:ALA:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 4, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 5, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 4, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBAcceptor': 2, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1445,RFAA,7U3J_L6U,,0.0,,
+1446,RFAA,6Z14_Q4Z,0.15384615384615385,0.9384615384615385,"{'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+1447,RFAA,6ZK5_IMH,,0.0,,
+1448,RFAA,7QGP_DJ8,,0.0,,
+1449,RFAA,7L5F_XNG,0.18181818181818185,0.9272727272727272,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1450,RFAA,7FT9_4MB,,0.0,,
+1451,RFAA,7OP9_06K,,0.0,,
+1452,RFAA,7JXX_VP7,0.24999999999999997,0.9,"{'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
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+1470,RFAA,7TSF_H4B,,0.0,,
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+1475,RFAA,7OZC_G6S,,0.0,,
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+1485,RFAA,7NF3_4LU,0.5333333333333333,0.7866666666666666,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
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+1505,RFAA,7PK0_BYC,0.33333333333333337,0.8666666666666667,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+1506,RFAA,5SIS_JSM,0.24999999999999994,0.9,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
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+1510,RFAA,7CUO_PHB,0.15789473684210525,0.9368421052631579,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 3, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+1511,RFAA,7R3D_APR,,0.0,,
+1512,RFAA,7WJB_BGC,0.5,0.8,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 4, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
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+1514,RFAA,6ZPB_3D1,,0.0,,
+1515,RFAA,7UTW_NAI,,0.0,,
+1516,RFAA,7WUY_76N,,0.0,,
+1517,RFAA,8A2D_KXY,,0.0,,
+1518,RFAA,7NR8_UOE,,0.0,,
+1519,RFAA,7KC5_BJZ,,0.0,,
+1520,RFAA,7QPP_VDX,0.7619047619047621,0.6952380952380952,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+1521,RFAA,7VKZ_NOJ,,0.0,,
+1522,RFAA,7F51_BA7,,0.0,,
+1523,RFAA,7PL1_SFG,0.1363636363636363,0.9454545454545454,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+1524,RFAA,7VB8_STL,0.30434782608695654,0.8782608695652174,"{'UNL:ALA:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+1525,RFAA,8FAV_4Y5,0.7407407407407407,0.7037037037037037,"{'UNL:ALA:VdWContact': 4, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 7, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 4, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 3}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 3, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1526,RFAA,7CD9_FVR,,0.0,,
+1527,RFAA,7N7H_CTP,,0.0,,
+1528,RFAA,7ODY_DGI,0.4827586206896551,0.806896551724138,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 4, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 6, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2}"
+1529,RFAA,8CSD_C5P,,0.0,,
+1530,RFAA,7OFK_VCH,,0.0,,
+1531,RFAA,7SDD_4IP,,0.0,,
+1532,RFAA,7OPG_06N,,0.0,,
+1533,RFAA,7ZTL_BCN,0.29999999999999993,0.88,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+1534,RFAA,7SIU_9ID,,0.0,,
+1535,RFAA,7LCU_XTA,0.16666666666666674,0.9333333333333333,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1536,RFAA,7NGW_UAW,,0.0,,
+1537,RFAA,7VYJ_CA0,,0.0,,
+1538,RFAA,7QHG_T3B,,0.0,,
+1539,RFAA,8HO0_3ZI,,0.0,,
+1540,Chai-1-Single-Seq,8AAU_LH0,0.21428571428571422,0.9142857142857144,"{'UNL:ALA:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1541,Chai-1-Single-Seq,7JHQ_VAJ,0.5384615384615384,0.7846153846153846,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+1542,Chai-1-Single-Seq,6ZCY_QF8,0.09523809523809529,0.9619047619047619,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+1543,Chai-1-Single-Seq,7UAW_MF6,0.36,0.856,"{'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+1544,Chai-1-Single-Seq,6YMS_OZH,0.22727272727272735,0.9090909090909091,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1545,Chai-1-Single-Seq,7UJ5_DGL,0.11111111111111102,0.9555555555555556,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+1546,Chai-1-Single-Seq,8EX2_Q2Q,0.30769230769230765,0.8769230769230769,"{'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+1547,Chai-1-Single-Seq,7R9N_F97,,0.0,,
+1548,Chai-1-Single-Seq,7UYB_OK0,0.2,0.92,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+1549,Chai-1-Single-Seq,7U0U_FK5,0.4074074074074075,0.837037037037037,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 4, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU-:Hydrophobic': 1, 'UNL:GLU-:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE-:Hydrophobic': 1, 'UNL:PHE-:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:PRO-:Hydrophobic': 1, 'UNL:TRP-:HBAcceptor': 1, 'UNL:TRP-:Hydrophobic': 1, 'UNL:TRP-:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+1550,Chai-1-Single-Seq,7ZU2_DHT,0.1538461538461538,0.9384615384615385,"{'UNL:ASN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 5, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 6, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+1551,Chai-1-Single-Seq,6XHT_V2V,0.33333333333333337,0.8666666666666667,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 4, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:VdWContact': 1}"
+1552,Chai-1-Single-Seq,7OSO_0V1,0.08333333333333337,0.9666666666666667,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2}"
+1553,Chai-1-Single-Seq,8D19_GSH,0.1538461538461538,0.9384615384615385,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+1554,Chai-1-Single-Seq,7MGT_ZD4,0.08695652173913052,0.9652173913043478,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1555,Chai-1-Single-Seq,8C3N_ADP,0.17647058823529413,0.9294117647058824,"{'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+1556,Chai-1-Single-Seq,6YYO_Q1K,0.29999999999999993,0.88,"{'UNL:GLY:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1}"
+1557,Chai-1-Single-Seq,8A1H_DLZ,0.3000000000000001,0.88,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+1558,Chai-1-Single-Seq,7XQZ_FPF,0.08333333333333326,0.9666666666666667,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1559,Chai-1-Single-Seq,7RH3_59O,0.18181818181818185,0.9272727272727272,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 1}"
+1560,Chai-1-Single-Seq,7OMX_CNA,0.23333333333333334,0.9066666666666666,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:HBAcceptor': 2, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 3, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1561,Chai-1-Single-Seq,7LMO_NYO,0.36363636363636376,0.8545454545454545,"{'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 3, 'UNL:PRO:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 4, 'UNL:TYR:VdWContact': 4, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 4, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1562,Chai-1-Single-Seq,7VBU_6I4,0.21428571428571425,0.9142857142857143,"{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1563,Chai-1-Single-Seq,7TXK_LW8,0.1111111111111111,0.9555555555555556,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+1564,Chai-1-Single-Seq,7T1D_E7K,0.5,0.8,"{'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 7, 'UNL:PHE:VdWContact': 4, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 7, 'UNL:PHE:VdWContact': 5, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1565,Chai-1-Single-Seq,7R59_I5F,0.1,0.96,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+1566,Chai-1-Single-Seq,7ZCC_OGA,0.6363636363636364,0.7454545454545455,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:PRO:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+1567,Chai-1-Single-Seq,7V43_C4O,0.7142857142857143,0.7142857142857143,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 4, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}"
+1568,Chai-1-Single-Seq,7BNH_BEZ,0.25,0.9,"{'UNL:ASP:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+1569,Chai-1-Single-Seq,6WTN_RXT,0.05882352941176472,0.9764705882352941,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+1570,Chai-1-Single-Seq,7QFM_AY3,0.21428571428571425,0.9142857142857143,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1571,Chai-1-Single-Seq,7MSR_DCA,0.13043478260869562,0.9478260869565217,"{'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 3, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 3, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1572,Chai-1-Single-Seq,5SAK_ZRY,0.39999999999999997,0.8400000000000001,"{'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+1573,Chai-1-Single-Seq,7QTA_URI,0.0,1.0,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}"
+1574,Chai-1-Single-Seq,7RSV_7IQ,0.21428571428571425,0.9142857142857143,"{'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1}"
+1575,Chai-1-Single-Seq,8DSC_NCA,,0.0,,
+1576,Chai-1-Single-Seq,7AKL_RK5,0.05882352941176472,0.9764705882352941,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3}"
+1577,Chai-1-Single-Seq,7XBV_APC,0.21052631578947373,0.9157894736842105,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1578,Chai-1-Single-Seq,7CNS_PMV,0.26315789473684215,0.8947368421052632,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+1579,Chai-1-Single-Seq,7ZDY_6MJ,,0.0,,
+1580,Chai-1-Single-Seq,6Z4N_Q7B,0.41666666666666663,0.8333333333333334,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2}"
+1581,Chai-1-Single-Seq,7NFB_GEN,0.39999999999999997,0.8400000000000001,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1}"
+1582,Chai-1-Single-Seq,7R7R_AWJ,0.38888888888888884,0.8444444444444444,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1583,Chai-1-Single-Seq,7V14_ORU,0.125,0.95,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1584,Chai-1-Single-Seq,6YR2_T1C,0.4000000000000001,0.84,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+1585,Chai-1-Single-Seq,7JG0_GAR,0.3636363636363637,0.8545454545454545,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:V:VdWContact': 1}"
+1586,Chai-1-Single-Seq,7EBG_J0L,0.3333333333333333,0.8666666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+1587,Chai-1-Single-Seq,8AY3_OE3,0.20000000000000007,0.9199999999999999,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+1588,Chai-1-Single-Seq,7M6K_YRJ,0.14999999999999997,0.9400000000000001,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1589,Chai-1-Single-Seq,6YT6_PKE,,0.0,,
+1590,Chai-1-Single-Seq,7Q27_8KC,0.22222222222222224,0.9111111111111111,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+1591,Chai-1-Single-Seq,8DHG_T78,0.14285714285714296,0.9428571428571428,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 5, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+1592,Chai-1-Single-Seq,8EXL_799,0.15999999999999998,0.936,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}"
+1593,Chai-1-Single-Seq,7FB7_8NF,0.5,0.8,"{'UNL:ASP:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1}"
+1594,Chai-1-Single-Seq,7THI_PGA,0.33333333333333326,0.8666666666666667,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+1595,Chai-1-Single-Seq,6ZAE_ACV,0.22222222222222227,0.9111111111111111,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+1596,Chai-1-Single-Seq,7MGY_ZD1,,0.0,,
+1597,Chai-1-Single-Seq,7XPO_UPG,0.21052631578947373,0.9157894736842105,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+1598,Chai-1-Single-Seq,7SUC_COM,,0.0,,
+1599,Chai-1-Single-Seq,7BJJ_TVW,0.125,0.95,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+1600,Chai-1-Single-Seq,7K0V_VQP,0.11111111111111116,0.9555555555555555,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+1601,Chai-1-Single-Seq,7TE8_P0T,0.523809523809524,0.7904761904761904,"{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+1602,Chai-1-Single-Seq,7QF4_RBF,0.19999999999999996,0.92,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 4, 'UNL:GLN:HBAcceptor': 3, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}"
+1603,Chai-1-Single-Seq,7UJ4_OQ4,0.10526315789473689,0.9578947368421052,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+1604,Chai-1-Single-Seq,7A9H_TPP,0.27586206896551724,0.8896551724137931,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+1605,Chai-1-Single-Seq,7LEV_0JO,0.09090909090909105,0.9636363636363636,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 4, 'UNL:GLY:VdWContact': 4, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 4, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 2}"
+1606,Chai-1-Single-Seq,7N6F_0I1,0.05263157894736842,0.9789473684210527,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1607,Chai-1-Single-Seq,8EAB_VN2,0.39999999999999997,0.8400000000000001,"{'UNL:ASP:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 3, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:HBAcceptor': 2, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+1608,Chai-1-Single-Seq,6ZC3_JOR,0.2857142857142858,0.8857142857142857,"{'UNL:ARG:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1609,Chai-1-Single-Seq,7Q25_8J9,0.21052631578947384,0.9157894736842105,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 3, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+1610,Chai-1-Single-Seq,7C3U_AZG,0.18181818181818185,0.9272727272727272,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2}"
+1611,Chai-1-Single-Seq,7ROR_69X,0.06666666666666665,0.9733333333333334,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+1612,Chai-1-Single-Seq,7MMH_ZJY,0.27586206896551724,0.8896551724137931,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+1613,Chai-1-Single-Seq,7TH4_FFO,0.2857142857142857,0.8857142857142857,"{'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1614,Chai-1-Single-Seq,8D39_QDB,0.09090909090909094,0.9636363636363636,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+1615,Chai-1-Single-Seq,7YZU_DO7,0.04999999999999999,0.98,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 2}"
+1616,Chai-1-Single-Seq,5SB2_1K2,0.12500000000000006,0.95,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1617,Chai-1-Single-Seq,6M73_FNR,0.10714285714285711,0.9571428571428572,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1618,Chai-1-Single-Seq,8B8H_OJQ,0.07407407407407413,0.9703703703703703,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBDonor': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}"
+1619,Chai-1-Single-Seq,7TOM_5AD,0.4090909090909091,0.8363636363636364,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1620,Chai-1-Single-Seq,7VWF_K55,0.19230769230769235,0.923076923076923,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:Hydrophobic': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 1}"
+1621,Chai-1-Single-Seq,7XI7_4RI,0.3076923076923077,0.8769230769230769,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1622,Chai-1-Single-Seq,7AN5_RDH,0.04166666666666663,0.9833333333333334,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+1623,Chai-1-Single-Seq,7B2C_TP7,,0.0,,
+1624,Chai-1-Single-Seq,7B94_ANP,0.2,0.92,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1625,Chai-1-Single-Seq,7NF0_BYN,0.25,0.9,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1}"
+1626,Chai-1-Single-Seq,7WKL_CAQ,0.41666666666666674,0.8333333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1627,Chai-1-Single-Seq,7WPW_F15,0.17647058823529416,0.9294117647058824,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1628,Chai-1-Single-Seq,8SLG_G5A,0.3684210526315789,0.8526315789473684,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 4, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 3, 'UNL:GLU:VdWContact': 5, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+1629,Chai-1-Single-Seq,7RNI_60I,0.3571428571428571,0.8571428571428572,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 3}"
+1630,Chai-1-Single-Seq,7SZA_DUI,0.26086956521739135,0.8956521739130434,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+1631,Chai-1-Single-Seq,7PIH_7QW,0.23809523809523803,0.9047619047619048,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+1632,Chai-1-Single-Seq,7T3E_SLB,0.26666666666666666,0.8933333333333333,"{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2}"
+1633,Chai-1-Single-Seq,7FRX_O88,,0.0,,
+1634,Chai-1-Single-Seq,8CNH_V6U,0.35000000000000003,0.86,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+1635,Chai-1-Single-Seq,7C8Q_DSG,0.11111111111111102,0.9555555555555556,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:DSG:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+1636,Chai-1-Single-Seq,7ZF0_DHR,,0.0,,
+1637,Chai-1-Single-Seq,8G0V_YHT,,0.0,,
+1638,Chai-1-Single-Seq,7P5T_5YG,0.45454545454545453,0.8181818181818181,"{'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+1639,Chai-1-Single-Seq,7NU0_DCL,0.08333333333333326,0.9666666666666667,"{'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1640,Chai-1-Single-Seq,6Z0R_Q4H,0.18181818181818182,0.9272727272727272,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1}","{'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1}"
+1641,Chai-1-Single-Seq,7XRL_FWK,0.1578947368421053,0.9368421052631579,"{'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1642,Chai-1-Single-Seq,7LOU_IFM,0.5454545454545454,0.7818181818181819,"{'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:UDP:VdWContact': 1}"
+1643,Chai-1-Single-Seq,7ROU_66I,0.09677419354838704,0.9612903225806452,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBDonor': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+1644,Chai-1-Single-Seq,6XCT_478,0.1578947368421053,0.9368421052631579,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 5, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1645,Chai-1-Single-Seq,7LT0_ONJ,0.22222222222222215,0.9111111111111111,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}"
+1646,Chai-1-Single-Seq,7OLI_8HG,0.0,1.0,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2}"
+1647,Chai-1-Single-Seq,7Z1Q_NIO,0.09090909090909094,0.9636363636363636,"{'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+1648,Chai-1-Single-Seq,6YQW_82I,0.3,0.88,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1649,Chai-1-Single-Seq,6T88_MWQ,0.30769230769230776,0.8769230769230769,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1650,Chai-1-Single-Seq,7PRI_7TI,0.29411764705882354,0.8823529411764706,"{'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:VdWContact': 1}"
+1651,Chai-1-Single-Seq,7OFF_VCB,0.3333333333333333,0.8666666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 4, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+1652,Chai-1-Single-Seq,7DQL_4CL,0.3846153846153846,0.8461538461538461,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 3}"
+1653,Chai-1-Single-Seq,7O1T_5X8,0.09999999999999994,0.9600000000000001,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:CYS:Hydrophobic': 2, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+1654,Chai-1-Single-Seq,7KM8_WPD,0.14999999999999997,0.9400000000000001,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+1655,Chai-1-Single-Seq,7ZXV_45D,0.3750000000000001,0.85,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL::Hydrophobic': 1, 'UNL::VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 5, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+1656,Chai-1-Single-Seq,7X5N_5M5,0.05555555555555555,0.9777777777777777,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1657,Chai-1-Single-Seq,7VQ9_ISY,0.4666666666666666,0.8133333333333334,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 4, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+1658,Chai-1-Single-Seq,7PJQ_OWH,0.09999999999999998,0.96,"{'UNL:ASN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+1659,Chai-1-Single-Seq,8AQL_PLG,,0.0,,
+1660,Chai-1-Single-Seq,7VC5_9SF,0.6428571428571428,0.7428571428571429,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1661,Chai-1-Single-Seq,7AFX_R9K,0.08333333333333334,0.9666666666666667,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1}"
+1662,Chai-1-Single-Seq,7RKW_5TV,0.2857142857142857,0.8857142857142857,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+1663,Chai-1-Single-Seq,7TYP_KUR,0.38461538461538475,0.846153846153846,"{'UNL:ALA:Hydrophobic': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 5, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 2, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+1664,Chai-1-Single-Seq,7L03_F9F,0.23529411764705882,0.9058823529411765,"{'UNL:ALA:Hydrophobic': 2, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1665,Chai-1-Single-Seq,7P1F_KFN,0.1333333333333333,0.9466666666666667,"{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 5, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1666,Chai-1-Single-Seq,7O0N_CDP,0.2,0.92,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 4, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 5, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+1667,Chai-1-Single-Seq,7MYU_ZR7,0.26086956521739135,0.8956521739130434,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+1668,Chai-1-Single-Seq,6YSP_PAL,0.10526315789473684,0.9578947368421052,"{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 4, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3}","{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 3, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 4, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2}"
+1669,Chai-1-Single-Seq,7XJN_NSD,0.7999999999999999,0.68,"{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+1670,Chai-1-Single-Seq,7R6J_2I7,0.6,0.76,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 3, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 2, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1671,Chai-1-Single-Seq,8HFN_XGC,0.21739130434782605,0.9130434782608696,"{'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1672,Chai-1-Single-Seq,7BTT_F8R,0.07692307692307698,0.9692307692307692,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+1673,Chai-1-Single-Seq,7MY1_IPE,0.2,0.92,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+1674,Chai-1-Single-Seq,8FO5_Y4U,0.8,0.6799999999999999,"{'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 4, 'UNL:TYR:VdWContact': 4}","{'UNL:GLN:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2}"
+1675,Chai-1-Single-Seq,8AUH_L9I,0.3846153846153847,0.8461538461538461,"{'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:CYS:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+1676,Chai-1-Single-Seq,7ECR_SIN,0.7142857142857142,0.7142857142857143,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1677,Chai-1-Single-Seq,6TW5_9M2,0.2857142857142858,0.8857142857142857,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1678,Chai-1-Single-Seq,7ELT_TYM,0.1724137931034484,0.9310344827586207,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:HBDonor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 3}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 3}"
+1679,Chai-1-Single-Seq,7D5C_GV6,0.21428571428571427,0.9142857142857143,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1680,Chai-1-Single-Seq,7W06_ITN,0.22222222222222215,0.9111111111111111,"{'UNL:ALA:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 2}"
+1681,Chai-1-Single-Seq,6YJA_2BA,0.16666666666666669,0.9333333333333333,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1682,Chai-1-Single-Seq,7P1M_4IU,0.4285714285714287,0.8285714285714285,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+1683,Chai-1-Single-Seq,7PGX_FMN,0.04999999999999993,0.98,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}"
+1684,Chai-1-Single-Seq,7UAS_MBU,0.4117647058823529,0.8352941176470589,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+1685,Chai-1-Single-Seq,8GFD_ZHR,0.055555555555555525,0.9777777777777777,"{'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1686,Chai-1-Single-Seq,7CTM_BDP,0.33333333333333337,0.8666666666666667,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CSD:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1}"
+1687,Chai-1-Single-Seq,7UQ3_O2U,0.125,0.95,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1688,Chai-1-Single-Seq,7DKT_GLF,0.3333333333333335,0.8666666666666666,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 2, 'UNL:TYR:VdWContact': 4}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+1689,Chai-1-Single-Seq,7CNQ_G8X,,0.0,,
+1690,Chai-1-Single-Seq,6Z1C_7EY,0.14285714285714293,0.9428571428571428,"{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 3}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 2}"
+1691,Chai-1-Single-Seq,7M3H_YPV,0.3529411764705883,0.8588235294117647,"{'UNL:ALA:Hydrophobic': 4, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1}"
+1692,Chai-1-Single-Seq,7D6O_MTE,,0.0,,
+1693,Chai-1-Single-Seq,7N4W_P4V,0.23529411764705885,0.9058823529411765,"{'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1694,Chai-1-Single-Seq,6Z2C_Q5E,0.10526315789473684,0.9578947368421052,"{'UNL:ARG:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1695,Chai-1-Single-Seq,7CIJ_G0C,0.10000000000000003,0.96,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2}"
+1696,Chai-1-Single-Seq,7USH_82V,0.07692307692307687,0.9692307692307692,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}"
+1697,Chai-1-Single-Seq,7XG5_PLP,0.13333333333333341,0.9466666666666667,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}"
+1698,Chai-1-Single-Seq,7PT3_3KK,0.3913043478260869,0.8434782608695652,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1699,Chai-1-Single-Seq,7KB1_WBJ,,0.0,,
+1700,Chai-1-Single-Seq,7WUX_6OI,0.2608695652173913,0.8956521739130435,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1}"
+1701,Chai-1-Single-Seq,7OZ9_NGK,0.6,0.76,"{'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1}"
+1702,Chai-1-Single-Seq,7N03_ZRP,0.1666666666666667,0.9333333333333333,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:TRP:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1703,Chai-1-Single-Seq,7BMI_U4B,0.1333333333333333,0.9466666666666667,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+1704,Chai-1-Single-Seq,7RZL_NPO,0.10000000000000003,0.96,"{'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1705,Chai-1-Single-Seq,7QHL_D5P,0.0,1.0,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+1706,Chai-1-Single-Seq,7N7B_T3F,0.25,0.9,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+1707,Chai-1-Single-Seq,7Q5I_I0F,0.409090909090909,0.8363636363636364,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}"
+1708,Chai-1-Single-Seq,7BKA_4JC,0.05882352941176472,0.9764705882352941,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1709,Chai-1-Single-Seq,7NXO_UU8,0.24999999999999997,0.9,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 4, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1710,Chai-1-Single-Seq,6XG5_TOP,0.08333333333333337,0.9666666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1}"
+1711,Chai-1-Single-Seq,6XBO_5MC,0.05555555555555558,0.9777777777777777,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}"
+1712,Chai-1-Single-Seq,8DKO_TFB,0.3333333333333333,0.8666666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+1713,Chai-1-Single-Seq,7LJN_GTP,0.14999999999999997,0.9400000000000001,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+1714,Chai-1-Single-Seq,7MOI_HPS,0.15384615384615385,0.9384615384615385,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 1}"
+1715,Chai-1-Single-Seq,8G6P_API,0.8666666666666668,0.6533333333333333,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1}"
+1716,Chai-1-Single-Seq,7ULC_56B,0.2799999999999999,0.888,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+1717,Chai-1-Single-Seq,7RC3_SAH,0.0,1.0,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+1718,Chai-1-Single-Seq,7SFO_98L,0.2631578947368422,0.8947368421052632,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1}"
+1719,Chai-1-Single-Seq,8DP2_UMA,0.2173913043478261,0.9130434782608695,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}"
+1720,Chai-1-Single-Seq,7ZZW_KKW,0.2857142857142858,0.8857142857142857,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:VdWContact': 2}"
+1721,Chai-1-Single-Seq,7XFA_D9J,0.16666666666666666,0.9333333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}"
+1722,Chai-1-Single-Seq,7NP6_UK8,0.5714285714285713,0.7714285714285715,"{'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1723,Chai-1-Single-Seq,7F5D_EUO,0.4375,0.825,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+1724,Chai-1-Single-Seq,6TW7_NZB,0.4000000000000001,0.84,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+1725,Chai-1-Single-Seq,7FHA_ADX,0.0869565217391304,0.9652173913043478,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 1}"
+1726,Chai-1-Single-Seq,7ES1_UDP,0.21052631578947367,0.9157894736842105,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1727,Chai-1-Single-Seq,7OEO_V9Z,0.21052631578947367,0.9157894736842105,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}"
+1728,Chai-1-Single-Seq,7DUA_HJ0,0.16666666666666669,0.9333333333333333,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+1729,Chai-1-Single-Seq,7BCP_GCO,0.14285714285714285,0.9428571428571428,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1}"
+1730,Chai-1-Single-Seq,7P2I_MFU,0.23076923076923073,0.9076923076923077,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2}"
+1731,Chai-1-Single-Seq,7WDT_NGS,0.07142857142857142,0.9714285714285714,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+1732,Chai-1-Single-Seq,8AEM_LVF,0.4,0.84,"{'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:MET:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1733,Chai-1-Single-Seq,7WY1_D0L,0.2500000000000001,0.8999999999999999,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 4, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1734,Chai-1-Single-Seq,7KRU_ATP,0.33333333333333337,0.8666666666666667,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 7, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 6, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2}"
+1735,Chai-1-Single-Seq,7P4C_5OV,0.4,0.84,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:VdWContact': 2}"
+1736,Chai-1-Single-Seq,7MWN_WI5,0.047619047619047616,0.9809523809523809,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+1737,Chai-1-Single-Seq,7ZHP_IQY,0.40909090909090906,0.8363636363636364,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1738,Chai-1-Single-Seq,7W05_GMP,0.07692307692307687,0.9692307692307692,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+1739,Chai-1-Single-Seq,7UJF_R3V,0.23809523809523808,0.9047619047619048,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 9, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+1740,Chai-1-Single-Seq,7LOE_Y84,0.4285714285714286,0.8285714285714285,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3}"
+1741,Chai-1-Single-Seq,8AIE_M7L,0.25,0.9,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 3, 'UNL:THR:VdWContact': 5, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 3, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+1742,Chai-1-Single-Seq,7JY3_VUD,0.2777777777777778,0.8888888888888888,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+1743,Chai-1-Single-Seq,6XM9_V55,0.25000000000000006,0.9,"{'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1744,Chai-1-Single-Seq,7POM_7VZ,0.3636363636363636,0.8545454545454545,"{'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:HIS:HBDonor': 2, 'UNL:HIS:VdWContact': 4, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+1745,Chai-1-Single-Seq,7M31_TDR,,0.0,,
+1746,Chai-1-Single-Seq,8EYE_X4I,0.17391304347826086,0.9304347826086956,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 5, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 5, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1747,Chai-1-Single-Seq,6YRV_PJ8,0.33333333333333326,0.8666666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 3, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+1748,Chai-1-Single-Seq,7LZD_YHY,0.23809523809523808,0.9047619047619048,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3}","{'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:Hydrophobic': 4, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+1749,Chai-1-Single-Seq,7EPV_FDA,0.125,0.95,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}"
+1750,Chai-1-Single-Seq,7UY4_SMI,0.8181818181818182,0.6727272727272727,"{'UNL:ASN:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+1751,Chai-1-Single-Seq,7N4N_0BK,0.5238095238095238,0.7904761904761904,"{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+1752,Chai-1-Single-Seq,7UMW_NAD,0.08333333333333326,0.9666666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:HBAcceptor': 2, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBAcceptor': 2, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1753,Chai-1-Single-Seq,7U3J_L6U,0.10714285714285723,0.9571428571428571,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 3}"
+1754,Chai-1-Single-Seq,6Z14_Q4Z,0.2142857142857143,0.9142857142857143,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 4}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+1755,Chai-1-Single-Seq,6ZK5_IMH,0.4444444444444444,0.8222222222222222,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1756,Chai-1-Single-Seq,7QGP_DJ8,0.22727272727272735,0.9090909090909091,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+1757,Chai-1-Single-Seq,7L5F_XNG,0.19999999999999987,0.92,"{'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1758,Chai-1-Single-Seq,7FT9_4MB,1.1111111111111112,0.5555555555555556,{},"{'UNL:ALA:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+1759,Chai-1-Single-Seq,7OP9_06K,,0.0,,
+1760,Chai-1-Single-Seq,7JXX_VP7,0.4545454545454545,0.8181818181818182,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1761,Chai-1-Single-Seq,7CL8_TES,0.1333333333333333,0.9466666666666667,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1762,Chai-1-Single-Seq,7TM6_GPJ,0.07142857142857142,0.9714285714285714,"{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 2}"
+1763,Chai-1-Single-Seq,7WQQ_5Z6,0.5625,0.775,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 3, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 4, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+1764,Chai-1-Single-Seq,7WL4_JFU,0.15789473684210525,0.9368421052631579,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+1765,Chai-1-Single-Seq,7SCW_GSP,0.1666666666666667,0.9333333333333333,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 4, 'UNL:LYS:HBAcceptor': 2, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 4, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+1766,Chai-1-Single-Seq,7L7C_XQ1,0.7142857142857142,0.7142857142857143,"{'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 3, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 3, 'UNL:THR:Hydrophobic': 1}","{'UNL:GLN:Hydrophobic': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PRO:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}"
+1767,Chai-1-Single-Seq,7PUV_84Z,0.4285714285714286,0.8285714285714285,"{'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1768,Chai-1-Single-Seq,7KQU_YOF,,0.0,,
+1769,Chai-1-Single-Seq,7Z2O_IAJ,0.07692307692307698,0.9692307692307692,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}"
+1770,Chai-1-Single-Seq,7PRM_81I,0.13636363636363633,0.9454545454545454,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+1771,Chai-1-Single-Seq,8FLV_ZB9,,0.0,,
+1772,Chai-1-Single-Seq,7NLV_UJE,0.2666666666666666,0.8933333333333333,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 2, 'UNL:SER:VdWContact': 4, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 2, 'UNL:SER:VdWContact': 4, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+1773,Chai-1-Single-Seq,7T0D_FPP,0.2666666666666666,0.8933333333333333,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 4, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 5}"
+1774,Chai-1-Single-Seq,7MWU_ZPM,0.45454545454545453,0.8181818181818181,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+1775,Chai-1-Single-Seq,7L00_XCJ,0.27777777777777785,0.8888888888888888,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1776,Chai-1-Single-Seq,8C5M_MTA,0.3333333333333333,0.8666666666666667,"{'UNL:ASP:VdWContact': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1777,Chai-1-Single-Seq,7Z7F_IF3,0.23076923076923073,0.9076923076923077,"{'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+1778,Chai-1-Single-Seq,7TSF_H4B,0.6111111111111112,0.7555555555555555,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}"
+1779,Chai-1-Single-Seq,7TUO_KL9,0.5,0.8,"{'UNL:ALA:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1780,Chai-1-Single-Seq,7ED2_A3P,0.22222222222222224,0.9111111111111111,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+1781,Chai-1-Single-Seq,7ZL5_IWE,0.4615384615384615,0.8153846153846154,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:HIS:VdWContact': 5, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1}"
+1782,Chai-1-Single-Seq,8F8E_XJI,0.09999999999999998,0.96,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+1783,Chai-1-Single-Seq,7OZC_G6S,0.35714285714285726,0.8571428571428571,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:HIS:VdWContact': 3, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+1784,Chai-1-Single-Seq,7Q2B_M6H,0.4117647058823529,0.8352941176470589,"{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}","{'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1785,Chai-1-Single-Seq,6VTA_AKN,0.5555555555555556,0.7777777777777778,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1}"
+1786,Chai-1-Single-Seq,7V3N_AKG,0.4375,0.825,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1787,Chai-1-Single-Seq,8F4J_PHO,,0.0,,
+1788,Chai-1-Single-Seq,7ZOC_T8E,,0.0,,
+1789,Chai-1-Single-Seq,7WCF_ACP,0.08333333333333333,0.9666666666666667,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 3, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 3, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+1790,Chai-1-Single-Seq,7NUT_GLP,0.1578947368421053,0.9368421052631579,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1}"
+1791,Chai-1-Single-Seq,7E4L_MDN,0.4000000000000001,0.84,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+1792,Chai-1-Single-Seq,7TS6_KMI,0.4444444444444444,0.8222222222222222,"{'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1793,Chai-1-Single-Seq,7NF3_4LU,0.12903225806451604,0.9483870967741936,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+1794,Chai-1-Single-Seq,8D5D_5DK,0.19047619047619047,0.9238095238095239,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:HBDonor': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1795,Chai-1-Single-Seq,7JMV_4NC,0.38888888888888895,0.8444444444444444,"{'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1796,Chai-1-Single-Seq,7A9E_R4W,0.19999999999999996,0.92,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+1797,Chai-1-Single-Seq,7TBU_S3P,0.2666666666666667,0.8933333333333333,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1}"
+1798,Chai-1-Single-Seq,7TB0_UD1,,0.0,,
+1799,Chai-1-Single-Seq,7MFP_Z7P,,0.0,,
+1800,Chai-1-Single-Seq,6M2B_EZO,0.11111111111111102,0.9555555555555556,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1801,Chai-1-Single-Seq,7NPL_UKZ,0.4000000000000001,0.84,"{'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1802,Chai-1-Single-Seq,7KZ9_XN7,0.2727272727272727,0.8909090909090909,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+1803,Chai-1-Single-Seq,7QE4_NGA,,0.0,,
+1804,Chai-1-Single-Seq,8AP0_PRP,0.19999999999999996,0.92,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 3, 'UNL:SER:HBDonor': 2, 'UNL:SER:VdWContact': 4, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+1805,Chai-1-Single-Seq,7V3S_5I9,0.13636363636363646,0.9454545454545454,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 3, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 3, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3}"
+1806,Chai-1-Single-Seq,7C0U_FGO,0.588235294117647,0.7647058823529412,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 4}"
+1807,Chai-1-Single-Seq,7UXS_OJC,0.4210526315789474,0.831578947368421,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1}"
+1808,Chai-1-Single-Seq,7X9K_8OG,0.13636363636363633,0.9454545454545454,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+1809,Chai-1-Single-Seq,8BOM_QU6,0.0,1.0,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1810,Chai-1-Single-Seq,8BTI_RFO,0.06666666666666665,0.9733333333333334,"{'UNL:ALA:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+1811,Chai-1-Single-Seq,7RWS_4UR,0.375,0.85,"{'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1812,Chai-1-Single-Seq,6YQV_8K2,0.15384615384615374,0.9384615384615385,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1813,Chai-1-Single-Seq,7PK0_BYC,0.1666666666666667,0.9333333333333333,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+1814,Chai-1-Single-Seq,5SIS_JSM,0.2631578947368421,0.8947368421052632,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1815,Chai-1-Single-Seq,7NSW_HC4,0.09523809523809523,0.9619047619047619,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+1816,Chai-1-Single-Seq,7F8T_FAD,0.12500000000000006,0.95,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 4, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1817,Chai-1-Single-Seq,5SD5_HWI,0.3529411764705882,0.8588235294117648,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+1818,Chai-1-Single-Seq,7CUO_PHB,0.05263157894736842,0.9789473684210527,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+1819,Chai-1-Single-Seq,7R3D_APR,0.3529411764705882,0.8588235294117648,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 5}","{'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 4}"
+1820,Chai-1-Single-Seq,7WJB_BGC,0.09090909090909083,0.9636363636363636,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+1821,Chai-1-Single-Seq,7A1P_QW2,0.19047619047619047,0.9238095238095239,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+1822,Chai-1-Single-Seq,6ZPB_3D1,0.08695652173913049,0.9652173913043478,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+1823,Chai-1-Single-Seq,7UTW_NAI,0.2307692307692308,0.9076923076923077,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 3}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 3}"
+1824,Chai-1-Single-Seq,7WUY_76N,0.5499999999999999,0.78,"{'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 4, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1825,Chai-1-Single-Seq,8A2D_KXY,0.2,0.92,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3}"
+1826,Chai-1-Single-Seq,7NR8_UOE,0.07407407407407418,0.9703703703703703,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 2, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 1}"
+1827,Chai-1-Single-Seq,7KC5_BJZ,0.6923076923076923,0.7230769230769231,"{'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 4, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 4}","{'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+1828,Chai-1-Single-Seq,7QPP_VDX,0.3333333333333334,0.8666666666666667,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 5, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 4, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+1829,Chai-1-Single-Seq,7VKZ_NOJ,,0.0,,
+1830,Chai-1-Single-Seq,7F51_BA7,0.16666666666666677,0.9333333333333333,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 2}"
+1831,Chai-1-Single-Seq,7PL1_SFG,0.20000000000000007,0.9199999999999999,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+1832,Chai-1-Single-Seq,7VB8_STL,0.21428571428571425,0.9142857142857143,"{'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+1833,Chai-1-Single-Seq,8FAV_4Y5,0.7083333333333333,0.7166666666666667,"{'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 3, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1834,Chai-1-Single-Seq,7CD9_FVR,0.7999999999999999,0.68,"{'UNL:ASP:VdWContact': 2, 'UNL:THR:Hydrophobic': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3}"
+1835,Chai-1-Single-Seq,7N7H_CTP,0.5909090909090909,0.7636363636363637,"{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 3, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 3, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 4, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+1836,Chai-1-Single-Seq,7ODY_DGI,0.09090909090909086,0.9636363636363636,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2}"
+1837,Chai-1-Single-Seq,8CSD_C5P,0.25,0.9,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 2, 'UNL:SER:VdWContact': 3, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+1838,Chai-1-Single-Seq,7OFK_VCH,0.1904761904761904,0.9238095238095239,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+1839,Chai-1-Single-Seq,7SDD_4IP,0.3846153846153847,0.8461538461538461,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 3}","{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+1840,Chai-1-Single-Seq,7OPG_06N,0.75,0.7,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3}"
+1841,Chai-1-Single-Seq,7ZTL_BCN,0.14285714285714285,0.9428571428571428,"{'UNL:ASP:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+1842,Chai-1-Single-Seq,7SIU_9ID,0.2916666666666666,0.8833333333333334,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+1843,Chai-1-Single-Seq,7LCU_XTA,0.20833333333333337,0.9166666666666666,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1844,Chai-1-Single-Seq,7NGW_UAW,0.04999999999999993,0.98,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1845,Chai-1-Single-Seq,7VYJ_CA0,0.21052631578947367,0.9157894736842105,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1846,Chai-1-Single-Seq,7QHG_T3B,0.5555555555555555,0.7777777777777778,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+1847,Chai-1-Single-Seq,8HO0_3ZI,0.2,0.92,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1848,Chai-1,8AAU_LH0,0.25,0.9,"{'UNL:ALA:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1849,Chai-1,7JHQ_VAJ,0.30769230769230765,0.8769230769230769,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+1850,Chai-1,6ZCY_QF8,0.09523809523809529,0.9619047619047619,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+1851,Chai-1,7UAW_MF6,0.35294117647058826,0.8588235294117648,"{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+1852,Chai-1,6YMS_OZH,0.1428571428571428,0.9428571428571428,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1853,Chai-1,7UJ5_DGL,0.15,0.94,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+1854,Chai-1,8EX2_Q2Q,0.30769230769230765,0.8769230769230769,"{'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+1855,Chai-1,7R9N_F97,0.4000000000000001,0.84,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}"
+1856,Chai-1,7UYB_OK0,0.125,0.95,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+1857,Chai-1,7U0U_FK5,0.3214285714285715,0.8714285714285714,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 3}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU-:Hydrophobic': 1, 'UNL:GLU-:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE-:Hydrophobic': 1, 'UNL:PHE-:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:PRO-:Hydrophobic': 1, 'UNL:TRP-:HBAcceptor': 1, 'UNL:TRP-:Hydrophobic': 1, 'UNL:TRP-:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+1858,Chai-1,7ZU2_DHT,0.07692307692307687,0.9692307692307692,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 6, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 6, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+1859,Chai-1,6XHT_V2V,0.388888888888889,0.8444444444444443,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 4, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:VdWContact': 1}"
+1860,Chai-1,7OSO_0V1,0.30000000000000004,0.88,"{'UNL:ARG:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2}"
+1861,Chai-1,8D19_GSH,0.38461538461538464,0.8461538461538461,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+1862,Chai-1,7MGT_ZD4,0.043478260869565216,0.9826086956521739,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1863,Chai-1,8C3N_ADP,0.10526315789473678,0.9578947368421052,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+1864,Chai-1,6YYO_Q1K,0.5,0.8,"{'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1}"
+1865,Chai-1,8A1H_DLZ,0.09523809523809523,0.9619047619047619,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+1866,Chai-1,7XQZ_FPF,0.13636363636363635,0.9454545454545454,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1867,Chai-1,7RH3_59O,0.5,0.8,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 1}"
+1868,Chai-1,7OMX_CNA,0.090909090909091,0.9636363636363636,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 3, 'UNL:PRO:VdWContact': 3, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:HBAcceptor': 2, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 3, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1869,Chai-1,7LMO_NYO,0.13043478260869582,0.9478260869565217,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 4, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 4, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1870,Chai-1,7VBU_6I4,0.2857142857142857,0.8857142857142857,"{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:MET:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1871,Chai-1,7TXK_LW8,0.5714285714285715,0.7714285714285714,"{'UNL:ASN:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+1872,Chai-1,7T1D_E7K,,0.0,,
+1873,Chai-1,7R59_I5F,0.18181818181818182,0.9272727272727272,"{'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+1874,Chai-1,7ZCC_OGA,0.7272727272727274,0.709090909090909,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+1875,Chai-1,7V43_C4O,0.2,0.92,"{'UNL:ALA:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 4, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 4, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}"
+1876,Chai-1,7BNH_BEZ,0.14285714285714285,0.9428571428571428,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+1877,Chai-1,6WTN_RXT,0.11764705882352944,0.9529411764705882,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+1878,Chai-1,7QFM_AY3,0.125,0.95,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1879,Chai-1,7MSR_DCA,0.0,1.0,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 3, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 3, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1880,Chai-1,5SAK_ZRY,0.46666666666666673,0.8133333333333332,"{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+1881,Chai-1,7QTA_URI,0.25,0.9,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}"
+1882,Chai-1,7RSV_7IQ,0.16666666666666669,0.9333333333333333,"{'UNL:GLN:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1}"
+1883,Chai-1,8DSC_NCA,0.2857142857142857,0.8857142857142857,"{'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1}"
+1884,Chai-1,7AKL_RK5,0.0,1.0,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3}"
+1885,Chai-1,7XBV_APC,0.22222222222222218,0.9111111111111111,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1886,Chai-1,7CNS_PMV,0.1363636363636364,0.9454545454545454,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 3}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+1887,Chai-1,7ZDY_6MJ,,0.0,,
+1888,Chai-1,6Z4N_Q7B,0.11764705882352941,0.9529411764705882,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2}"
+1889,Chai-1,7NFB_GEN,0.1875,0.925,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1}"
+1890,Chai-1,7R7R_AWJ,0.23529411764705885,0.9058823529411765,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1891,Chai-1,7V14_ORU,0.23529411764705882,0.9058823529411765,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1892,Chai-1,6YR2_T1C,0.3913043478260869,0.8434782608695652,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+1893,Chai-1,7JG0_GAR,0.18181818181818182,0.9272727272727272,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:V:VdWContact': 1}"
+1894,Chai-1,7EBG_J0L,0.3333333333333333,0.8666666666666667,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+1895,Chai-1,8AY3_OE3,0.17647058823529416,0.9294117647058824,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+1896,Chai-1,7M6K_YRJ,0.19999999999999996,0.92,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1897,Chai-1,6YT6_PKE,0.09999999999999998,0.96,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1898,Chai-1,7Q27_8KC,0.4444444444444443,0.8222222222222223,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:VdWContact': 3, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+1899,Chai-1,8DHG_T78,0.1999999999999999,0.92,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 5, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+1900,Chai-1,8EXL_799,0.0,1.0,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}"
+1901,Chai-1,7FB7_8NF,0.46153846153846145,0.8153846153846154,"{'UNL:GLU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1}"
+1902,Chai-1,7THI_PGA,0.16666666666666674,0.9333333333333333,"{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 2, 'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+1903,Chai-1,6ZAE_ACV,0.16666666666666669,0.9333333333333333,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+1904,Chai-1,7MGY_ZD1,0.05882352941176469,0.9764705882352941,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+1905,Chai-1,7XPO_UPG,0.10526315789473678,0.9578947368421052,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+1906,Chai-1,7SUC_COM,,0.0,,
+1907,Chai-1,7BJJ_TVW,0.3000000000000001,0.88,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+1908,Chai-1,7K0V_VQP,0.0769230769230771,0.9692307692307691,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+1909,Chai-1,7TE8_P0T,0.42857142857142844,0.8285714285714286,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+1910,Chai-1,7QF4_RBF,0.2,0.92,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 4, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}"
+1911,Chai-1,7UJ4_OQ4,0.1904761904761904,0.9238095238095239,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+1912,Chai-1,7A9H_TPP,0.15999999999999992,0.936,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+1913,Chai-1,7LEV_0JO,0.19047619047619058,0.9238095238095237,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 5, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 4, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 2}"
+1914,Chai-1,7N6F_0I1,0.23529411764705885,0.9058823529411765,"{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1915,Chai-1,8EAB_VN2,0.2857142857142857,0.8857142857142857,"{'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:HBAcceptor': 2, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+1916,Chai-1,6ZC3_JOR,0.35714285714285715,0.8571428571428572,"{'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1917,Chai-1,7Q25_8J9,0.0,1.0,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 3, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 3, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+1918,Chai-1,7C3U_AZG,0.4000000000000001,0.84,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2}"
+1919,Chai-1,7ROR_69X,0.11764705882352941,0.9529411764705882,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 2, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+1920,Chai-1,7MMH_ZJY,0.17241379310344826,0.9310344827586207,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+1921,Chai-1,7TH4_FFO,0.15789473684210525,0.9368421052631579,"{'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1922,Chai-1,8D39_QDB,0.24999999999999994,0.9,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+1923,Chai-1,7YZU_DO7,0.05555555555555555,0.9777777777777777,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 2}"
+1924,Chai-1,5SB2_1K2,0.04166666666666674,0.9833333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1925,Chai-1,6M73_FNR,0.07407407407407413,0.9703703703703703,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1926,Chai-1,8B8H_OJQ,0.038461538461538464,0.9846153846153847,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBDonor': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}"
+1927,Chai-1,7TOM_5AD,0.27272727272727276,0.8909090909090909,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1928,Chai-1,7VWF_K55,0.24,0.904,"{'UNL:ARG:Hydrophobic': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 1}"
+1929,Chai-1,7XI7_4RI,0.16666666666666669,0.9333333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1930,Chai-1,7AN5_RDH,0.21739130434782614,0.9130434782608695,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+1931,Chai-1,7B2C_TP7,,0.0,,
+1932,Chai-1,7B94_ANP,0.18181818181818174,0.9272727272727272,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1933,Chai-1,7NF0_BYN,,0.0,,
+1934,Chai-1,7WKL_CAQ,0.38461538461538464,0.8461538461538461,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1935,Chai-1,7WPW_F15,0.0625,0.975,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1936,Chai-1,8SLG_G5A,0.4444444444444444,0.8222222222222222,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 3, 'UNL:GLU:VdWContact': 5, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+1937,Chai-1,7RNI_60I,0.46153846153846156,0.8153846153846154,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 3}"
+1938,Chai-1,7SZA_DUI,0.26315789473684215,0.8947368421052632,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+1939,Chai-1,7PIH_7QW,0.19999999999999996,0.92,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+1940,Chai-1,7T3E_SLB,0.1875,0.925,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2}"
+1941,Chai-1,7FRX_O88,,0.0,,
+1942,Chai-1,8CNH_V6U,0.40000000000000013,0.84,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 3, 'UNL:SER:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+1943,Chai-1,7C8Q_DSG,0.05555555555555555,0.9777777777777777,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:DSG:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+1944,Chai-1,7ZF0_DHR,0.36363636363636354,0.8545454545454546,"{'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3}","{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 3}"
+1945,Chai-1,8G0V_YHT,,0.0,,
+1946,Chai-1,7P5T_5YG,0.4999999999999999,0.8,"{'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 5, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+1947,Chai-1,7NU0_DCL,0.0,1.0,"{'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1948,Chai-1,6Z0R_Q4H,0.0,1.0,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1}","{'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1}"
+1949,Chai-1,7XRL_FWK,0.1428571428571429,0.9428571428571428,"{'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 4, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1950,Chai-1,7LOU_IFM,0.1666666666666667,0.9333333333333333,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:UDP:VdWContact': 1}"
+1951,Chai-1,7ROU_66I,0.16666666666666674,0.9333333333333333,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+1952,Chai-1,6XCT_478,0.11111111111111113,0.9555555555555555,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 5, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1953,Chai-1,7LT0_ONJ,0.10526315789473695,0.9578947368421052,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}"
+1954,Chai-1,7OLI_8HG,0.058823529411764705,0.9764705882352941,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2}"
+1955,Chai-1,7Z1Q_NIO,0.0,1.0,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+1956,Chai-1,6YQW_82I,0.3,0.88,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1957,Chai-1,6T88_MWQ,0.4375,0.825,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1958,Chai-1,7PRI_7TI,0.13333333333333341,0.9466666666666667,"{'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:VdWContact': 1}"
+1959,Chai-1,7OFF_VCB,0.2666666666666668,0.8933333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+1960,Chai-1,7DQL_4CL,0.7999999999999999,0.68,"{'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 3}"
+1961,Chai-1,7O1T_5X8,0.05,0.98,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:CYS:Hydrophobic': 2, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+1962,Chai-1,7KM8_WPD,0.2631578947368421,0.8947368421052632,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+1963,Chai-1,7ZXV_45D,0.3478260869565218,0.8608695652173912,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL::Hydrophobic': 1, 'UNL::VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 5, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+1964,Chai-1,7X5N_5M5,0.05263157894736842,0.9789473684210527,"{'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1965,Chai-1,7VQ9_ISY,0.0625,0.975,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+1966,Chai-1,7PJQ_OWH,0.29999999999999993,0.88,"{'UNL:ASN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2}","{'UNL:ASN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+1967,Chai-1,8AQL_PLG,0.31578947368421056,0.8736842105263158,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 4, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1968,Chai-1,7VC5_9SF,0.625,0.75,"{'UNL:ASN:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1969,Chai-1,7AFX_R9K,0.3076923076923077,0.8769230769230769,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1}"
+1970,Chai-1,7RKW_5TV,0.1428571428571429,0.9428571428571428,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+1971,Chai-1,7TYP_KUR,0.2083333333333332,0.9166666666666667,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 2, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+1972,Chai-1,7L03_F9F,0.16666666666666669,0.9333333333333333,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1973,Chai-1,7P1F_KFN,0.41666666666666663,0.8333333333333334,"{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1974,Chai-1,7O0N_CDP,0.19047619047619035,0.9238095238095239,"{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 5, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 5, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+1975,Chai-1,7MYU_ZR7,0.17391304347826086,0.9304347826086956,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+1976,Chai-1,6YSP_PAL,0.4375,0.825,"{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 4, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 3, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 4, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2}"
+1977,Chai-1,7XJN_NSD,,0.0,,
+1978,Chai-1,7R6J_2I7,0.375,0.85,"{'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 4, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 2, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1979,Chai-1,8HFN_XGC,0.21739130434782605,0.9130434782608696,"{'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1980,Chai-1,7BTT_F8R,0.23076923076923073,0.9076923076923077,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+1981,Chai-1,7MY1_IPE,0.5,0.8,"{'UNL:ASP:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+1982,Chai-1,8FO5_Y4U,0.4000000000000001,0.84,"{'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3}","{'UNL:GLN:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2}"
+1983,Chai-1,8AUH_L9I,0.7000000000000001,0.72,"{'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:CYS:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+1984,Chai-1,7ECR_SIN,,0.0,,
+1985,Chai-1,6TW5_9M2,0.3999999999999999,0.8400000000000001,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1986,Chai-1,7ELT_TYM,0.17241379310344823,0.9310344827586207,"{'UNL:ALA:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 3}"
+1987,Chai-1,7D5C_GV6,0.19999999999999996,0.92,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1988,Chai-1,7W06_ITN,0.14285714285714282,0.9428571428571428,"{'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 2}"
+1989,Chai-1,6YJA_2BA,0.052631578947368474,0.9789473684210526,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+1990,Chai-1,7P1M_4IU,0.3571428571428573,0.8571428571428571,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+1991,Chai-1,7PGX_FMN,0.09523809523809534,0.9619047619047618,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 4, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}"
+1992,Chai-1,7UAS_MBU,0.2666666666666666,0.8933333333333333,"{'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 2, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ASP:Hydrophobic': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+1993,Chai-1,8GFD_ZHR,0.16666666666666669,0.9333333333333333,"{'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+1994,Chai-1,7CTM_BDP,0.36363636363636354,0.8545454545454546,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CSD:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1}"
+1995,Chai-1,7UQ3_O2U,0.125,0.95,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+1996,Chai-1,7DKT_GLF,0.0,1.0,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+1997,Chai-1,7CNQ_G8X,,0.0,,
+1998,Chai-1,6Z1C_7EY,0.1333333333333333,0.9466666666666667,"{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 3}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 2}"
+1999,Chai-1,7M3H_YPV,0.26315789473684215,0.8947368421052632,"{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1}"
+2000,Chai-1,7D6O_MTE,,0.0,,
+2001,Chai-1,7N4W_P4V,0.6,0.76,"{'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2002,Chai-1,6Z2C_Q5E,0.49999999999999994,0.8,"{'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2003,Chai-1,7CIJ_G0C,0.22222222222222227,0.9111111111111111,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2}"
+2004,Chai-1,7USH_82V,0.08333333333333333,0.9666666666666667,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}"
+2005,Chai-1,7XG5_PLP,0.06666666666666676,0.9733333333333333,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}"
+2006,Chai-1,7PT3_3KK,0.29166666666666674,0.8833333333333333,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2007,Chai-1,7KB1_WBJ,0.21052631578947362,0.9157894736842106,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+2008,Chai-1,7WUX_6OI,0.16666666666666669,0.9333333333333333,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1}"
+2009,Chai-1,7OZ9_NGK,0.375,0.85,"{'UNL:ARG:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1}"
+2010,Chai-1,7N03_ZRP,0.2222222222222223,0.9111111111111111,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2011,Chai-1,7BMI_U4B,0.0625,0.975,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2012,Chai-1,7RZL_NPO,0.2,0.92,"{'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2013,Chai-1,7QHL_D5P,0.11764705882352931,0.9529411764705883,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2014,Chai-1,7N7B_T3F,0.10000000000000003,0.96,"{'UNL:ASP:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+2015,Chai-1,7Q5I_I0F,0.05555555555555555,0.9777777777777777,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}"
+2016,Chai-1,7BKA_4JC,0.7058823529411766,0.7176470588235293,"{'UNL:ARG:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2017,Chai-1,7NXO_UU8,0.17391304347826092,0.9304347826086956,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2018,Chai-1,6XG5_TOP,0.16666666666666669,0.9333333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1}"
+2019,Chai-1,6XBO_5MC,0.16666666666666669,0.9333333333333333,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}"
+2020,Chai-1,8DKO_TFB,0.0,1.0,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+2021,Chai-1,7LJN_GTP,0.10526315789473684,0.9578947368421052,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+2022,Chai-1,7MOI_HPS,0.08333333333333337,0.9666666666666667,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 1}"
+2023,Chai-1,8G6P_API,1.076923076923077,0.5692307692307692,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1}"
+2024,Chai-1,7ULC_56B,0.25,0.9,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+2025,Chai-1,7RC3_SAH,0.17391304347826084,0.9304347826086956,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+2026,Chai-1,7SFO_98L,0.1666666666666665,0.9333333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1}"
+2027,Chai-1,8DP2_UMA,0.3043478260869565,0.8782608695652174,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}"
+2028,Chai-1,7ZZW_KKW,0.27777777777777773,0.888888888888889,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:VdWContact': 2}"
+2029,Chai-1,7XFA_D9J,0.18181818181818174,0.9272727272727272,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}"
+2030,Chai-1,7NP6_UK8,0.3599999999999999,0.8560000000000001,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2031,Chai-1,7F5D_EUO,0.1428571428571428,0.9428571428571428,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+2032,Chai-1,6TW7_NZB,0.3571428571428571,0.8571428571428572,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+2033,Chai-1,7FHA_ADX,0.15000000000000002,0.94,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 2, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 1}"
+2034,Chai-1,7ES1_UDP,0.10526315789473684,0.9578947368421052,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2035,Chai-1,7OEO_V9Z,0.0,1.0,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}"
+2036,Chai-1,7DUA_HJ0,0.125,0.95,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2037,Chai-1,7BCP_GCO,0.21428571428571425,0.9142857142857143,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1}"
+2038,Chai-1,7P2I_MFU,0.30769230769230765,0.8769230769230769,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2}"
+2039,Chai-1,7WDT_NGS,0.1538461538461539,0.9384615384615385,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+2040,Chai-1,8AEM_LVF,0.4,0.84,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:MET:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2041,Chai-1,7WY1_D0L,0.08333333333333326,0.9666666666666667,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 4, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 4, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2042,Chai-1,7KRU_ATP,0.3157894736842105,0.8736842105263158,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 6, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 6, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2}"
+2043,Chai-1,7P4C_5OV,0.0,1.0,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:VdWContact': 2}"
+2044,Chai-1,7MWN_WI5,0.10000000000000003,0.96,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+2045,Chai-1,7ZHP_IQY,0.1600000000000001,0.9359999999999999,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2046,Chai-1,7W05_GMP,0.1538461538461539,0.9384615384615385,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+2047,Chai-1,7UJF_R3V,0.33333333333333337,0.8666666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 9, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+2048,Chai-1,7LOE_Y84,0.16666666666666666,0.9333333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3}"
+2049,Chai-1,8AIE_M7L,0.375,0.85,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 3, 'UNL:THR:VdWContact': 5, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 3, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+2050,Chai-1,7JY3_VUD,0.27777777777777773,0.888888888888889,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+2051,Chai-1,6XM9_V55,0.0714285714285714,0.9714285714285714,"{'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2052,Chai-1,7POM_7VZ,0.23076923076923067,0.9076923076923077,"{'UNL:GLN:VdWContact': 2, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:HIS:HBDonor': 2, 'UNL:HIS:VdWContact': 4, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2053,Chai-1,7M31_TDR,,0.0,,
+2054,Chai-1,8EYE_X4I,0.1428571428571428,0.9428571428571428,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 5, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 5, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2055,Chai-1,6YRV_PJ8,0.2727272727272728,0.8909090909090909,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 3, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2056,Chai-1,7LZD_YHY,0.21052631578947356,0.9157894736842106,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 4, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3}","{'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:Hydrophobic': 4, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+2057,Chai-1,7EPV_FDA,0.1739130434782609,0.9304347826086956,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}"
+2058,Chai-1,7UY4_SMI,0.41666666666666674,0.8333333333333333,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+2059,Chai-1,7N4N_0BK,0.31578947368421056,0.8736842105263158,"{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+2060,Chai-1,7UMW_NAD,0.040000000000000036,0.984,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBAcceptor': 2, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBAcceptor': 2, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2061,Chai-1,7U3J_L6U,0.14285714285714293,0.9428571428571428,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 3}"
+2062,Chai-1,6Z14_Q4Z,0.4285714285714286,0.8285714285714285,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 4, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+2063,Chai-1,6ZK5_IMH,0.35294117647058826,0.8588235294117648,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2064,Chai-1,7QGP_DJ8,0.3,0.88,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2065,Chai-1,7L5F_XNG,0.09523809523809518,0.9619047619047619,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2066,Chai-1,7FT9_4MB,0.1333333333333333,0.9466666666666667,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+2067,Chai-1,7OP9_06K,,0.0,,
+2068,Chai-1,7JXX_VP7,0.29166666666666663,0.8833333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2069,Chai-1,7CL8_TES,0.35714285714285726,0.8571428571428571,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2070,Chai-1,7TM6_GPJ,0.07692307692307698,0.9692307692307692,"{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:HBDonor': 2, 'UNL:LYS:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 2}"
+2071,Chai-1,7WQQ_5Z6,0.3125,0.875,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 4, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:Hydrophobic': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 4, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+2072,Chai-1,7WL4_JFU,0.19047619047619047,0.9238095238095239,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+2073,Chai-1,7SCW_GSP,0.23076923076923075,0.9076923076923077,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 4, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBAcceptor': 2, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 4, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+2074,Chai-1,7L7C_XQ1,0.42857142857142855,0.8285714285714285,"{'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:THR:Hydrophobic': 2}","{'UNL:GLN:Hydrophobic': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PRO:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}"
+2075,Chai-1,7PUV_84Z,0.33333333333333337,0.8666666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}","{'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2076,Chai-1,7KQU_YOF,0.125,0.95,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+2077,Chai-1,7Z2O_IAJ,0.30769230769230776,0.8769230769230769,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}"
+2078,Chai-1,7PRM_81I,0.13043478260869562,0.9478260869565217,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 2, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2079,Chai-1,8FLV_ZB9,0.18181818181818185,0.9272727272727272,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+2080,Chai-1,7NLV_UJE,0.19999999999999996,0.92,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 2, 'UNL:SER:VdWContact': 4, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 2, 'UNL:SER:VdWContact': 4, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+2081,Chai-1,7T0D_FPP,0.125,0.95,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 4}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 5}"
+2082,Chai-1,7MWU_ZPM,0.0,1.0,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+2083,Chai-1,7L00_XCJ,0.7368421052631579,0.7052631578947368,"{'UNL:GLU:Hydrophobic': 3, 'UNL:GLU:VdWContact': 3, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 2, 'UNL:PRO:Hydrophobic': 3, 'UNL:PRO:VdWContact': 3}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2084,Chai-1,8C5M_MTA,0.19047619047619052,0.9238095238095237,"{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2085,Chai-1,7Z7F_IF3,0.3333333333333333,0.8666666666666667,"{'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+2086,Chai-1,7TSF_H4B,0.11764705882352942,0.9529411764705882,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}"
+2087,Chai-1,7TUO_KL9,0.16666666666666669,0.9333333333333333,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2088,Chai-1,7ED2_A3P,0.1578947368421052,0.9368421052631579,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+2089,Chai-1,7ZL5_IWE,0.4615384615384616,0.8153846153846154,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:HIS:VdWContact': 4, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1}"
+2090,Chai-1,8F8E_XJI,0.1363636363636364,0.9454545454545454,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+2091,Chai-1,7OZC_G6S,0.35714285714285715,0.8571428571428572,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:HIS:VdWContact': 3, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+2092,Chai-1,7Q2B_M6H,0.1538461538461538,0.9384615384615385,"{'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 3}","{'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2093,Chai-1,6VTA_AKN,0.5555555555555556,0.7777777777777778,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 2, 'UNL:ASP:VdWContact': 4, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1}"
+2094,Chai-1,7V3N_AKG,0.3333333333333333,0.8666666666666667,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2095,Chai-1,8F4J_PHO,,0.0,,
+2096,Chai-1,7ZOC_T8E,0.07692307692307687,0.9692307692307692,"{'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:HIS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 4, 'UNL:HIS:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+2097,Chai-1,7WCF_ACP,0.043478260869565216,0.9826086956521739,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 3, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 3, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+2098,Chai-1,7NUT_GLP,0.125,0.95,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1}"
+2099,Chai-1,7E4L_MDN,0.30000000000000004,0.88,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+2100,Chai-1,7TS6_KMI,0.30769230769230765,0.8769230769230769,"{'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2101,Chai-1,7NF3_4LU,0.09999999999999999,0.96,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+2102,Chai-1,8D5D_5DK,0.3,0.88,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2103,Chai-1,7JMV_4NC,0.2941176470588235,0.8823529411764706,"{'UNL:ARG:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2104,Chai-1,7A9E_R4W,0.23076923076923073,0.9076923076923077,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+2105,Chai-1,7TBU_S3P,0.09090909090909088,0.9636363636363636,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1}"
+2106,Chai-1,7TB0_UD1,,0.0,,
+2107,Chai-1,7MFP_Z7P,,0.0,,
+2108,Chai-1,6M2B_EZO,0.05555555555555555,0.9777777777777777,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2109,Chai-1,7NPL_UKZ,0.7083333333333333,0.7166666666666667,"{'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2110,Chai-1,7KZ9_XN7,0.36363636363636354,0.8545454545454546,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+2111,Chai-1,7QE4_NGA,,0.0,,
+2112,Chai-1,8AP0_PRP,0.1875,0.925,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+2113,Chai-1,7V3S_5I9,0.22727272727272738,0.9090909090909091,"{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 4, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 3, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3}"
+2114,Chai-1,7C0U_FGO,0.32,0.872,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 4}"
+2115,Chai-1,7UXS_OJC,0.24000000000000013,0.9039999999999999,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 4, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1}"
+2116,Chai-1,7X9K_8OG,0.19047619047619052,0.9238095238095237,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+2117,Chai-1,8BOM_QU6,0.07999999999999996,0.968,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 4, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2118,Chai-1,8BTI_RFO,0.0625,0.975,"{'UNL:ALA:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2119,Chai-1,7RWS_4UR,0.4375,0.825,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2120,Chai-1,6YQV_8K2,0.1428571428571429,0.9428571428571428,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2121,Chai-1,7PK0_BYC,0.11999999999999995,0.9520000000000001,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2122,Chai-1,5SIS_JSM,0.15789473684210525,0.9368421052631579,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2123,Chai-1,7NSW_HC4,0.0,1.0,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2124,Chai-1,7F8T_FAD,0.3214285714285713,0.8714285714285714,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 4, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2125,Chai-1,5SD5_HWI,0.31578947368421045,0.8736842105263158,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+2126,Chai-1,7CUO_PHB,0.125,0.95,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+2127,Chai-1,7R3D_APR,0.22222222222222224,0.9111111111111111,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3}","{'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 4}"
+2128,Chai-1,7WJB_BGC,0.2727272727272727,0.8909090909090909,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+2129,Chai-1,7A1P_QW2,0.1578947368421053,0.9368421052631579,"{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+2130,Chai-1,6ZPB_3D1,0.38095238095238093,0.8476190476190476,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2131,Chai-1,7UTW_NAI,0.11999999999999997,0.952,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 4}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 3}"
+2132,Chai-1,7WUY_76N,0.4782608695652174,0.808695652173913,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2133,Chai-1,8A2D_KXY,0.2592592592592593,0.8962962962962963,"{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3}"
+2134,Chai-1,7NR8_UOE,0.15999999999999998,0.936,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 1}"
+2135,Chai-1,7KC5_BJZ,0.6,0.76,"{'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 4, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 3}","{'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+2136,Chai-1,7QPP_VDX,0.10526315789473684,0.9578947368421052,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+2137,Chai-1,7VKZ_NOJ,,0.0,,
+2138,Chai-1,7F51_BA7,0.19354838709677424,0.9225806451612903,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 2}"
+2139,Chai-1,7PL1_SFG,0.08695652173913043,0.9652173913043478,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+2140,Chai-1,7VB8_STL,0.21428571428571422,0.9142857142857144,"{'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+2141,Chai-1,8FAV_4Y5,0.18181818181818188,0.9272727272727272,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 3, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 3, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2142,Chai-1,7CD9_FVR,0.7058823529411764,0.7176470588235294,"{'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 4, 'UNL:THR:VdWContact': 4, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3}"
+2143,Chai-1,7N7H_CTP,0.1363636363636364,0.9454545454545454,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 3, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 4, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+2144,Chai-1,7ODY_DGI,0.09090909090909091,0.9636363636363636,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2}"
+2145,Chai-1,8CSD_C5P,0.375,0.85,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 2, 'UNL:SER:VdWContact': 3, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2146,Chai-1,7OFK_VCH,0.1428571428571429,0.9428571428571428,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+2147,Chai-1,7SDD_4IP,0.16666666666666663,0.9333333333333333,"{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 4, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+2148,Chai-1,7OPG_06N,0.14285714285714293,0.9428571428571428,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3}"
+2149,Chai-1,7ZTL_BCN,0.0,1.0,"{'UNL:ASP:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+2150,Chai-1,7SIU_9ID,0.4347826086956521,0.8260869565217391,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2151,Chai-1,7LCU_XTA,0.49999999999999994,0.8,"{'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2152,Chai-1,7NGW_UAW,0.10526315789473678,0.9578947368421052,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2153,Chai-1,7VYJ_CA0,0.11764705882352942,0.9529411764705882,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2154,Chai-1,7QHG_T3B,0.27586206896551724,0.8896551724137931,"{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+2155,Chai-1,8HO0_3ZI,0.3846153846153847,0.8461538461538461,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2156,Boltz-1-Single-Seq,8AAU_LH0,0.375,0.85,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2157,Boltz-1-Single-Seq,7JHQ_VAJ,0.30769230769230765,0.8769230769230769,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+2158,Boltz-1-Single-Seq,6ZCY_QF8,0.13043478260869565,0.9478260869565217,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+2159,Boltz-1-Single-Seq,7UAW_MF6,0.375,0.85,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+2160,Boltz-1-Single-Seq,6YMS_OZH,0.23809523809523814,0.9047619047619048,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 2, 'UNL:ASN:VdWContact': 3, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2161,Boltz-1-Single-Seq,7UJ5_DGL,0.1578947368421053,0.9368421052631579,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+2162,Boltz-1-Single-Seq,8EX2_Q2Q,,0.0,,
+2163,Boltz-1-Single-Seq,7R9N_F97,0.4117647058823529,0.8352941176470589,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}"
+2164,Boltz-1-Single-Seq,7UYB_OK0,0.06666666666666665,0.9733333333333334,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+2165,Boltz-1-Single-Seq,7U0U_FK5,0.25806451612903225,0.896774193548387,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 5, 'UNL:PHE:VdWContact': 5, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 3}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU-:Hydrophobic': 1, 'UNL:GLU-:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE-:Hydrophobic': 1, 'UNL:PHE-:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:PRO-:Hydrophobic': 1, 'UNL:TRP-:HBAcceptor': 1, 'UNL:TRP-:Hydrophobic': 1, 'UNL:TRP-:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+2166,Boltz-1-Single-Seq,7ZU2_DHT,0.08333333333333333,0.9666666666666667,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 6, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 6, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+2167,Boltz-1-Single-Seq,6XHT_V2V,0.4705882352941176,0.8117647058823529,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 4, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:VdWContact': 1}"
+2168,Boltz-1-Single-Seq,7OSO_0V1,0.25000000000000006,0.9,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2}"
+2169,Boltz-1-Single-Seq,8D19_GSH,0.1764705882352941,0.9294117647058824,"{'UNL:ARG:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+2170,Boltz-1-Single-Seq,7MGT_ZD4,0.045454545454545456,0.9818181818181818,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2171,Boltz-1-Single-Seq,8C3N_ADP,0.19999999999999998,0.92,"{'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+2172,Boltz-1-Single-Seq,6YYO_Q1K,,0.0,,
+2173,Boltz-1-Single-Seq,8A1H_DLZ,,0.0,,
+2174,Boltz-1-Single-Seq,7XQZ_FPF,0.19047619047619052,0.9238095238095237,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2175,Boltz-1-Single-Seq,7RH3_59O,0.09090909090909094,0.9636363636363636,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 1}"
+2176,Boltz-1-Single-Seq,7OMX_CNA,0.19999999999999993,0.92,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:HBAcceptor': 2, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 3, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2177,Boltz-1-Single-Seq,7LMO_NYO,0.45000000000000007,0.82,"{'UNL:ARG:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 4, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 4, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2178,Boltz-1-Single-Seq,7VBU_6I4,0.0714285714285714,0.9714285714285714,"{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2179,Boltz-1-Single-Seq,7TXK_LW8,0.09999999999999998,0.96,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+2180,Boltz-1-Single-Seq,7T1D_E7K,0.6363636363636364,0.7454545454545455,"{'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 5, 'UNL:ILE:VdWContact': 4, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 4, 'UNL:PHE:Hydrophobic': 7, 'UNL:PHE:VdWContact': 6, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 7, 'UNL:PHE:VdWContact': 5, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2181,Boltz-1-Single-Seq,7R59_I5F,0.1,0.96,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+2182,Boltz-1-Single-Seq,7ZCC_OGA,,0.0,,
+2183,Boltz-1-Single-Seq,7V43_C4O,,0.0,,
+2184,Boltz-1-Single-Seq,7BNH_BEZ,0.6363636363636362,0.7454545454545455,"{'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+2185,Boltz-1-Single-Seq,6WTN_RXT,0.05263157894736842,0.9789473684210527,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2186,Boltz-1-Single-Seq,7QFM_AY3,0.31578947368421045,0.8736842105263158,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2187,Boltz-1-Single-Seq,7MSR_DCA,0.08695652173913038,0.9652173913043478,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 3, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 3, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2188,Boltz-1-Single-Seq,5SAK_ZRY,,0.0,,
+2189,Boltz-1-Single-Seq,7QTA_URI,,0.0,,
+2190,Boltz-1-Single-Seq,7RSV_7IQ,0.5,0.8,"{'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1}"
+2191,Boltz-1-Single-Seq,8DSC_NCA,0.33333333333333337,0.8666666666666667,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1}"
+2192,Boltz-1-Single-Seq,7AKL_RK5,0.0,1.0,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3}"
+2193,Boltz-1-Single-Seq,7XBV_APC,0.15789473684210525,0.9368421052631579,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2194,Boltz-1-Single-Seq,7CNS_PMV,0.047619047619047616,0.9809523809523809,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 3}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+2195,Boltz-1-Single-Seq,7ZDY_6MJ,0.25,0.9,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 3}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+2196,Boltz-1-Single-Seq,6Z4N_Q7B,0.14999999999999997,0.9400000000000001,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2}"
+2197,Boltz-1-Single-Seq,7NFB_GEN,,0.0,,
+2198,Boltz-1-Single-Seq,7R7R_AWJ,0.11111111111111116,0.9555555555555555,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2199,Boltz-1-Single-Seq,7V14_ORU,0.1333333333333333,0.9466666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2200,Boltz-1-Single-Seq,6YR2_T1C,0.2857142857142857,0.8857142857142857,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+2201,Boltz-1-Single-Seq,7JG0_GAR,0.27272727272727276,0.8909090909090909,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:V:VdWContact': 1}"
+2202,Boltz-1-Single-Seq,7EBG_J0L,0.36363636363636365,0.8545454545454545,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+2203,Boltz-1-Single-Seq,8AY3_OE3,0.125,0.95,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+2204,Boltz-1-Single-Seq,7M6K_YRJ,0.04999999999999999,0.98,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2205,Boltz-1-Single-Seq,6YT6_PKE,0.19047619047619047,0.9238095238095239,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2206,Boltz-1-Single-Seq,7Q27_8KC,0.14999999999999997,0.9400000000000001,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 3, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+2207,Boltz-1-Single-Seq,8DHG_T78,0.2857142857142857,0.8857142857142857,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+2208,Boltz-1-Single-Seq,8EXL_799,0.1739130434782608,0.9304347826086957,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}"
+2209,Boltz-1-Single-Seq,7FB7_8NF,0.26666666666666666,0.8933333333333333,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1}"
+2210,Boltz-1-Single-Seq,7THI_PGA,0.1538461538461539,0.9384615384615385,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+2211,Boltz-1-Single-Seq,6ZAE_ACV,0.20000000000000007,0.9199999999999999,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+2212,Boltz-1-Single-Seq,7MGY_ZD1,0.20000000000000012,0.9199999999999999,"{'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+2213,Boltz-1-Single-Seq,7XPO_UPG,0.3333333333333334,0.8666666666666667,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+2214,Boltz-1-Single-Seq,7SUC_COM,,0.0,,
+2215,Boltz-1-Single-Seq,7BJJ_TVW,0.1111111111111111,0.9555555555555556,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+2216,Boltz-1-Single-Seq,7K0V_VQP,0.14285714285714285,0.9428571428571428,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2217,Boltz-1-Single-Seq,7TE8_P0T,0.45833333333333326,0.8166666666666667,"{'UNL:ALA:Hydrophobic': 3, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+2218,Boltz-1-Single-Seq,7QF4_RBF,0.0,1.0,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}"
+2219,Boltz-1-Single-Seq,7UJ4_OQ4,0.24999999999999997,0.9,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+2220,Boltz-1-Single-Seq,7A9H_TPP,0.18518518518518529,0.9259259259259259,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 4, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+2221,Boltz-1-Single-Seq,7LEV_0JO,0.19047619047619058,0.9238095238095237,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 5, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 4, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 2}"
+2222,Boltz-1-Single-Seq,7N6F_0I1,,0.0,,
+2223,Boltz-1-Single-Seq,8EAB_VN2,0.2857142857142858,0.8857142857142857,"{'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:HBAcceptor': 2, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+2224,Boltz-1-Single-Seq,6ZC3_JOR,0.05555555555555555,0.9777777777777777,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2225,Boltz-1-Single-Seq,7Q25_8J9,,0.0,,
+2226,Boltz-1-Single-Seq,7C3U_AZG,0.25,0.9,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2}"
+2227,Boltz-1-Single-Seq,7ROR_69X,0.10344827586206888,0.9586206896551724,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+2228,Boltz-1-Single-Seq,7MMH_ZJY,0.10714285714285711,0.9571428571428572,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2229,Boltz-1-Single-Seq,7TH4_FFO,0.3,0.88,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2230,Boltz-1-Single-Seq,8D39_QDB,,0.0,,
+2231,Boltz-1-Single-Seq,7YZU_DO7,0.33333333333333326,0.8666666666666667,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 2}"
+2232,Boltz-1-Single-Seq,5SB2_1K2,0.2592592592592592,0.8962962962962964,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2233,Boltz-1-Single-Seq,6M73_FNR,0.0357142857142857,0.9857142857142858,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2234,Boltz-1-Single-Seq,8B8H_OJQ,0.15384615384615383,0.9384615384615385,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}"
+2235,Boltz-1-Single-Seq,7TOM_5AD,0.27272727272727276,0.8909090909090909,"{'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2236,Boltz-1-Single-Seq,7VWF_K55,0.25925925925925924,0.8962962962962963,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:Hydrophobic': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 1}"
+2237,Boltz-1-Single-Seq,7XI7_4RI,0.25000000000000006,0.9,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2238,Boltz-1-Single-Seq,7AN5_RDH,0.12000000000000008,0.952,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+2239,Boltz-1-Single-Seq,7B2C_TP7,,0.0,,
+2240,Boltz-1-Single-Seq,7B94_ANP,0.2272727272727273,0.9090909090909091,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2241,Boltz-1-Single-Seq,7NF0_BYN,0.09677419354838704,0.9612903225806452,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1}"
+2242,Boltz-1-Single-Seq,7WKL_CAQ,0.08333333333333333,0.9666666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2243,Boltz-1-Single-Seq,7WPW_F15,0.17647058823529416,0.9294117647058824,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2244,Boltz-1-Single-Seq,8SLG_G5A,0.2941176470588236,0.8823529411764706,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 4, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 3, 'UNL:GLU:VdWContact': 5, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+2245,Boltz-1-Single-Seq,7RNI_60I,,0.0,,
+2246,Boltz-1-Single-Seq,7SZA_DUI,0.09999999999999998,0.96,"{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2247,Boltz-1-Single-Seq,7PIH_7QW,0.11111111111111113,0.9555555555555555,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+2248,Boltz-1-Single-Seq,7T3E_SLB,0.0,1.0,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2}"
+2249,Boltz-1-Single-Seq,7FRX_O88,,0.0,,
+2250,Boltz-1-Single-Seq,8CNH_V6U,0.4444444444444444,0.8222222222222222,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+2251,Boltz-1-Single-Seq,7C8Q_DSG,,0.0,,
+2252,Boltz-1-Single-Seq,7ZF0_DHR,0.36363636363636354,0.8545454545454546,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 3}"
+2253,Boltz-1-Single-Seq,8G0V_YHT,,0.0,,
+2254,Boltz-1-Single-Seq,7P5T_5YG,,0.0,,
+2255,Boltz-1-Single-Seq,7NU0_DCL,0.08333333333333337,0.9666666666666667,"{'UNL:ASP:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2256,Boltz-1-Single-Seq,6Z0R_Q4H,0.2727272727272727,0.8909090909090909,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1}","{'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1}"
+2257,Boltz-1-Single-Seq,7XRL_FWK,,0.0,,
+2258,Boltz-1-Single-Seq,7LOU_IFM,0.08333333333333334,0.9666666666666667,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:UDP:VdWContact': 1}"
+2259,Boltz-1-Single-Seq,7ROU_66I,0.125,0.95,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBDonor': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+2260,Boltz-1-Single-Seq,6XCT_478,0.2500000000000001,0.8999999999999999,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 3, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 5, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2261,Boltz-1-Single-Seq,7LT0_ONJ,0.21052631578947378,0.9157894736842105,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}"
+2262,Boltz-1-Single-Seq,7OLI_8HG,0.0,1.0,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2}"
+2263,Boltz-1-Single-Seq,7Z1Q_NIO,0.09999999999999998,0.96,"{'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+2264,Boltz-1-Single-Seq,6YQW_82I,0.1,0.96,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2265,Boltz-1-Single-Seq,6T88_MWQ,0.35714285714285715,0.8571428571428572,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2266,Boltz-1-Single-Seq,7PRI_7TI,0.06666666666666671,0.9733333333333333,"{'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:VdWContact': 1}"
+2267,Boltz-1-Single-Seq,7OFF_VCB,0.2,0.92,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+2268,Boltz-1-Single-Seq,7DQL_4CL,0.3333333333333333,0.8666666666666667,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 3}"
+2269,Boltz-1-Single-Seq,7O1T_5X8,0.05,0.98,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:CYS:Hydrophobic': 2, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+2270,Boltz-1-Single-Seq,7KM8_WPD,0.15000000000000008,0.94,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+2271,Boltz-1-Single-Seq,7ZXV_45D,0.19999999999999996,0.92,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL::Hydrophobic': 1, 'UNL::VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 5, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+2272,Boltz-1-Single-Seq,7X5N_5M5,0.21739130434782608,0.9130434782608696,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2273,Boltz-1-Single-Seq,7VQ9_ISY,0.3125,0.875,"{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+2274,Boltz-1-Single-Seq,7PJQ_OWH,0.09090909090909083,0.9636363636363636,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+2275,Boltz-1-Single-Seq,8AQL_PLG,,0.0,,
+2276,Boltz-1-Single-Seq,7VC5_9SF,0.3529411764705882,0.8588235294117648,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2277,Boltz-1-Single-Seq,7AFX_R9K,0.14285714285714288,0.9428571428571428,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1}"
+2278,Boltz-1-Single-Seq,7RKW_5TV,,0.0,,
+2279,Boltz-1-Single-Seq,7TYP_KUR,0.29166666666666663,0.8833333333333333,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 5, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 2, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2280,Boltz-1-Single-Seq,7L03_F9F,0.05555555555555555,0.9777777777777777,"{'UNL:ALA:Hydrophobic': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2281,Boltz-1-Single-Seq,7P1F_KFN,0.2142857142857143,0.9142857142857143,"{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 4, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2282,Boltz-1-Single-Seq,7O0N_CDP,0.09523809523809523,0.9619047619047619,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 4, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 5, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+2283,Boltz-1-Single-Seq,7MYU_ZR7,0.0,1.0,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+2284,Boltz-1-Single-Seq,6YSP_PAL,0.4375,0.825,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 4, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3}","{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 3, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 4, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2}"
+2285,Boltz-1-Single-Seq,7XJN_NSD,0.5833333333333335,0.7666666666666666,"{'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 5, 'UNL:TRP:VdWContact': 4, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+2286,Boltz-1-Single-Seq,7R6J_2I7,,0.0,,
+2287,Boltz-1-Single-Seq,8HFN_XGC,0.1739130434782608,0.9304347826086957,"{'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2288,Boltz-1-Single-Seq,7BTT_F8R,0.2857142857142857,0.8857142857142857,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+2289,Boltz-1-Single-Seq,7MY1_IPE,0.5000000000000001,0.7999999999999999,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:THR:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+2290,Boltz-1-Single-Seq,8FO5_Y4U,0.5454545454545454,0.7818181818181819,"{'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 4, 'UNL:TYR:VdWContact': 5}","{'UNL:GLN:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2}"
+2291,Boltz-1-Single-Seq,8AUH_L9I,0.14285714285714282,0.9428571428571428,"{'UNL:ALA:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:CYS:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+2292,Boltz-1-Single-Seq,7ECR_SIN,,0.0,,
+2293,Boltz-1-Single-Seq,6TW5_9M2,,0.0,,
+2294,Boltz-1-Single-Seq,7ELT_TYM,0.10714285714285722,0.9571428571428571,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 3}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 3}"
+2295,Boltz-1-Single-Seq,7D5C_GV6,0.1111111111111111,0.9555555555555556,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 4, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2296,Boltz-1-Single-Seq,7W06_ITN,0.2666666666666667,0.8933333333333333,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 2}"
+2297,Boltz-1-Single-Seq,6YJA_2BA,0.23809523809523808,0.9047619047619048,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2298,Boltz-1-Single-Seq,7P1M_4IU,0.0,1.0,"{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+2299,Boltz-1-Single-Seq,7PGX_FMN,0.09090909090909091,0.9636363636363636,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}"
+2300,Boltz-1-Single-Seq,7UAS_MBU,0.23529411764705888,0.9058823529411765,"{'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 2, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ASP:Hydrophobic': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+2301,Boltz-1-Single-Seq,8GFD_ZHR,0.31578947368421045,0.8736842105263158,"{'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2302,Boltz-1-Single-Seq,7CTM_BDP,0.07692307692307698,0.9692307692307692,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CSD:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1}"
+2303,Boltz-1-Single-Seq,7UQ3_O2U,0.07142857142857142,0.9714285714285714,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2304,Boltz-1-Single-Seq,7DKT_GLF,0.08333333333333337,0.9666666666666667,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+2305,Boltz-1-Single-Seq,7CNQ_G8X,,0.0,,
+2306,Boltz-1-Single-Seq,6Z1C_7EY,0.1333333333333333,0.9466666666666667,"{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 2}"
+2307,Boltz-1-Single-Seq,7M3H_YPV,0.23529411764705885,0.9058823529411765,"{'UNL:ALA:Hydrophobic': 4, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1}"
+2308,Boltz-1-Single-Seq,7D6O_MTE,,0.0,,
+2309,Boltz-1-Single-Seq,7N4W_P4V,0.1875,0.925,"{'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2310,Boltz-1-Single-Seq,6Z2C_Q5E,0.5,0.8,"{'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2311,Boltz-1-Single-Seq,7CIJ_G0C,0.3684210526315789,0.8526315789473684,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 3, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2}"
+2312,Boltz-1-Single-Seq,7USH_82V,0.16666666666666666,0.9333333333333333,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}"
+2313,Boltz-1-Single-Seq,7XG5_PLP,0.20000000000000007,0.9199999999999999,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}"
+2314,Boltz-1-Single-Seq,7PT3_3KK,0.22727272727272732,0.9090909090909091,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2315,Boltz-1-Single-Seq,7KB1_WBJ,,0.0,,
+2316,Boltz-1-Single-Seq,7WUX_6OI,,0.0,,
+2317,Boltz-1-Single-Seq,7OZ9_NGK,0.375,0.85,"{'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1}"
+2318,Boltz-1-Single-Seq,7N03_ZRP,0.1666666666666667,0.9333333333333333,"{'UNL:ASN:HBDonor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2319,Boltz-1-Single-Seq,7BMI_U4B,0.0,1.0,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2320,Boltz-1-Single-Seq,7RZL_NPO,0.2,0.92,"{'UNL:GLY:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2321,Boltz-1-Single-Seq,7QHL_D5P,0.2000000000000001,0.9199999999999999,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2322,Boltz-1-Single-Seq,7N7B_T3F,0.1363636363636364,0.9454545454545454,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+2323,Boltz-1-Single-Seq,7Q5I_I0F,0.15789473684210537,0.9368421052631578,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}"
+2324,Boltz-1-Single-Seq,7BKA_4JC,0.0625,0.975,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2325,Boltz-1-Single-Seq,7NXO_UU8,0.26086956521739124,0.8956521739130435,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2326,Boltz-1-Single-Seq,6XG5_TOP,0.07692307692307687,0.9692307692307692,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1}"
+2327,Boltz-1-Single-Seq,6XBO_5MC,0.10526315789473684,0.9578947368421052,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}"
+2328,Boltz-1-Single-Seq,8DKO_TFB,0.125,0.95,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+2329,Boltz-1-Single-Seq,7LJN_GTP,,0.0,,
+2330,Boltz-1-Single-Seq,7MOI_HPS,0.27272727272727276,0.8909090909090909,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 1}"
+2331,Boltz-1-Single-Seq,8G6P_API,0.10000000000000009,0.96,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:HBDonor': 2, 'UNL:LYS:VdWContact': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1}"
+2332,Boltz-1-Single-Seq,7ULC_56B,0.14285714285714296,0.9428571428571428,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+2333,Boltz-1-Single-Seq,7RC3_SAH,0.19999999999999998,0.92,"{'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+2334,Boltz-1-Single-Seq,7SFO_98L,0.2777777777777778,0.8888888888888888,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1}"
+2335,Boltz-1-Single-Seq,8DP2_UMA,0.040000000000000036,0.984,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}"
+2336,Boltz-1-Single-Seq,7ZZW_KKW,,0.0,,
+2337,Boltz-1-Single-Seq,7XFA_D9J,0.33333333333333326,0.8666666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}"
+2338,Boltz-1-Single-Seq,7NP6_UK8,0.29032258064516137,0.8838709677419354,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 4, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2339,Boltz-1-Single-Seq,7F5D_EUO,0.2142857142857143,0.9142857142857143,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+2340,Boltz-1-Single-Seq,6TW7_NZB,0.1333333333333333,0.9466666666666667,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+2341,Boltz-1-Single-Seq,7FHA_ADX,0.09523809523809518,0.9619047619047619,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 1}"
+2342,Boltz-1-Single-Seq,7ES1_UDP,0.052631578947368474,0.9789473684210526,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2343,Boltz-1-Single-Seq,7OEO_V9Z,0.2222222222222222,0.9111111111111111,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}"
+2344,Boltz-1-Single-Seq,7DUA_HJ0,0.2631578947368421,0.8947368421052632,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2345,Boltz-1-Single-Seq,7BCP_GCO,0.1333333333333333,0.9466666666666667,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1}"
+2346,Boltz-1-Single-Seq,7P2I_MFU,0.30769230769230765,0.8769230769230769,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2}"
+2347,Boltz-1-Single-Seq,7WDT_NGS,0.4,0.84,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+2348,Boltz-1-Single-Seq,8AEM_LVF,0.4000000000000001,0.84,"{'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:MET:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2349,Boltz-1-Single-Seq,7WY1_D0L,,0.0,,
+2350,Boltz-1-Single-Seq,7KRU_ATP,0.380952380952381,0.8476190476190476,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 7, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 6, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2}"
+2351,Boltz-1-Single-Seq,7P4C_5OV,0.21428571428571433,0.9142857142857143,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 3}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:VdWContact': 2}"
+2352,Boltz-1-Single-Seq,7MWN_WI5,0.1363636363636364,0.9454545454545454,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+2353,Boltz-1-Single-Seq,7ZHP_IQY,0.18181818181818185,0.9272727272727272,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2354,Boltz-1-Single-Seq,7W05_GMP,0.07142857142857151,0.9714285714285714,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+2355,Boltz-1-Single-Seq,7UJF_R3V,0.25,0.9,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 9, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+2356,Boltz-1-Single-Seq,7LOE_Y84,0.16666666666666666,0.9333333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3}"
+2357,Boltz-1-Single-Seq,8AIE_M7L,0.3571428571428572,0.8571428571428571,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 3, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 5, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 3, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+2358,Boltz-1-Single-Seq,7JY3_VUD,,0.0,,
+2359,Boltz-1-Single-Seq,6XM9_V55,0.5,0.8,"{'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1}","{'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2360,Boltz-1-Single-Seq,7POM_7VZ,0.23529411764705885,0.9058823529411765,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 2}","{'UNL:HIS:HBDonor': 2, 'UNL:HIS:VdWContact': 4, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2361,Boltz-1-Single-Seq,7M31_TDR,,0.0,,
+2362,Boltz-1-Single-Seq,8EYE_X4I,0.24999999999999997,0.9,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 5, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 5, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2363,Boltz-1-Single-Seq,6YRV_PJ8,0.1363636363636363,0.9454545454545454,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 3, 'UNL:THR:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 3, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2364,Boltz-1-Single-Seq,7LZD_YHY,0.5333333333333333,0.7866666666666666,"{'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:Hydrophobic': 4, 'UNL:TYR:VdWContact': 4}","{'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:Hydrophobic': 4, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+2365,Boltz-1-Single-Seq,7EPV_FDA,0.24000000000000002,0.904,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 2, 'UNL:VAL:HBDonor': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}"
+2366,Boltz-1-Single-Seq,7UY4_SMI,0.26666666666666666,0.8933333333333333,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+2367,Boltz-1-Single-Seq,7N4N_0BK,0.2777777777777778,0.8888888888888888,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+2368,Boltz-1-Single-Seq,7UMW_NAD,0.11538461538461536,0.9538461538461539,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:HBAcceptor': 2, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBAcceptor': 2, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2369,Boltz-1-Single-Seq,7U3J_L6U,0.153846153846154,0.9384615384615385,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 3}"
+2370,Boltz-1-Single-Seq,6Z14_Q4Z,0.21428571428571433,0.9142857142857143,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 4, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+2371,Boltz-1-Single-Seq,6ZK5_IMH,0.47368421052631576,0.8105263157894738,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2372,Boltz-1-Single-Seq,7QGP_DJ8,0.1904761904761904,0.9238095238095239,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2373,Boltz-1-Single-Seq,7L5F_XNG,0.20833333333333331,0.9166666666666666,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2374,Boltz-1-Single-Seq,7FT9_4MB,0.14285714285714285,0.9428571428571428,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+2375,Boltz-1-Single-Seq,7OP9_06K,,0.0,,
+2376,Boltz-1-Single-Seq,7JXX_VP7,0.045454545454545456,0.9818181818181818,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2377,Boltz-1-Single-Seq,7CL8_TES,,0.0,,
+2378,Boltz-1-Single-Seq,7TM6_GPJ,0.20000000000000007,0.9199999999999999,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 3, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 2}"
+2379,Boltz-1-Single-Seq,7WQQ_5Z6,0.23529411764705885,0.9058823529411765,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 5, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 4, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 4, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+2380,Boltz-1-Single-Seq,7WL4_JFU,0.10526315789473684,0.9578947368421052,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+2381,Boltz-1-Single-Seq,7SCW_GSP,0.19230769230769226,0.9230769230769231,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 4, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 4, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+2382,Boltz-1-Single-Seq,7L7C_XQ1,0.5714285714285715,0.7714285714285714,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 3, 'UNL:PRO:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:GLN:Hydrophobic': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PRO:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}"
+2383,Boltz-1-Single-Seq,7PUV_84Z,0.125,0.95,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2384,Boltz-1-Single-Seq,7KQU_YOF,,0.0,,
+2385,Boltz-1-Single-Seq,7Z2O_IAJ,0.21428571428571427,0.9142857142857143,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}"
+2386,Boltz-1-Single-Seq,7PRM_81I,0.1304347826086957,0.9478260869565217,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2387,Boltz-1-Single-Seq,8FLV_ZB9,0.13043478260869565,0.9478260869565217,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+2388,Boltz-1-Single-Seq,7NLV_UJE,0.06666666666666665,0.9733333333333334,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 2, 'UNL:SER:VdWContact': 4, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 2, 'UNL:SER:VdWContact': 4, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+2389,Boltz-1-Single-Seq,7T0D_FPP,,0.0,,
+2390,Boltz-1-Single-Seq,7MWU_ZPM,0.22222222222222227,0.9111111111111111,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+2391,Boltz-1-Single-Seq,7L00_XCJ,0.2173913043478261,0.9130434782608695,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2392,Boltz-1-Single-Seq,8C5M_MTA,,0.0,,
+2393,Boltz-1-Single-Seq,7Z7F_IF3,0.14285714285714282,0.9428571428571428,"{'UNL:ASP:VdWContact': 2, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+2394,Boltz-1-Single-Seq,7TSF_H4B,,0.0,,
+2395,Boltz-1-Single-Seq,7TUO_KL9,0.4482758620689654,0.8206896551724139,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2396,Boltz-1-Single-Seq,7ED2_A3P,0.22222222222222224,0.9111111111111111,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+2397,Boltz-1-Single-Seq,7ZL5_IWE,0.5,0.8,"{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 2, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1}"
+2398,Boltz-1-Single-Seq,8F8E_XJI,0.44,0.8240000000000001,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+2399,Boltz-1-Single-Seq,7OZC_G6S,0.19999999999999998,0.92,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:HIS:VdWContact': 3, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+2400,Boltz-1-Single-Seq,7Q2B_M6H,0.07692307692307687,0.9692307692307692,"{'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 3}","{'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2401,Boltz-1-Single-Seq,6VTA_AKN,0.3333333333333333,0.8666666666666667,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1}"
+2402,Boltz-1-Single-Seq,7V3N_AKG,0.375,0.85,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2403,Boltz-1-Single-Seq,8F4J_PHO,,0.0,,
+2404,Boltz-1-Single-Seq,7ZOC_T8E,0.28571428571428564,0.8857142857142858,"{'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2}","{'UNL:ASN:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 4, 'UNL:HIS:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+2405,Boltz-1-Single-Seq,7WCF_ACP,0.08000000000000002,0.968,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 4, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 3, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+2406,Boltz-1-Single-Seq,7NUT_GLP,0.21428571428571425,0.9142857142857143,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 4, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1}"
+2407,Boltz-1-Single-Seq,7E4L_MDN,0.5000000000000001,0.7999999999999999,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:LYS:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+2408,Boltz-1-Single-Seq,7TS6_KMI,,0.0,,
+2409,Boltz-1-Single-Seq,7NF3_4LU,0.10344827586206892,0.9586206896551724,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+2410,Boltz-1-Single-Seq,8D5D_5DK,0.1739130434782608,0.9304347826086957,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2411,Boltz-1-Single-Seq,7JMV_4NC,0.11764705882352933,0.9529411764705883,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2412,Boltz-1-Single-Seq,7A9E_R4W,0.6153846153846153,0.7538461538461538,"{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+2413,Boltz-1-Single-Seq,7TBU_S3P,0.3333333333333333,0.8666666666666667,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 5, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1}"
+2414,Boltz-1-Single-Seq,7TB0_UD1,,0.0,,
+2415,Boltz-1-Single-Seq,7MFP_Z7P,0.38235294117647045,0.8470588235294119,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:HBDonor': 2, 'UNL:ASN:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 4}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:HBDonor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 5, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:Hydrophobic': 3, 'UNL:THR:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}"
+2416,Boltz-1-Single-Seq,6M2B_EZO,0.1578947368421053,0.9368421052631579,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2417,Boltz-1-Single-Seq,7NPL_UKZ,0.52,0.792,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 5, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2418,Boltz-1-Single-Seq,7KZ9_XN7,0.24999999999999994,0.9,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+2419,Boltz-1-Single-Seq,7QE4_NGA,,0.0,,
+2420,Boltz-1-Single-Seq,8AP0_PRP,0.17647058823529416,0.9294117647058824,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+2421,Boltz-1-Single-Seq,7V3S_5I9,0.21739130434782616,0.9130434782608695,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 3, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3}"
+2422,Boltz-1-Single-Seq,7C0U_FGO,0.1428571428571429,0.9428571428571428,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 4}"
+2423,Boltz-1-Single-Seq,7UXS_OJC,0.19047619047619052,0.9238095238095237,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 4, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1}"
+2424,Boltz-1-Single-Seq,7X9K_8OG,0.05,0.98,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+2425,Boltz-1-Single-Seq,8BOM_QU6,0.07999999999999996,0.968,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 4, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2426,Boltz-1-Single-Seq,8BTI_RFO,0.13333333333333333,0.9466666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2427,Boltz-1-Single-Seq,7RWS_4UR,0.4375,0.825,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2428,Boltz-1-Single-Seq,6YQV_8K2,0.4444444444444445,0.8222222222222222,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2429,Boltz-1-Single-Seq,7PK0_BYC,0.039999999999999994,0.984,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2430,Boltz-1-Single-Seq,5SIS_JSM,0.1578947368421052,0.9368421052631579,"{'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2431,Boltz-1-Single-Seq,7NSW_HC4,0.043478260869565216,0.9826086956521739,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2432,Boltz-1-Single-Seq,7F8T_FAD,0.4285714285714285,0.8285714285714286,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 4, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2433,Boltz-1-Single-Seq,5SD5_HWI,0.23529411764705876,0.9058823529411765,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+2434,Boltz-1-Single-Seq,7CUO_PHB,0.1578947368421052,0.9368421052631579,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+2435,Boltz-1-Single-Seq,7R3D_APR,0.22222222222222224,0.9111111111111111,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 4}","{'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 4}"
+2436,Boltz-1-Single-Seq,7WJB_BGC,0.09090909090909088,0.9636363636363636,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+2437,Boltz-1-Single-Seq,7A1P_QW2,0.15789473684210525,0.9368421052631579,"{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+2438,Boltz-1-Single-Seq,6ZPB_3D1,0.3125,0.875,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2439,Boltz-1-Single-Seq,7UTW_NAI,0.045454545454545414,0.9818181818181818,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 3}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 3}"
+2440,Boltz-1-Single-Seq,7WUY_76N,,0.0,,
+2441,Boltz-1-Single-Seq,8A2D_KXY,0.2413793103448276,0.903448275862069,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3}"
+2442,Boltz-1-Single-Seq,7NR8_UOE,,0.0,,
+2443,Boltz-1-Single-Seq,7KC5_BJZ,0.7142857142857142,0.7142857142857143,"{'UNL:ILE:Hydrophobic': 5, 'UNL:ILE:VdWContact': 4, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3}","{'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+2444,Boltz-1-Single-Seq,7QPP_VDX,0.04999999999999993,0.98,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+2445,Boltz-1-Single-Seq,7VKZ_NOJ,0.3846153846153846,0.8461538461538461,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 2}"
+2446,Boltz-1-Single-Seq,7F51_BA7,0.19354838709677424,0.9225806451612903,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 3, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 2}"
+2447,Boltz-1-Single-Seq,7PL1_SFG,0.09090909090909086,0.9636363636363636,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+2448,Boltz-1-Single-Seq,7VB8_STL,,0.0,,
+2449,Boltz-1-Single-Seq,8FAV_4Y5,0.22222222222222227,0.9111111111111111,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:Hydrophobic': 4, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 3, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2450,Boltz-1-Single-Seq,7CD9_FVR,0.5,0.8,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 4, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 5, 'UNL:TYR:VdWContact': 5}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3}"
+2451,Boltz-1-Single-Seq,7N7H_CTP,0.13043478260869565,0.9478260869565217,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 4, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 3, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 4, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+2452,Boltz-1-Single-Seq,7ODY_DGI,0.28571428571428564,0.8857142857142858,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2}"
+2453,Boltz-1-Single-Seq,8CSD_C5P,0.25,0.9,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 2, 'UNL:SER:VdWContact': 3, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2454,Boltz-1-Single-Seq,7OFK_VCH,0.14285714285714285,0.9428571428571428,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+2455,Boltz-1-Single-Seq,7SDD_4IP,0.3333333333333332,0.8666666666666667,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 4, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+2456,Boltz-1-Single-Seq,7OPG_06N,0.375,0.85,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3}"
+2457,Boltz-1-Single-Seq,7ZTL_BCN,0.5833333333333335,0.7666666666666666,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 4, 'UNL:HIS:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+2458,Boltz-1-Single-Seq,7SIU_9ID,0.3478260869565218,0.8608695652173912,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2459,Boltz-1-Single-Seq,7LCU_XTA,0.2380952380952382,0.9047619047619048,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2460,Boltz-1-Single-Seq,7NGW_UAW,0.1,0.96,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2461,Boltz-1-Single-Seq,7VYJ_CA0,,0.0,,
+2462,Boltz-1-Single-Seq,7QHG_T3B,0.2413793103448274,0.903448275862069,"{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 3, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 3}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+2463,Boltz-1-Single-Seq,8HO0_3ZI,,0.0,,
+2464,Boltz-1,8AAU_LH0,0.3125,0.875,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2465,Boltz-1,7JHQ_VAJ,0.4,0.84,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+2466,Boltz-1,6ZCY_QF8,0.17391304347826092,0.9304347826086956,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+2467,Boltz-1,7UAW_MF6,0.375,0.85,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+2468,Boltz-1,6YMS_OZH,0.1428571428571429,0.9428571428571428,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 2, 'UNL:ASN:VdWContact': 3, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2469,Boltz-1,7UJ5_DGL,0.21052631578947373,0.9157894736842105,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+2470,Boltz-1,8EX2_Q2Q,,0.0,,
+2471,Boltz-1,7R9N_F97,0.4375,0.825,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}"
+2472,Boltz-1,7UYB_OK0,0.2,0.92,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+2473,Boltz-1,7U0U_FK5,0.33333333333333337,0.8666666666666667,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 5, 'UNL:PHE:VdWContact': 5, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 3}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU-:Hydrophobic': 1, 'UNL:GLU-:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE-:Hydrophobic': 1, 'UNL:PHE-:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:PRO-:Hydrophobic': 1, 'UNL:TRP-:HBAcceptor': 1, 'UNL:TRP-:Hydrophobic': 1, 'UNL:TRP-:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+2474,Boltz-1,7ZU2_DHT,0.15384615384615374,0.9384615384615385,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 6, 'UNL:MET:VdWContact': 4, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 6, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+2475,Boltz-1,6XHT_V2V,0.22222222222222227,0.9111111111111111,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 4, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:VdWContact': 1}"
+2476,Boltz-1,7OSO_0V1,0.2727272727272727,0.8909090909090909,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2}"
+2477,Boltz-1,8D19_GSH,0.5,0.8,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+2478,Boltz-1,7MGT_ZD4,0.16666666666666674,0.9333333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2479,Boltz-1,8C3N_ADP,0.1578947368421053,0.9368421052631579,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+2480,Boltz-1,6YYO_Q1K,,0.0,,
+2481,Boltz-1,8A1H_DLZ,,0.0,,
+2482,Boltz-1,7XQZ_FPF,0.1304347826086957,0.9478260869565217,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2483,Boltz-1,7RH3_59O,0.18181818181818185,0.9272727272727272,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 1}"
+2484,Boltz-1,7OMX_CNA,0.30434782608695654,0.8782608695652174,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:HBAcceptor': 2, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 3, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2485,Boltz-1,7LMO_NYO,0.619047619047619,0.7523809523809524,"{'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 4, 'UNL:TYR:VdWContact': 4, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 4, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2486,Boltz-1,7VBU_6I4,0.0714285714285714,0.9714285714285714,"{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2487,Boltz-1,7TXK_LW8,0.15789473684210525,0.9368421052631579,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+2488,Boltz-1,7T1D_E7K,0.4210526315789473,0.8315789473684211,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:PHE:Hydrophobic': 8, 'UNL:PHE:VdWContact': 7, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 7, 'UNL:PHE:VdWContact': 5, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2489,Boltz-1,7R59_I5F,0.1,0.96,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+2490,Boltz-1,7ZCC_OGA,,0.0,,
+2491,Boltz-1,7V43_C4O,,0.0,,
+2492,Boltz-1,7BNH_BEZ,1.1428571428571428,0.5428571428571429,{},"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+2493,Boltz-1,6WTN_RXT,0.11764705882352944,0.9529411764705882,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2494,Boltz-1,7QFM_AY3,0.3684210526315789,0.8526315789473684,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2495,Boltz-1,7MSR_DCA,0.13043478260869557,0.9478260869565218,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 3, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 3, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2496,Boltz-1,5SAK_ZRY,,0.0,,
+2497,Boltz-1,7QTA_URI,0.1111111111111111,0.9555555555555556,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}"
+2498,Boltz-1,7RSV_7IQ,0.33333333333333326,0.8666666666666667,"{'UNL:GLN:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1}"
+2499,Boltz-1,8DSC_NCA,0.4285714285714285,0.8285714285714286,"{'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1}"
+2500,Boltz-1,7AKL_RK5,0.0,1.0,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3}"
+2501,Boltz-1,7XBV_APC,0.11111111111111105,0.9555555555555556,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2502,Boltz-1,7CNS_PMV,0.38888888888888895,0.8444444444444444,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+2503,Boltz-1,7ZDY_6MJ,0.25,0.9,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 3}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+2504,Boltz-1,6Z4N_Q7B,0.2857142857142857,0.8857142857142857,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2}"
+2505,Boltz-1,7NFB_GEN,,0.0,,
+2506,Boltz-1,7R7R_AWJ,0.2222222222222223,0.9111111111111111,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2507,Boltz-1,7V14_ORU,0.1333333333333333,0.9466666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2508,Boltz-1,6YR2_T1C,0.40909090909090906,0.8363636363636364,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+2509,Boltz-1,7JG0_GAR,0.18181818181818185,0.9272727272727272,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:V:VdWContact': 1}"
+2510,Boltz-1,7EBG_J0L,0.36363636363636354,0.8545454545454546,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+2511,Boltz-1,8AY3_OE3,0.0625,0.975,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+2512,Boltz-1,7M6K_YRJ,0.05882352941176472,0.9764705882352941,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2513,Boltz-1,6YT6_PKE,0.22727272727272718,0.9090909090909092,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2514,Boltz-1,7Q27_8KC,0.23809523809523808,0.9047619047619048,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+2515,Boltz-1,8DHG_T78,0.1304347826086957,0.9478260869565217,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+2516,Boltz-1,8EXL_799,0.15999999999999998,0.936,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}"
+2517,Boltz-1,7FB7_8NF,0.2,0.92,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1}"
+2518,Boltz-1,7THI_PGA,0.4999999999999999,0.8,"{'UNL:ARG:VdWContact': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+2519,Boltz-1,6ZAE_ACV,0.125,0.95,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+2520,Boltz-1,7MGY_ZD1,0.13333333333333336,0.9466666666666667,"{'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+2521,Boltz-1,7XPO_UPG,0.20000000000000007,0.9199999999999999,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+2522,Boltz-1,7SUC_COM,,0.0,,
+2523,Boltz-1,7BJJ_TVW,0.1,0.96,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+2524,Boltz-1,7K0V_VQP,0.6551724137931033,0.7379310344827587,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 4, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2525,Boltz-1,7TE8_P0T,0.3333333333333333,0.8666666666666667,"{'UNL:ALA:Hydrophobic': 4, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 3, 'UNL:ASN:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+2526,Boltz-1,7QF4_RBF,0.04999999999999993,0.98,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 4, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}"
+2527,Boltz-1,7UJ4_OQ4,0.1666666666666666,0.9333333333333333,"{'UNL:ALA:Hydrophobic': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+2528,Boltz-1,7A9H_TPP,0.1379310344827586,0.9448275862068966,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+2529,Boltz-1,7LEV_0JO,0.2380952380952382,0.9047619047619048,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 5, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 4, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 2}"
+2530,Boltz-1,7N6F_0I1,,0.0,,
+2531,Boltz-1,8EAB_VN2,0.35714285714285726,0.8571428571428571,"{'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:HBAcceptor': 2, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:HBAcceptor': 2, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+2532,Boltz-1,6ZC3_JOR,0.2,0.92,"{'UNL:ARG:Hydrophobic': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2533,Boltz-1,7Q25_8J9,,0.0,,
+2534,Boltz-1,7C3U_AZG,0.1538461538461538,0.9384615384615385,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2}"
+2535,Boltz-1,7ROR_69X,0.033333333333333326,0.9866666666666667,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+2536,Boltz-1,7MMH_ZJY,0.07142857142857141,0.9714285714285714,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2537,Boltz-1,7TH4_FFO,0.3181818181818182,0.8727272727272728,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2538,Boltz-1,8D39_QDB,,0.0,,
+2539,Boltz-1,7YZU_DO7,0.38888888888888884,0.8444444444444444,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 2}"
+2540,Boltz-1,5SB2_1K2,0.16000000000000006,0.9359999999999999,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2541,Boltz-1,6M73_FNR,0.10714285714285712,0.9571428571428572,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2542,Boltz-1,8B8H_OJQ,0.13793103448275867,0.9448275862068966,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}"
+2543,Boltz-1,7TOM_5AD,0.26086956521739135,0.8956521739130434,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2544,Boltz-1,7VWF_K55,0.15384615384615385,0.9384615384615385,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:Hydrophobic': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 1}"
+2545,Boltz-1,7XI7_4RI,0.16666666666666669,0.9333333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2546,Boltz-1,7AN5_RDH,0.12000000000000002,0.952,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+2547,Boltz-1,7B2C_TP7,,0.0,,
+2548,Boltz-1,7B94_ANP,0.35000000000000003,0.86,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2549,Boltz-1,7NF0_BYN,0.032258064516129004,0.9870967741935484,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1}"
+2550,Boltz-1,7WKL_CAQ,0.23076923076923073,0.9076923076923077,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2551,Boltz-1,7WPW_F15,0.2631578947368421,0.8947368421052632,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2552,Boltz-1,8SLG_G5A,0.2941176470588236,0.8823529411764706,"{'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 4, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 3, 'UNL:GLU:VdWContact': 5, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+2553,Boltz-1,7RNI_60I,,0.0,,
+2554,Boltz-1,7SZA_DUI,0.15789473684210525,0.9368421052631579,"{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2555,Boltz-1,7PIH_7QW,0.1499999999999999,0.9400000000000001,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+2556,Boltz-1,7T3E_SLB,0.125,0.95,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2}"
+2557,Boltz-1,7FRX_O88,,0.0,,
+2558,Boltz-1,8CNH_V6U,0.38888888888888895,0.8444444444444444,"{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+2559,Boltz-1,7C8Q_DSG,,0.0,,
+2560,Boltz-1,7ZF0_DHR,0.25,0.9,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 3}"
+2561,Boltz-1,8G0V_YHT,,0.0,,
+2562,Boltz-1,7P5T_5YG,,0.0,,
+2563,Boltz-1,7NU0_DCL,0.09090909090909091,0.9636363636363636,"{'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2564,Boltz-1,6Z0R_Q4H,0.2727272727272727,0.8909090909090909,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1}","{'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1}"
+2565,Boltz-1,7XRL_FWK,,0.0,,
+2566,Boltz-1,7LOU_IFM,0.07692307692307693,0.9692307692307692,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:UDP:VdWContact': 1}"
+2567,Boltz-1,7ROU_66I,0.09677419354838701,0.9612903225806452,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+2568,Boltz-1,6XCT_478,0.38888888888888884,0.8444444444444444,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 5, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2569,Boltz-1,7LT0_ONJ,0.21052631578947378,0.9157894736842105,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}"
+2570,Boltz-1,7OLI_8HG,0.0625,0.975,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2}"
+2571,Boltz-1,7Z1Q_NIO,0.2,0.92,"{'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+2572,Boltz-1,6YQW_82I,0.1,0.96,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2573,Boltz-1,6T88_MWQ,0.25,0.9,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2574,Boltz-1,7PRI_7TI,0.3846153846153845,0.8461538461538463,"{'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:VdWContact': 4, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:VdWContact': 1}"
+2575,Boltz-1,7OFF_VCB,0.13333333333333336,0.9466666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+2576,Boltz-1,7DQL_4CL,0.39999999999999997,0.8400000000000001,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 3}"
+2577,Boltz-1,7O1T_5X8,0.1,0.96,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:CYS:Hydrophobic': 2, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+2578,Boltz-1,7KM8_WPD,0.15000000000000008,0.94,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+2579,Boltz-1,7ZXV_45D,0.2413793103448275,0.903448275862069,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 4, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL::Hydrophobic': 1, 'UNL::VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 5, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+2580,Boltz-1,7X5N_5M5,0.09090909090909088,0.9636363636363636,"{'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2581,Boltz-1,7VQ9_ISY,0.25,0.9,"{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+2582,Boltz-1,7PJQ_OWH,0.20000000000000007,0.9199999999999999,"{'UNL:ASN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2}","{'UNL:ASN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+2583,Boltz-1,8AQL_PLG,,0.0,,
+2584,Boltz-1,7VC5_9SF,0.3125,0.875,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2585,Boltz-1,7AFX_R9K,0.14285714285714288,0.9428571428571428,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1}"
+2586,Boltz-1,7RKW_5TV,,0.0,,
+2587,Boltz-1,7TYP_KUR,0.21739130434782622,0.9130434782608695,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 5, 'UNL:PHE:VdWContact': 3, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 2, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2588,Boltz-1,7L03_F9F,0.05555555555555555,0.9777777777777777,"{'UNL:ALA:Hydrophobic': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2589,Boltz-1,7P1F_KFN,0.4285714285714286,0.8285714285714285,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2590,Boltz-1,7O0N_CDP,0.18181818181818182,0.9272727272727272,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 4, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 5, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+2591,Boltz-1,7MYU_ZR7,0.0,1.0,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+2592,Boltz-1,6YSP_PAL,0.1875,0.925,"{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 4, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3}","{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 3, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 4, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2}"
+2593,Boltz-1,7XJN_NSD,0.39999999999999997,0.8400000000000001,"{'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+2594,Boltz-1,7R6J_2I7,,0.0,,
+2595,Boltz-1,8HFN_XGC,0.13043478260869562,0.9478260869565217,"{'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2596,Boltz-1,7BTT_F8R,0.3333333333333334,0.8666666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+2597,Boltz-1,7MY1_IPE,0.18181818181818182,0.9272727272727272,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+2598,Boltz-1,8FO5_Y4U,1.1818181818181817,0.5272727272727273,"{'UNL:ASN:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 4, 'UNL:TYR:Hydrophobic': 7, 'UNL:TYR:VdWContact': 7}","{'UNL:GLN:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2}"
+2599,Boltz-1,8AUH_L9I,0.28571428571428564,0.8857142857142858,"{'UNL:ALA:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:CYS:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+2600,Boltz-1,7ECR_SIN,,0.0,,
+2601,Boltz-1,6TW5_9M2,,0.0,,
+2602,Boltz-1,7ELT_TYM,0.07407407407407407,0.9703703703703703,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 3}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 3}"
+2603,Boltz-1,7D5C_GV6,0.18518518518518517,0.9259259259259259,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 4, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2604,Boltz-1,7W06_ITN,0.2941176470588236,0.8823529411764706,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 2}"
+2605,Boltz-1,6YJA_2BA,0.3333333333333333,0.8666666666666667,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2606,Boltz-1,7P1M_4IU,0.19999999999999996,0.92,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+2607,Boltz-1,7PGX_FMN,0.09523809523809529,0.9619047619047619,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}"
+2608,Boltz-1,7UAS_MBU,0.1875,0.925,"{'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 2, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ASP:Hydrophobic': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+2609,Boltz-1,8GFD_ZHR,0.29999999999999993,0.88,"{'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2610,Boltz-1,7CTM_BDP,0.23076923076923084,0.9076923076923077,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CSD:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1}"
+2611,Boltz-1,7UQ3_O2U,0.07142857142857142,0.9714285714285714,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2612,Boltz-1,7DKT_GLF,0.08333333333333337,0.9666666666666667,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+2613,Boltz-1,7CNQ_G8X,,0.0,,
+2614,Boltz-1,6Z1C_7EY,0.06666666666666665,0.9733333333333334,"{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 2}"
+2615,Boltz-1,7M3H_YPV,0.25,0.9,"{'UNL:ALA:Hydrophobic': 4, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1}"
+2616,Boltz-1,7D6O_MTE,,0.0,,
+2617,Boltz-1,7N4W_P4V,0.05555555555555555,0.9777777777777777,"{'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2618,Boltz-1,6Z2C_Q5E,0.07142857142857142,0.9714285714285714,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2619,Boltz-1,7CIJ_G0C,0.35,0.86,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2}"
+2620,Boltz-1,7USH_82V,0.16666666666666666,0.9333333333333333,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}"
+2621,Boltz-1,7XG5_PLP,0.20000000000000007,0.9199999999999999,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}"
+2622,Boltz-1,7PT3_3KK,0.1250000000000001,0.95,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2623,Boltz-1,7KB1_WBJ,,0.0,,
+2624,Boltz-1,7WUX_6OI,,0.0,,
+2625,Boltz-1,7OZ9_NGK,0.5,0.8,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1}"
+2626,Boltz-1,7N03_ZRP,0.23529411764705885,0.9058823529411765,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2627,Boltz-1,7BMI_U4B,0.0,1.0,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2628,Boltz-1,7RZL_NPO,0.09999999999999998,0.96,"{'UNL:GLY:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2629,Boltz-1,7QHL_D5P,1.0416666666666665,0.5833333333333334,"{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 3, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 3}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2630,Boltz-1,7N7B_T3F,0.19047619047619052,0.9238095238095237,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+2631,Boltz-1,7Q5I_I0F,0.14999999999999997,0.9400000000000001,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}"
+2632,Boltz-1,7BKA_4JC,0.3125,0.875,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2633,Boltz-1,7NXO_UU8,0.22727272727272724,0.9090909090909091,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2634,Boltz-1,6XG5_TOP,0.08333333333333337,0.9666666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1}"
+2635,Boltz-1,6XBO_5MC,0.11111111111111113,0.9555555555555555,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}"
+2636,Boltz-1,8DKO_TFB,0.125,0.95,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+2637,Boltz-1,7LJN_GTP,,0.0,,
+2638,Boltz-1,7MOI_HPS,0.27272727272727276,0.8909090909090909,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 1}"
+2639,Boltz-1,8G6P_API,0.050000000000000044,0.98,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:HBDonor': 2, 'UNL:LYS:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1}"
+2640,Boltz-1,7ULC_56B,0.13636363636363646,0.9454545454545454,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+2641,Boltz-1,7RC3_SAH,0.23999999999999994,0.904,"{'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+2642,Boltz-1,7SFO_98L,0.22222222222222218,0.9111111111111111,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1}"
+2643,Boltz-1,8DP2_UMA,0.12499999999999997,0.95,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}"
+2644,Boltz-1,7ZZW_KKW,,0.0,,
+2645,Boltz-1,7XFA_D9J,0.33333333333333326,0.8666666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}"
+2646,Boltz-1,7NP6_UK8,0.3333333333333333,0.8666666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 4, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2647,Boltz-1,7F5D_EUO,0.3333333333333334,0.8666666666666667,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+2648,Boltz-1,6TW7_NZB,0.2857142857142857,0.8857142857142857,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+2649,Boltz-1,7FHA_ADX,0.1428571428571428,0.9428571428571428,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 1}"
+2650,Boltz-1,7ES1_UDP,0.11111111111111102,0.9555555555555556,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2651,Boltz-1,7OEO_V9Z,0.05882352941176472,0.9764705882352941,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}"
+2652,Boltz-1,7DUA_HJ0,0.1666666666666667,0.9333333333333333,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2653,Boltz-1,7BCP_GCO,0.3571428571428571,0.8571428571428572,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1}"
+2654,Boltz-1,7P2I_MFU,0.30769230769230765,0.8769230769230769,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2}"
+2655,Boltz-1,7WDT_NGS,0.6428571428571429,0.7428571428571429,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+2656,Boltz-1,8AEM_LVF,0.33333333333333337,0.8666666666666667,"{'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:MET:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2657,Boltz-1,7WY1_D0L,,0.0,,
+2658,Boltz-1,7KRU_ATP,0.2631578947368421,0.8947368421052632,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 6, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 6, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2}"
+2659,Boltz-1,7P4C_5OV,0.21428571428571425,0.9142857142857143,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:VdWContact': 2}"
+2660,Boltz-1,7MWN_WI5,0.18181818181818182,0.9272727272727272,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+2661,Boltz-1,7ZHP_IQY,0.18181818181818174,0.9272727272727272,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2662,Boltz-1,7W05_GMP,0.23076923076923078,0.9076923076923077,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+2663,Boltz-1,7UJF_R3V,0.26086956521739135,0.8956521739130434,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+2664,Boltz-1,7LOE_Y84,0.25,0.9,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3}"
+2665,Boltz-1,8AIE_M7L,0.3125,0.875,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 3, 'UNL:THR:VdWContact': 5, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 3, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+2666,Boltz-1,7JY3_VUD,,0.0,,
+2667,Boltz-1,6XM9_V55,0.2857142857142857,0.8857142857142857,"{'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2668,Boltz-1,7POM_7VZ,0.16666666666666663,0.9333333333333333,"{'UNL:GLN:VdWContact': 2, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:HIS:HBDonor': 2, 'UNL:HIS:VdWContact': 4, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2669,Boltz-1,7M31_TDR,,0.0,,
+2670,Boltz-1,8EYE_X4I,0.1304347826086957,0.9478260869565217,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 5, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 5, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2671,Boltz-1,6YRV_PJ8,0.24999999999999997,0.9,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 3, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2672,Boltz-1,7LZD_YHY,0.5000000000000001,0.7999999999999999,"{'UNL:GLU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 2, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 4}","{'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:Hydrophobic': 4, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+2673,Boltz-1,7EPV_FDA,0.2399999999999999,0.904,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}"
+2674,Boltz-1,7UY4_SMI,0.3571428571428571,0.8571428571428572,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+2675,Boltz-1,7N4N_0BK,0.2666666666666666,0.8933333333333333,"{'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+2676,Boltz-1,7UMW_NAD,0.04,0.984,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBAcceptor': 2, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBAcceptor': 2, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2677,Boltz-1,7U3J_L6U,0.0,1.0,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 3}"
+2678,Boltz-1,6Z14_Q4Z,0.23076923076923078,0.9076923076923077,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 4, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+2679,Boltz-1,6ZK5_IMH,0.30000000000000004,0.88,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2680,Boltz-1,7QGP_DJ8,0.23809523809523808,0.9047619047619048,"{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2681,Boltz-1,7L5F_XNG,0.18181818181818196,0.9272727272727272,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2682,Boltz-1,7FT9_4MB,0.23529411764705882,0.9058823529411765,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+2683,Boltz-1,7OP9_06K,,0.0,,
+2684,Boltz-1,7JXX_VP7,0.0,1.0,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2685,Boltz-1,7CL8_TES,,0.0,,
+2686,Boltz-1,7TM6_GPJ,0.14285714285714293,0.9428571428571428,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 3, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 2}"
+2687,Boltz-1,7WQQ_5Z6,0.1333333333333333,0.9466666666666667,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 4, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:Hydrophobic': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 4, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+2688,Boltz-1,7WL4_JFU,0.1666666666666666,0.9333333333333333,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+2689,Boltz-1,7SCW_GSP,0.15999999999999998,0.936,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 4, 'UNL:LYS:HBAcceptor': 2, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 4, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+2690,Boltz-1,7L7C_XQ1,0.15384615384615385,0.9384615384615385,"{'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1}","{'UNL:GLN:Hydrophobic': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PRO:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}"
+2691,Boltz-1,7PUV_84Z,0.1333333333333333,0.9466666666666667,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2692,Boltz-1,7KQU_YOF,,0.0,,
+2693,Boltz-1,7Z2O_IAJ,0.14285714285714285,0.9428571428571428,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}"
+2694,Boltz-1,7PRM_81I,0.2692307692307691,0.8923076923076924,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2695,Boltz-1,8FLV_ZB9,0.17391304347826095,0.9304347826086956,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+2696,Boltz-1,7NLV_UJE,0.17647058823529416,0.9294117647058824,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 2, 'UNL:SER:VdWContact': 4, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 2, 'UNL:SER:VdWContact': 4, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+2697,Boltz-1,7T0D_FPP,,0.0,,
+2698,Boltz-1,7MWU_ZPM,0.4000000000000001,0.84,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+2699,Boltz-1,7L00_XCJ,0.31818181818181823,0.8727272727272727,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2700,Boltz-1,8C5M_MTA,,0.0,,
+2701,Boltz-1,7Z7F_IF3,0.23076923076923078,0.9076923076923077,"{'UNL:ASP:VdWContact': 2, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 2, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+2702,Boltz-1,7TSF_H4B,,0.0,,
+2703,Boltz-1,7TUO_KL9,0.44444444444444453,0.8222222222222222,"{'UNL:ARG:Hydrophobic': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2704,Boltz-1,7ED2_A3P,0.2777777777777778,0.8888888888888888,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+2705,Boltz-1,7ZL5_IWE,0.5714285714285714,0.7714285714285715,"{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 6, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1}"
+2706,Boltz-1,8F8E_XJI,0.6086956521739129,0.7565217391304349,"{'UNL:ALA:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+2707,Boltz-1,7OZC_G6S,0.21428571428571436,0.9142857142857143,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:HIS:VdWContact': 3, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+2708,Boltz-1,7Q2B_M6H,0.3,0.88,"{'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2709,Boltz-1,6VTA_AKN,0.3333333333333333,0.8666666666666667,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 3, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1}"
+2710,Boltz-1,7V3N_AKG,0.3333333333333333,0.8666666666666667,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2711,Boltz-1,8F4J_PHO,,0.0,,
+2712,Boltz-1,7ZOC_T8E,0.21428571428571422,0.9142857142857144,"{'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 4, 'UNL:HIS:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+2713,Boltz-1,7WCF_ACP,0.0769230769230769,0.9692307692307692,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 4, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 3, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+2714,Boltz-1,7NUT_GLP,0.0625,0.975,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1}"
+2715,Boltz-1,7E4L_MDN,0.2727272727272727,0.8909090909090909,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+2716,Boltz-1,7TS6_KMI,,0.0,,
+2717,Boltz-1,7NF3_4LU,0.03448275862068961,0.9862068965517241,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+2718,Boltz-1,8D5D_5DK,0.28571428571428575,0.8857142857142857,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2719,Boltz-1,7JMV_4NC,0.05555555555555555,0.9777777777777777,"{'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2720,Boltz-1,7A9E_R4W,0.6153846153846153,0.7538461538461538,"{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+2721,Boltz-1,7TBU_S3P,0.6666666666666666,0.7333333333333334,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 2, 'UNL:LYS:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 4, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1}"
+2722,Boltz-1,7TB0_UD1,,0.0,,
+2723,Boltz-1,7MFP_Z7P,0.47058823529411764,0.8117647058823529,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 3, 'UNL:ASN:VdWContact': 5, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:HBAcceptor': 2, 'UNL:TYR:Hydrophobic': 4, 'UNL:TYR:VdWContact': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:HBDonor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 5, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:Hydrophobic': 3, 'UNL:THR:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}"
+2724,Boltz-1,6M2B_EZO,0.11111111111111116,0.9555555555555555,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2725,Boltz-1,7NPL_UKZ,0.44000000000000006,0.824,"{'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2726,Boltz-1,7KZ9_XN7,0.16666666666666663,0.9333333333333333,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+2727,Boltz-1,7QE4_NGA,,0.0,,
+2728,Boltz-1,8AP0_PRP,0.19047619047619047,0.9238095238095239,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+2729,Boltz-1,7V3S_5I9,0.19047619047619047,0.9238095238095239,"{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 3, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 3, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3}"
+2730,Boltz-1,7C0U_FGO,0.19999999999999998,0.92,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 4}"
+2731,Boltz-1,7UXS_OJC,0.26315789473684215,0.8947368421052632,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 4, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1}"
+2732,Boltz-1,7X9K_8OG,0.0,1.0,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+2733,Boltz-1,8BOM_QU6,0.07999999999999996,0.968,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 4, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2734,Boltz-1,8BTI_RFO,0.21428571428571422,0.9142857142857144,"{'UNL:ALA:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2735,Boltz-1,7RWS_4UR,0.4444444444444444,0.8222222222222222,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2736,Boltz-1,6YQV_8K2,0.125,0.95,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2737,Boltz-1,7PK0_BYC,0.15999999999999992,0.936,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2738,Boltz-1,5SIS_JSM,0.05263157894736842,0.9789473684210527,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2739,Boltz-1,7NSW_HC4,0.09090909090909088,0.9636363636363636,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2740,Boltz-1,7F8T_FAD,0.22580645161290328,0.9096774193548387,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 4, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2741,Boltz-1,5SD5_HWI,0.33333333333333337,0.8666666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+2742,Boltz-1,7CUO_PHB,0.1111111111111111,0.9555555555555556,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+2743,Boltz-1,7R3D_APR,0.3125,0.875,"{'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 5}","{'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 4}"
+2744,Boltz-1,7WJB_BGC,0.30769230769230776,0.8769230769230769,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+2745,Boltz-1,7A1P_QW2,0.05555555555555555,0.9777777777777777,"{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+2746,Boltz-1,6ZPB_3D1,0.3125,0.875,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2747,Boltz-1,7UTW_NAI,0.1363636363636364,0.9454545454545454,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 3}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 3}"
+2748,Boltz-1,7WUY_76N,,0.0,,
+2749,Boltz-1,8A2D_KXY,0.22222222222222227,0.9111111111111111,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 3, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3}"
+2750,Boltz-1,7NR8_UOE,,0.0,,
+2751,Boltz-1,7KC5_BJZ,0.7333333333333334,0.7066666666666667,"{'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 2}","{'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+2752,Boltz-1,7QPP_VDX,0.04999999999999993,0.98,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+2753,Boltz-1,7VKZ_NOJ,0.3571428571428571,0.8571428571428572,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 2}"
+2754,Boltz-1,7F51_BA7,0.22580645161290328,0.9096774193548387,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 3, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 2}"
+2755,Boltz-1,7PL1_SFG,0.125,0.95,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+2756,Boltz-1,7VB8_STL,,0.0,,
+2757,Boltz-1,8FAV_4Y5,0.7083333333333333,0.7166666666666667,"{'UNL:GLN:Hydrophobic': 3, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 3, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2758,Boltz-1,7CD9_FVR,0.42105263157894746,0.831578947368421,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 4, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 5, 'UNL:TYR:VdWContact': 5}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3}"
+2759,Boltz-1,7N7H_CTP,0.04166666666666666,0.9833333333333334,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 4, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 3, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 4, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+2760,Boltz-1,7ODY_DGI,0.1904761904761904,0.9238095238095239,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2}"
+2761,Boltz-1,8CSD_C5P,0.3,0.88,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 2, 'UNL:SER:VdWContact': 3, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2762,Boltz-1,7OFK_VCH,0.09090909090909094,0.9636363636363636,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+2763,Boltz-1,7SDD_4IP,0.3846153846153846,0.8461538461538461,"{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+2764,Boltz-1,7OPG_06N,0.39999999999999997,0.8400000000000001,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3}"
+2765,Boltz-1,7ZTL_BCN,0.4285714285714286,0.8285714285714285,"{'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+2766,Boltz-1,7SIU_9ID,0.4782608695652174,0.808695652173913,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2767,Boltz-1,7LCU_XTA,0.3157894736842105,0.8736842105263158,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2768,Boltz-1,7NGW_UAW,0.10000000000000006,0.96,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2769,Boltz-1,7VYJ_CA0,,0.0,,
+2770,Boltz-1,7QHG_T3B,0.23333333333333342,0.9066666666666666,"{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 5, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+2771,Boltz-1,8HO0_3ZI,,0.0,,
+2772,AF3-Single-Seq,8AAU_LH0,0.3333333333333333,0.8666666666666667,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2773,AF3-Single-Seq,7JHQ_VAJ,0.5833333333333334,0.7666666666666666,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+2774,AF3-Single-Seq,6ZCY_QF8,0.16666666666666674,0.9333333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+2775,AF3-Single-Seq,7UAW_MF6,1.2105263157894735,0.5157894736842106,"{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+2776,AF3-Single-Seq,6YMS_OZH,0.36000000000000004,0.856,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2777,AF3-Single-Seq,7UJ5_DGL,0.4583333333333333,0.8166666666666667,"{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+2778,AF3-Single-Seq,8EX2_Q2Q,,0.0,,
+2779,AF3-Single-Seq,7R9N_F97,0.5416666666666667,0.7833333333333333,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 4, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}"
+2780,AF3-Single-Seq,7UYB_OK0,0.20000000000000012,0.9199999999999999,"{'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+2781,AF3-Single-Seq,7U0U_FK5,0.40625,0.8375,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 5, 'UNL:PHE:VdWContact': 5, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU-:Hydrophobic': 1, 'UNL:GLU-:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE-:Hydrophobic': 1, 'UNL:PHE-:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:PRO-:Hydrophobic': 1, 'UNL:TRP-:HBAcceptor': 1, 'UNL:TRP-:Hydrophobic': 1, 'UNL:TRP-:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+2782,AF3-Single-Seq,7ZU2_DHT,0.3500000000000001,0.86,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 6, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+2783,AF3-Single-Seq,6XHT_V2V,0.9444444444444445,0.6222222222222222,"{'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 3, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 3}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 4, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:VdWContact': 1}"
+2784,AF3-Single-Seq,7OSO_0V1,0.07142857142857145,0.9714285714285714,"{'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2}"
+2785,AF3-Single-Seq,8D19_GSH,0.09999999999999998,0.96,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+2786,AF3-Single-Seq,7MGT_ZD4,0.5185185185185185,0.7925925925925926,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2787,AF3-Single-Seq,8C3N_ADP,0.3125,0.875,"{'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+2788,AF3-Single-Seq,6YYO_Q1K,1.375,0.44999999999999996,{},"{'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1}"
+2789,AF3-Single-Seq,8A1H_DLZ,0.9166666666666667,0.6333333333333333,"{'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+2790,AF3-Single-Seq,7XQZ_FPF,0.44000000000000017,0.824,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2791,AF3-Single-Seq,7RH3_59O,0.25,0.9,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 1}"
+2792,AF3-Single-Seq,7OMX_CNA,0.7692307692307692,0.6923076923076923,"{'UNL:ARG:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:HBAcceptor': 2, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 3, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2793,AF3-Single-Seq,7LMO_NYO,0.3478260869565217,0.8608695652173913,"{'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 4, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2794,AF3-Single-Seq,7VBU_6I4,0.13043478260869573,0.9478260869565217,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2795,AF3-Single-Seq,7TXK_LW8,0.5294117647058825,0.788235294117647,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 4, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+2796,AF3-Single-Seq,7T1D_E7K,0.6500000000000001,0.74,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 4, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 7, 'UNL:PHE:VdWContact': 5, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2797,AF3-Single-Seq,7R59_I5F,0.41666666666666663,0.8333333333333334,"{'UNL:ASP:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+2798,AF3-Single-Seq,7ZCC_OGA,,0.0,,
+2799,AF3-Single-Seq,7V43_C4O,0.5,0.8,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 4, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}"
+2800,AF3-Single-Seq,7BNH_BEZ,0.0,1.0,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+2801,AF3-Single-Seq,6WTN_RXT,0.2916666666666665,0.8833333333333334,"{'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2802,AF3-Single-Seq,7QFM_AY3,0.05882352941176472,0.9764705882352941,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2803,AF3-Single-Seq,7MSR_DCA,0.13333333333333341,0.9466666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 3, 'UNL:PRO:VdWContact': 3, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 3, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2804,AF3-Single-Seq,5SAK_ZRY,,0.0,,
+2805,AF3-Single-Seq,7QTA_URI,0.39999999999999997,0.8400000000000001,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}"
+2806,AF3-Single-Seq,7RSV_7IQ,0.42105263157894735,0.8315789473684211,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1}"
+2807,AF3-Single-Seq,8DSC_NCA,0.5882352941176472,0.7647058823529411,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1}"
+2808,AF3-Single-Seq,7AKL_RK5,0.24,0.904,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3}"
+2809,AF3-Single-Seq,7XBV_APC,0.38709677419354843,0.8451612903225807,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2810,AF3-Single-Seq,7CNS_PMV,0.6818181818181817,0.7272727272727273,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 4, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+2811,AF3-Single-Seq,7ZDY_6MJ,0.36363636363636354,0.8545454545454546,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+2812,AF3-Single-Seq,6Z4N_Q7B,0.47619047619047633,0.8095238095238095,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 4, 'UNL:GLY:VdWContact': 2, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 2, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2}"
+2813,AF3-Single-Seq,7NFB_GEN,0.5454545454545454,0.7818181818181819,"{'UNL:HIS:VdWContact': 1, 'UNL:LIG:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1}"
+2814,AF3-Single-Seq,7R7R_AWJ,0.17857142857142855,0.9285714285714286,"{'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2815,AF3-Single-Seq,7V14_ORU,0.4444444444444445,0.8222222222222222,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 4, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2816,AF3-Single-Seq,6YR2_T1C,0.2916666666666667,0.8833333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+2817,AF3-Single-Seq,7JG0_GAR,0.0,1.0,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:V:VdWContact': 1}"
+2818,AF3-Single-Seq,7EBG_J0L,0.5714285714285714,0.7714285714285715,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+2819,AF3-Single-Seq,8AY3_OE3,0.30000000000000004,0.88,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+2820,AF3-Single-Seq,7M6K_YRJ,0.050000000000000044,0.98,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2821,AF3-Single-Seq,6YT6_PKE,0.5217391304347827,0.7913043478260869,"{'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2822,AF3-Single-Seq,7Q27_8KC,0.16000000000000014,0.9359999999999999,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+2823,AF3-Single-Seq,8DHG_T78,0.5555555555555556,0.7777777777777778,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+2824,AF3-Single-Seq,8EXL_799,0.2692307692307692,0.8923076923076924,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 2, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 5, 'UNL:MET:VdWContact': 4, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}"
+2825,AF3-Single-Seq,7FB7_8NF,0.3125,0.875,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:SER:VdWContact': 2}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1}"
+2826,AF3-Single-Seq,7THI_PGA,0.33333333333333337,0.8666666666666667,"{'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 5}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+2827,AF3-Single-Seq,6ZAE_ACV,0.2142857142857143,0.9142857142857143,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 4, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+2828,AF3-Single-Seq,7MGY_ZD1,0.10000000000000003,0.96,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+2829,AF3-Single-Seq,7XPO_UPG,0.6190476190476191,0.7523809523809524,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+2830,AF3-Single-Seq,7SUC_COM,,0.0,,
+2831,AF3-Single-Seq,7BJJ_TVW,0.2142857142857143,0.9142857142857143,"{'UNL:CYS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+2832,AF3-Single-Seq,7K0V_VQP,0.5357142857142858,0.7857142857142857,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2833,AF3-Single-Seq,7TE8_P0T,0.4166666666666667,0.8333333333333333,"{'UNL:ALA:Hydrophobic': 4, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 5, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+2834,AF3-Single-Seq,7QF4_RBF,0.8571428571428572,0.6571428571428571,"{'UNL:GLN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}"
+2835,AF3-Single-Seq,7UJ4_OQ4,0.5909090909090908,0.7636363636363637,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+2836,AF3-Single-Seq,7A9H_TPP,0.1538461538461538,0.9384615384615385,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+2837,AF3-Single-Seq,7LEV_0JO,0.39130434782608703,0.8434782608695652,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 4, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 2}"
+2838,AF3-Single-Seq,7N6F_0I1,0.4545454545454546,0.8181818181818181,"{'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 5, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2839,AF3-Single-Seq,8EAB_VN2,0.4444444444444446,0.8222222222222222,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 6}","{'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:HBAcceptor': 2, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+2840,AF3-Single-Seq,6ZC3_JOR,0.5882352941176471,0.7647058823529411,"{'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 3, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2841,AF3-Single-Seq,7Q25_8J9,,0.0,,
+2842,AF3-Single-Seq,7C3U_AZG,0.6153846153846154,0.7538461538461538,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2}"
+2843,AF3-Single-Seq,7ROR_69X,0.2195121951219512,0.9121951219512195,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+2844,AF3-Single-Seq,7MMH_ZJY,0.4838709677419354,0.8064516129032259,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2845,AF3-Single-Seq,7TH4_FFO,0.45833333333333337,0.8166666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2846,AF3-Single-Seq,8D39_QDB,0.17647058823529416,0.9294117647058824,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+2847,AF3-Single-Seq,7YZU_DO7,0.3333333333333334,0.8666666666666667,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 2}"
+2848,AF3-Single-Seq,5SB2_1K2,0.3571428571428571,0.8571428571428572,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2849,AF3-Single-Seq,6M73_FNR,0.1470588235294118,0.9411764705882353,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2850,AF3-Single-Seq,8B8H_OJQ,0.49999999999999994,0.8,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}"
+2851,AF3-Single-Seq,7TOM_5AD,0.5909090909090909,0.7636363636363637,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 3, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2852,AF3-Single-Seq,7VWF_K55,0.6071428571428571,0.7571428571428571,"{'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 1}"
+2853,AF3-Single-Seq,7XI7_4RI,0.375,0.85,"{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2854,AF3-Single-Seq,7AN5_RDH,1.0454545454545454,0.5818181818181818,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+2855,AF3-Single-Seq,7B2C_TP7,,0.0,,
+2856,AF3-Single-Seq,7B94_ANP,0.6086956521739131,0.7565217391304347,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2857,AF3-Single-Seq,7NF0_BYN,0.5277777777777778,0.7888888888888889,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1}"
+2858,AF3-Single-Seq,7WKL_CAQ,0.3125,0.875,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2859,AF3-Single-Seq,7WPW_F15,0.22222222222222227,0.9111111111111111,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2860,AF3-Single-Seq,8SLG_G5A,0.47826086956521735,0.808695652173913,"{'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 3, 'UNL:GLU:VdWContact': 5, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+2861,AF3-Single-Seq,7RNI_60I,,0.0,,
+2862,AF3-Single-Seq,7SZA_DUI,0.38095238095238104,0.8476190476190476,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2863,AF3-Single-Seq,7PIH_7QW,0.18518518518518506,0.9259259259259259,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+2864,AF3-Single-Seq,7T3E_SLB,0.09523809523809523,0.9619047619047619,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2}"
+2865,AF3-Single-Seq,7FRX_O88,,0.0,,
+2866,AF3-Single-Seq,8CNH_V6U,0.3636363636363637,0.8545454545454545,"{'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+2867,AF3-Single-Seq,7C8Q_DSG,,0.0,,
+2868,AF3-Single-Seq,7ZF0_DHR,0.25,0.9,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 3}"
+2869,AF3-Single-Seq,8G0V_YHT,0.22727272727272724,0.9090909090909091,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2870,AF3-Single-Seq,7P5T_5YG,0.4999999999999999,0.8,"{'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+2871,AF3-Single-Seq,7NU0_DCL,0.2142857142857143,0.9142857142857143,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2872,AF3-Single-Seq,6Z0R_Q4H,0.39999999999999997,0.8400000000000001,"{'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2}","{'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1}"
+2873,AF3-Single-Seq,7XRL_FWK,0.10000000000000003,0.96,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2874,AF3-Single-Seq,7LOU_IFM,1.1111111111111112,0.5555555555555556,{},"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:UDP:VdWContact': 1}"
+2875,AF3-Single-Seq,7ROU_66I,0.4571428571428571,0.8171428571428572,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+2876,AF3-Single-Seq,6XCT_478,0.2222222222222222,0.9111111111111111,"{'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 5, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2877,AF3-Single-Seq,7LT0_ONJ,0.52,0.792,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 6, 'UNL:ILE:VdWContact': 4, 'UNL:LEU:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}"
+2878,AF3-Single-Seq,7OLI_8HG,0.5555555555555557,0.7777777777777777,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2}"
+2879,AF3-Single-Seq,7Z1Q_NIO,0.06666666666666665,0.9733333333333334,"{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+2880,AF3-Single-Seq,6YQW_82I,0.1818181818181818,0.9272727272727272,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2881,AF3-Single-Seq,6T88_MWQ,0.4375,0.825,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2882,AF3-Single-Seq,7PRI_7TI,0.25,0.9,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:VdWContact': 1}"
+2883,AF3-Single-Seq,7OFF_VCB,0.4375,0.825,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLY:VdWContact': 4, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+2884,AF3-Single-Seq,7DQL_4CL,0.5833333333333334,0.7666666666666666,"{'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 3}"
+2885,AF3-Single-Seq,7O1T_5X8,0.13043478260869562,0.9478260869565217,"{'UNL:ARG:VdWContact': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:CYS:Hydrophobic': 2, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+2886,AF3-Single-Seq,7KM8_WPD,0.6,0.76,"{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+2887,AF3-Single-Seq,7ZXV_45D,0.25806451612903236,0.896774193548387,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 4, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}","{'UNL::Hydrophobic': 1, 'UNL::VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 5, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+2888,AF3-Single-Seq,7X5N_5M5,0.19999999999999996,0.92,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2889,AF3-Single-Seq,7VQ9_ISY,0.49999999999999994,0.8,"{'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:MET:Hydrophobic': 2, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+2890,AF3-Single-Seq,7PJQ_OWH,0.33333333333333337,0.8666666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:CYS:Hydrophobic': 2, 'UNL:CYS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2}","{'UNL:ASN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+2891,AF3-Single-Seq,8AQL_PLG,0.6666666666666667,0.7333333333333333,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 4, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2892,AF3-Single-Seq,7VC5_9SF,0.8461538461538461,0.6615384615384615,"{'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2893,AF3-Single-Seq,7AFX_R9K,0.4,0.84,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1}"
+2894,AF3-Single-Seq,7RKW_5TV,0.375,0.85,"{'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2895,AF3-Single-Seq,7TYP_KUR,0.6363636363636361,0.7454545454545456,"{'UNL:CYS:Hydrophobic': 2, 'UNL:CYS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 2, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2896,AF3-Single-Seq,7L03_F9F,0.33333333333333337,0.8666666666666667,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2897,AF3-Single-Seq,7P1F_KFN,1.3333333333333333,0.4666666666666667,"{'UNL:ASP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2898,AF3-Single-Seq,7O0N_CDP,0.40909090909090906,0.8363636363636364,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 5, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+2899,AF3-Single-Seq,7MYU_ZR7,0.26086956521739124,0.8956521739130435,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+2900,AF3-Single-Seq,6YSP_PAL,0.95,0.62,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 3, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 4, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2}"
+2901,AF3-Single-Seq,7XJN_NSD,1.2727272727272725,0.49090909090909096,"{'UNL:GLU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+2902,AF3-Single-Seq,7R6J_2I7,1.0666666666666669,0.5733333333333333,"{'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 2, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2903,AF3-Single-Seq,8HFN_XGC,0.5714285714285714,0.7714285714285715,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 6, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2904,AF3-Single-Seq,7BTT_F8R,0.47368421052631576,0.8105263157894738,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+2905,AF3-Single-Seq,7MY1_IPE,0.25,0.9,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+2906,AF3-Single-Seq,8FO5_Y4U,0.35714285714285704,0.8571428571428572,"{'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:GLN:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2}"
+2907,AF3-Single-Seq,8AUH_L9I,0.5714285714285714,0.7714285714285715,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:CYS:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+2908,AF3-Single-Seq,7ECR_SIN,1.0909090909090908,0.5636363636363637,{'UNL:GLN:VdWContact': 1},"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2909,AF3-Single-Seq,6TW5_9M2,0.35,0.86,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2910,AF3-Single-Seq,7ELT_TYM,0.606060606060606,0.7575757575757576,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 3}"
+2911,AF3-Single-Seq,7D5C_GV6,0.11111111111111116,0.9555555555555555,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2912,AF3-Single-Seq,7W06_ITN,1.1666666666666667,0.5333333333333333,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 2}"
+2913,AF3-Single-Seq,6YJA_2BA,0.75,0.7,"{'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 4, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2914,AF3-Single-Seq,7P1M_4IU,0.35294117647058826,0.8588235294117648,"{'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+2915,AF3-Single-Seq,7PGX_FMN,0.5217391304347826,0.7913043478260869,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}"
+2916,AF3-Single-Seq,7UAS_MBU,0.2777777777777777,0.888888888888889,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ASP:Hydrophobic': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+2917,AF3-Single-Seq,8GFD_ZHR,0.11764705882352938,0.9529411764705883,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2918,AF3-Single-Seq,7CTM_BDP,0.4615384615384616,0.8153846153846154,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CSD:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1}"
+2919,AF3-Single-Seq,7UQ3_O2U,0.10000000000000003,0.96,"{'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2920,AF3-Single-Seq,7DKT_GLF,0.23529411764705888,0.9058823529411765,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 3, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+2921,AF3-Single-Seq,7CNQ_G8X,,0.0,,
+2922,AF3-Single-Seq,6Z1C_7EY,0.18181818181818182,0.9272727272727272,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 2}"
+2923,AF3-Single-Seq,7M3H_YPV,0.3157894736842105,0.8736842105263158,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1}"
+2924,AF3-Single-Seq,7D6O_MTE,,0.0,,
+2925,AF3-Single-Seq,7N4W_P4V,0.27272727272727276,0.8909090909090909,"{'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2926,AF3-Single-Seq,6Z2C_Q5E,0.14999999999999997,0.9400000000000001,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2927,AF3-Single-Seq,7CIJ_G0C,0.4545454545454544,0.8181818181818182,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 5, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2}"
+2928,AF3-Single-Seq,7USH_82V,0.7692307692307693,0.6923076923076923,"{'UNL:ARG:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}"
+2929,AF3-Single-Seq,7XG5_PLP,0.20000000000000007,0.9199999999999999,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}"
+2930,AF3-Single-Seq,7PT3_3KK,0.5172413793103449,0.7931034482758621,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2931,AF3-Single-Seq,7KB1_WBJ,0.07142857142857151,0.9714285714285714,"{'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+2932,AF3-Single-Seq,7WUX_6OI,,0.0,,
+2933,AF3-Single-Seq,7OZ9_NGK,0.5,0.8,"{'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1}"
+2934,AF3-Single-Seq,7N03_ZRP,0.34782608695652173,0.8608695652173913,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2935,AF3-Single-Seq,7BMI_U4B,0.368421052631579,0.8526315789473684,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 4, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2936,AF3-Single-Seq,7RZL_NPO,0.18181818181818177,0.9272727272727272,"{'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2937,AF3-Single-Seq,7QHL_D5P,0.36363636363636376,0.8545454545454545,"{'UNL:ARG:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2938,AF3-Single-Seq,7N7B_T3F,0.21428571428571425,0.9142857142857143,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+2939,AF3-Single-Seq,7Q5I_I0F,0.26086956521739135,0.8956521739130434,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}"
+2940,AF3-Single-Seq,7BKA_4JC,0.38888888888888895,0.8444444444444444,"{'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2941,AF3-Single-Seq,7NXO_UU8,,0.0,,
+2942,AF3-Single-Seq,6XG5_TOP,0.8571428571428571,0.6571428571428571,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1}"
+2943,AF3-Single-Seq,6XBO_5MC,0.6190476190476191,0.7523809523809524,"{'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}"
+2944,AF3-Single-Seq,8DKO_TFB,1.125,0.55,{'UNL:PRO:VdWContact': 1},"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+2945,AF3-Single-Seq,7LJN_GTP,0.5,0.8,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+2946,AF3-Single-Seq,7MOI_HPS,0.4285714285714286,0.8285714285714285,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 1}"
+2947,AF3-Single-Seq,8G6P_API,0.8,0.6799999999999999,"{'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1}"
+2948,AF3-Single-Seq,7ULC_56B,0.6363636363636364,0.7454545454545455,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+2949,AF3-Single-Seq,7RC3_SAH,0.5217391304347827,0.7913043478260869,"{'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+2950,AF3-Single-Seq,7SFO_98L,0.7391304347826086,0.7043478260869566,"{'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1}"
+2951,AF3-Single-Seq,8DP2_UMA,0.32000000000000006,0.872,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}"
+2952,AF3-Single-Seq,7ZZW_KKW,,0.0,,
+2953,AF3-Single-Seq,7XFA_D9J,0.4583333333333334,0.8166666666666667,"{'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}"
+2954,AF3-Single-Seq,7NP6_UK8,0.5714285714285714,0.7714285714285715,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2955,AF3-Single-Seq,7F5D_EUO,0.3333333333333333,0.8666666666666667,"{'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+2956,AF3-Single-Seq,6TW7_NZB,0.588235294117647,0.7647058823529412,"{'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 4, 'UNL:TYR:VdWContact': 4, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+2957,AF3-Single-Seq,7FHA_ADX,0.29166666666666663,0.8833333333333333,"{'UNL:ALA:VdWContact': 2, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 1}"
+2958,AF3-Single-Seq,7ES1_UDP,0.10344827586206895,0.9586206896551724,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2959,AF3-Single-Seq,7OEO_V9Z,0.5263157894736843,0.7894736842105263,"{'UNL:ALA:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}"
+2960,AF3-Single-Seq,7DUA_HJ0,0.4,0.84,"{'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2961,AF3-Single-Seq,7BCP_GCO,0.15789473684210525,0.9368421052631579,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1}"
+2962,AF3-Single-Seq,7P2I_MFU,0.16666666666666663,0.9333333333333333,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2}"
+2963,AF3-Single-Seq,7WDT_NGS,0.4736842105263158,0.8105263157894737,"{'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+2964,AF3-Single-Seq,8AEM_LVF,0.25,0.9,"{'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:MET:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2965,AF3-Single-Seq,7WY1_D0L,0.9090909090909091,0.6363636363636364,"{'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 4, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2966,AF3-Single-Seq,7KRU_ATP,0.2608695652173914,0.8956521739130434,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 5, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 4, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 6, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2}"
+2967,AF3-Single-Seq,7P4C_5OV,0.3157894736842105,0.8736842105263158,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:VdWContact': 2}"
+2968,AF3-Single-Seq,7MWN_WI5,0.17391304347826086,0.9304347826086956,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+2969,AF3-Single-Seq,7ZHP_IQY,0.25000000000000006,0.9,"{'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2970,AF3-Single-Seq,7W05_GMP,0.3636363636363636,0.8545454545454545,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+2971,AF3-Single-Seq,7UJF_R3V,0.17391304347826098,0.9304347826086956,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+2972,AF3-Single-Seq,7LOE_Y84,0.3571428571428571,0.8571428571428572,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3}"
+2973,AF3-Single-Seq,8AIE_M7L,0.5555555555555557,0.7777777777777777,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 3, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+2974,AF3-Single-Seq,7JY3_VUD,0.06666666666666665,0.9733333333333334,"{'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+2975,AF3-Single-Seq,6XM9_V55,0.3125,0.875,"{'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:HIS:VdWContact': 4, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+2976,AF3-Single-Seq,7POM_7VZ,0.20000000000000012,0.9199999999999999,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:HIS:HBDonor': 2, 'UNL:HIS:VdWContact': 4, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2977,AF3-Single-Seq,7M31_TDR,,0.0,,
+2978,AF3-Single-Seq,8EYE_X4I,0.44444444444444464,0.8222222222222222,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 5, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2979,AF3-Single-Seq,6YRV_PJ8,0.041666666666666685,0.9833333333333333,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 3, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2980,AF3-Single-Seq,7LZD_YHY,0.13043478260869557,0.9478260869565218,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:Hydrophobic': 4, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+2981,AF3-Single-Seq,7EPV_FDA,0.21428571428571422,0.9142857142857144,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 5, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}"
+2982,AF3-Single-Seq,7UY4_SMI,0.16666666666666669,0.9333333333333333,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+2983,AF3-Single-Seq,7N4N_0BK,0.23076923076923078,0.9076923076923077,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+2984,AF3-Single-Seq,7UMW_NAD,0.3448275862068966,0.8620689655172413,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 4, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBAcceptor': 2, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+2985,AF3-Single-Seq,7U3J_L6U,0.4074074074074075,0.837037037037037,"{'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 3}"
+2986,AF3-Single-Seq,6Z14_Q4Z,0.17647058823529416,0.9294117647058824,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+2987,AF3-Single-Seq,6ZK5_IMH,0.6818181818181818,0.7272727272727273,"{'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2988,AF3-Single-Seq,7QGP_DJ8,0.13793103448275862,0.9448275862068966,"{'UNL:ALA:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+2989,AF3-Single-Seq,7L5F_XNG,0.8999999999999999,0.64,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2990,AF3-Single-Seq,7FT9_4MB,0.7272727272727274,0.709090909090909,"{'UNL:ARG:VdWContact': 1, 'UNL:HIS:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+2991,AF3-Single-Seq,7OP9_06K,,0.0,,
+2992,AF3-Single-Seq,7JXX_VP7,0.52,0.792,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2993,AF3-Single-Seq,7CL8_TES,0.3333333333333333,0.8666666666666667,"{'UNL:ALA:Hydrophobic': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+2994,AF3-Single-Seq,7TM6_GPJ,1.2307692307692308,0.5076923076923077,{'UNL:PRO:VdWContact': 1},"{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 2}"
+2995,AF3-Single-Seq,7WQQ_5Z6,0.3500000000000001,0.86,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 5, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2}","{'UNL:ARG:Hydrophobic': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 4, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+2996,AF3-Single-Seq,7WL4_JFU,0.7777777777777777,0.6888888888888889,"{'UNL:LEU:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+2997,AF3-Single-Seq,7SCW_GSP,0.25925925925925936,0.8962962962962963,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 4, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+2998,AF3-Single-Seq,7L7C_XQ1,0.42857142857142855,0.8285714285714285,"{'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:GLN:Hydrophobic': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PRO:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}"
+2999,AF3-Single-Seq,7PUV_84Z,0.19047619047619058,0.9238095238095237,"{'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+3000,AF3-Single-Seq,7KQU_YOF,0.5238095238095237,0.7904761904761906,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+3001,AF3-Single-Seq,7Z2O_IAJ,0.21052631578947367,0.9157894736842105,"{'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}"
+3002,AF3-Single-Seq,7PRM_81I,0.4782608695652173,0.808695652173913,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+3003,AF3-Single-Seq,8FLV_ZB9,0.40740740740740733,0.837037037037037,"{'UNL:ALA:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+3004,AF3-Single-Seq,7NLV_UJE,1.0526315789473684,0.5789473684210527,"{'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 2, 'UNL:SER:VdWContact': 4, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+3005,AF3-Single-Seq,7T0D_FPP,,0.0,,
+3006,AF3-Single-Seq,7MWU_ZPM,0.33333333333333337,0.8666666666666667,"{'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+3007,AF3-Single-Seq,7L00_XCJ,0.1111111111111111,0.9555555555555556,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+3008,AF3-Single-Seq,8C5M_MTA,0.9333333333333333,0.6266666666666667,"{'UNL:GLY:VdWContact': 1, 'UNL:MET:VdWContact': 2}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+3009,AF3-Single-Seq,7Z7F_IF3,0.3333333333333334,0.8666666666666667,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+3010,AF3-Single-Seq,7TSF_H4B,0.24999999999999994,0.9,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}"
+3011,AF3-Single-Seq,7TUO_KL9,0.4545454545454545,0.8181818181818182,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+3012,AF3-Single-Seq,7ED2_A3P,0.8333333333333333,0.6666666666666667,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+3013,AF3-Single-Seq,7ZL5_IWE,0.5263157894736843,0.7894736842105263,"{'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 6, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1}"
+3014,AF3-Single-Seq,8F8E_XJI,0.3636363636363637,0.8545454545454545,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+3015,AF3-Single-Seq,7OZC_G6S,0.3529411764705883,0.8588235294117647,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 4, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:HIS:VdWContact': 3, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+3016,AF3-Single-Seq,7Q2B_M6H,0.13333333333333336,0.9466666666666667,"{'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+3017,AF3-Single-Seq,6VTA_AKN,0.42857142857142855,0.8285714285714285,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1}"
+3018,AF3-Single-Seq,7V3N_AKG,0.2857142857142857,0.8857142857142857,"{'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+3019,AF3-Single-Seq,8F4J_PHO,,0.0,,
+3020,AF3-Single-Seq,7ZOC_T8E,0.16666666666666669,0.9333333333333333,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 4, 'UNL:HIS:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+3021,AF3-Single-Seq,7WCF_ACP,0.24137931034482757,0.903448275862069,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 3, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+3022,AF3-Single-Seq,7NUT_GLP,0.4736842105263159,0.8105263157894737,"{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1}"
+3023,AF3-Single-Seq,7E4L_MDN,1.1,0.5599999999999999,"{'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 5}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+3024,AF3-Single-Seq,7TS6_KMI,0.4166666666666667,0.8333333333333333,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+3025,AF3-Single-Seq,7NF3_4LU,0.3243243243243243,0.8702702702702703,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+3026,AF3-Single-Seq,8D5D_5DK,0.1481481481481482,0.9407407407407408,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+3027,AF3-Single-Seq,7JMV_4NC,0.55,0.78,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+3028,AF3-Single-Seq,7A9E_R4W,0.1875,0.925,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+3029,AF3-Single-Seq,7TBU_S3P,0.5,0.8,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:SER:HBAcceptor': 3, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1}"
+3030,AF3-Single-Seq,7TB0_UD1,0.40740740740740755,0.837037037037037,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 2}"
+3031,AF3-Single-Seq,7MFP_Z7P,0.6206896551724137,0.7517241379310345,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:HBDonor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 5, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:Hydrophobic': 3, 'UNL:THR:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}"
+3032,AF3-Single-Seq,6M2B_EZO,0.16666666666666657,0.9333333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+3033,AF3-Single-Seq,7NPL_UKZ,0.4482758620689655,0.8206896551724138,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 5, 'UNL:PHE:VdWContact': 6, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+3034,AF3-Single-Seq,7KZ9_XN7,0.8333333333333335,0.6666666666666666,"{'UNL:GLN:VdWContact': 1, 'UNL:LYS:VdWContact': 1}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+3035,AF3-Single-Seq,7QE4_NGA,,0.0,,
+3036,AF3-Single-Seq,8AP0_PRP,0.11111111111111116,0.9555555555555555,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+3037,AF3-Single-Seq,7V3S_5I9,0.17241379310344823,0.9310344827586207,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 3, 'UNL:PHE:Hydrophobic': 3, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3}"
+3038,AF3-Single-Seq,7C0U_FGO,0.1428571428571428,0.9428571428571428,"{'UNL:ALA:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 4}"
+3039,AF3-Single-Seq,7UXS_OJC,0.2916666666666667,0.8833333333333333,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1}"
+3040,AF3-Single-Seq,7X9K_8OG,0.17857142857142855,0.9285714285714286,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+3041,AF3-Single-Seq,8BOM_QU6,0.25,0.9,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+3042,AF3-Single-Seq,8BTI_RFO,0.09999999999999992,0.9600000000000001,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+3043,AF3-Single-Seq,7RWS_4UR,0.5714285714285713,0.7714285714285715,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+3044,AF3-Single-Seq,6YQV_8K2,0.3333333333333334,0.8666666666666667,"{'UNL:ARG:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+3045,AF3-Single-Seq,7PK0_BYC,0.18421052631578955,0.9263157894736842,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+3046,AF3-Single-Seq,5SIS_JSM,0.4285714285714285,0.8285714285714286,"{'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+3047,AF3-Single-Seq,7NSW_HC4,0.9,0.64,"{'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+3048,AF3-Single-Seq,7F8T_FAD,0.5,0.8,"{'UNL:ARG:VdWContact': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 4, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+3049,AF3-Single-Seq,5SD5_HWI,0.17391304347826098,0.9304347826086956,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 4}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+3050,AF3-Single-Seq,7CUO_PHB,0.29411764705882354,0.8823529411764706,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+3051,AF3-Single-Seq,7R3D_APR,0.3333333333333332,0.8666666666666667,"{'UNL:ALA:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 4, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 4}"
+3052,AF3-Single-Seq,7WJB_BGC,0.6363636363636362,0.7454545454545455,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+3053,AF3-Single-Seq,7A1P_QW2,0.28,0.888,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+3054,AF3-Single-Seq,6ZPB_3D1,0.5238095238095238,0.7904761904761904,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+3055,AF3-Single-Seq,7UTW_NAI,0.2962962962962963,0.8814814814814815,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 3}"
+3056,AF3-Single-Seq,7WUY_76N,0.9473684210526316,0.6210526315789473,"{'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+3057,AF3-Single-Seq,8A2D_KXY,0.2903225806451613,0.8838709677419355,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 3, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3}"
+3058,AF3-Single-Seq,7NR8_UOE,,0.0,,
+3059,AF3-Single-Seq,7KC5_BJZ,0.4000000000000001,0.84,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+3060,AF3-Single-Seq,7QPP_VDX,0.44444444444444453,0.8222222222222222,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+3061,AF3-Single-Seq,7VKZ_NOJ,0.3333333333333333,0.8666666666666667,"{'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 2}"
+3062,AF3-Single-Seq,7F51_BA7,0.05882352941176472,0.9764705882352941,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 2}"
+3063,AF3-Single-Seq,7PL1_SFG,0.15384615384615385,0.9384615384615385,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+3064,AF3-Single-Seq,7VB8_STL,,0.0,,
+3065,AF3-Single-Seq,8FAV_4Y5,0.7499999999999999,0.7000000000000001,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 3, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+3066,AF3-Single-Seq,7CD9_FVR,0.26086956521739135,0.8956521739130434,"{'UNL:GLN:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3}"
+3067,AF3-Single-Seq,7N7H_CTP,1.0,0.6,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 3, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 4, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+3068,AF3-Single-Seq,7ODY_DGI,0.9523809523809523,0.6190476190476191,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2}"
+3069,AF3-Single-Seq,8CSD_C5P,0.2727272727272728,0.8909090909090909,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 2, 'UNL:SER:VdWContact': 3, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 2, 'UNL:SER:VdWContact': 3, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+3070,AF3-Single-Seq,7OFK_VCH,0.4,0.84,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+3071,AF3-Single-Seq,7SDD_4IP,0.33333333333333337,0.8666666666666667,"{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 2, 'UNL:ARG:VdWContact': 5, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+3072,AF3-Single-Seq,7OPG_06N,0.8,0.6799999999999999,"{'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3}"
+3073,AF3-Single-Seq,7ZTL_BCN,0.09999999999999998,0.96,"{'UNL:ASN:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+3074,AF3-Single-Seq,7SIU_9ID,0.39130434782608703,0.8434782608695652,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 4, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+3075,AF3-Single-Seq,7LCU_XTA,0.3333333333333334,0.8666666666666667,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+3076,AF3-Single-Seq,7NGW_UAW,0.125,0.95,"{'UNL:ALA:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+3077,AF3-Single-Seq,7VYJ_CA0,0.888888888888889,0.6444444444444444,"{'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+3078,AF3-Single-Seq,7QHG_T3B,0.9285714285714286,0.6285714285714286,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+3079,AF3-Single-Seq,8HO0_3ZI,0.1578947368421053,0.9368421052631579,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}","{'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+3080,AF3,8AAU_LH0,0.411764705882353,0.8352941176470587,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+3081,AF3,7JHQ_VAJ,0.2666666666666666,0.8933333333333333,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+3082,AF3,6ZCY_QF8,0.10000000000000005,0.96,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+3083,AF3,7UAW_MF6,0.4705882352941177,0.8117647058823529,"{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+3084,AF3,6YMS_OZH,0.09523809523809518,0.9619047619047619,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+3085,AF3,7UJ5_DGL,0.09523809523809523,0.9619047619047619,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+3086,AF3,8EX2_Q2Q,,0.0,,
+3087,AF3,7R9N_F97,0.4375,0.825,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}"
+3088,AF3,7UYB_OK0,0.1333333333333333,0.9466666666666667,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
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+3095,AF3,8C3N_ADP,0.3125,0.875,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
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+3101,AF3,7LMO_NYO,0.6190476190476192,0.7523809523809524,"{'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 4, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+3102,AF3,7VBU_6I4,0.21428571428571425,0.9142857142857143,"{'UNL:ALA:Hydrophobic': 3, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+3103,AF3,7TXK_LW8,0.1333333333333333,0.9466666666666667,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
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+3105,AF3,7R59_I5F,0.0,1.0,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
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+3108,AF3,7BNH_BEZ,0.5,0.8,"{'UNL:ILE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+3109,AF3,6WTN_RXT,0.23529411764705885,0.9058823529411765,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+3110,AF3,7QFM_AY3,0.0,1.0,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+3111,AF3,7MSR_DCA,0.13043478260869557,0.9478260869565218,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 3, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 3, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+3112,AF3,5SAK_ZRY,,0.0,,
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+3114,AF3,7RSV_7IQ,0.16666666666666674,0.9333333333333333,"{'UNL:GLN:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1}"
+3115,AF3,8DSC_NCA,0.4285714285714285,0.8285714285714286,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1}"
+3116,AF3,7AKL_RK5,0.0625,0.975,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3}"
+3117,AF3,7XBV_APC,0.05555555555555547,0.9777777777777779,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+3118,AF3,7CNS_PMV,0.22222222222222227,0.9111111111111111,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 2, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 3}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+3119,AF3,7ZDY_6MJ,0.49999999999999994,0.8,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 3}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+3120,AF3,6Z4N_Q7B,0.125,0.95,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2}"
+3121,AF3,7NFB_GEN,0.07142857142857142,0.9714285714285714,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1}"
+3122,AF3,7R7R_AWJ,0.17647058823529416,0.9294117647058824,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+3123,AF3,7V14_ORU,0.1875,0.925,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+3124,AF3,6YR2_T1C,0.3157894736842105,0.8736842105263158,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+3125,AF3,7JG0_GAR,0.07692307692307693,0.9692307692307692,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:V:VdWContact': 1}"
+3126,AF3,7EBG_J0L,0.18181818181818188,0.9272727272727272,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+3127,AF3,8AY3_OE3,0.23529411764705876,0.9058823529411765,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+3128,AF3,7M6K_YRJ,0.16666666666666674,0.9333333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
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+3130,AF3,7Q27_8KC,0.2777777777777777,0.888888888888889,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 3, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+3131,AF3,8DHG_T78,0.14285714285714285,0.9428571428571428,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 5, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
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+3133,AF3,7FB7_8NF,0.08333333333333337,0.9666666666666667,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1}"
+3134,AF3,7THI_PGA,0.23076923076923078,0.9076923076923077,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+3135,AF3,6ZAE_ACV,0.0,1.0,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+3136,AF3,7MGY_ZD1,0.11764705882352944,0.9529411764705882,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+3137,AF3,7XPO_UPG,0.1578947368421053,0.9368421052631579,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
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+3139,AF3,7BJJ_TVW,0.125,0.95,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+3140,AF3,7K0V_VQP,0.0769230769230769,0.9692307692307692,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+3141,AF3,7TE8_P0T,0.4761904761904762,0.8095238095238095,"{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 5, 'UNL:PHE:VdWContact': 3, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+3142,AF3,7QF4_RBF,0.2499999999999999,0.9,"{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 4, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}"
+3143,AF3,7UJ4_OQ4,0.1578947368421052,0.9368421052631579,"{'UNL:ALA:Hydrophobic': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+3144,AF3,7A9H_TPP,0.0,1.0,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+3145,AF3,7LEV_0JO,0.10000000000000005,0.96,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 5, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 4, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 2}"
+3146,AF3,7N6F_0I1,0.05263157894736836,0.9789473684210527,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+3147,AF3,8EAB_VN2,0.736842105263158,0.7052631578947368,"{'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:HBAcceptor': 2, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+3148,AF3,6ZC3_JOR,0.3333333333333333,0.8666666666666667,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+3149,AF3,7Q25_8J9,,0.0,,
+3150,AF3,7C3U_AZG,0.33333333333333337,0.8666666666666667,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 3, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2}"
+3151,AF3,7ROR_69X,0.06666666666666665,0.9733333333333334,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
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+3153,AF3,7TH4_FFO,0.0625,0.975,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+3154,AF3,8D39_QDB,0.08333333333333337,0.9666666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+3155,AF3,7YZU_DO7,0.16666666666666669,0.9333333333333333,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 2}"
+3156,AF3,5SB2_1K2,0.08333333333333341,0.9666666666666667,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
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+3158,AF3,8B8H_OJQ,0.18518518518518517,0.9259259259259259,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}"
+3159,AF3,7TOM_5AD,0.13636363636363644,0.9454545454545454,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+3160,AF3,7VWF_K55,0.2500000000000001,0.8999999999999999,"{'UNL:ARG:Hydrophobic': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 1}"
+3161,AF3,7XI7_4RI,0.25000000000000006,0.9,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+3162,AF3,7AN5_RDH,0.3913043478260869,0.8434782608695652,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+3163,AF3,7B2C_TP7,,0.0,,
+3164,AF3,7B94_ANP,0.20000000000000007,0.9199999999999999,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+3165,AF3,7NF0_BYN,0.09677419354838707,0.9612903225806452,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1}"
+3166,AF3,7WKL_CAQ,0.07142857142857142,0.9714285714285714,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+3167,AF3,7WPW_F15,0.0625,0.975,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+3168,AF3,8SLG_G5A,0.5,0.8,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 4, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 3, 'UNL:GLU:VdWContact': 5, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+3169,AF3,7RNI_60I,,0.0,,
+3170,AF3,7SZA_DUI,0.22222222222222213,0.9111111111111112,"{'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+3171,AF3,7PIH_7QW,0.21052631578947362,0.9157894736842106,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+3172,AF3,7T3E_SLB,0.3333333333333333,0.8666666666666667,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2}"
+3173,AF3,7FRX_O88,,0.0,,
+3174,AF3,8CNH_V6U,0.3333333333333333,0.8666666666666667,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+3175,AF3,7C8Q_DSG,,0.0,,
+3176,AF3,7ZF0_DHR,0.3,0.88,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3}","{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 3}"
+3177,AF3,8G0V_YHT,0.21052631578947362,0.9157894736842106,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+3178,AF3,7P5T_5YG,0.4166666666666667,0.8333333333333333,"{'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+3179,AF3,7NU0_DCL,0.18181818181818174,0.9272727272727272,"{'UNL:ASP:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+3180,AF3,6Z0R_Q4H,0.0,1.0,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1}","{'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1}"
+3181,AF3,7XRL_FWK,0.21428571428571433,0.9142857142857143,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 4, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+3182,AF3,7LOU_IFM,0.1,0.96,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:UDP:VdWContact': 1}"
+3183,AF3,7ROU_66I,0.033333333333333326,0.9866666666666667,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+3184,AF3,6XCT_478,0.22222222222222213,0.9111111111111112,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 5, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 5, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+3185,AF3,7LT0_ONJ,0.15789473684210537,0.9368421052631578,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}"
+3186,AF3,7OLI_8HG,0.11764705882352942,0.9529411764705882,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2}"
+3187,AF3,7Z1Q_NIO,0.2222222222222222,0.9111111111111111,"{'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+3188,AF3,6YQW_82I,0.19999999999999998,0.92,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+3189,AF3,6T88_MWQ,0.3333333333333333,0.8666666666666667,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+3190,AF3,7PRI_7TI,0.13333333333333336,0.9466666666666667,"{'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:VdWContact': 1}"
+3191,AF3,7OFF_VCB,0.25,0.9,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+3192,AF3,7DQL_4CL,0.16666666666666657,0.9333333333333333,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 3}"
+3193,AF3,7O1T_5X8,0.10000000000000005,0.96,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:CYS:Hydrophobic': 2, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
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+3195,AF3,7ZXV_45D,0.357142857142857,0.8571428571428572,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 3, 'UNL:THR:Hydrophobic': 2, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL::Hydrophobic': 1, 'UNL::VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 5, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+3196,AF3,7X5N_5M5,0.1111111111111111,0.9555555555555556,"{'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+3197,AF3,7VQ9_ISY,0.0,1.0,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+3198,AF3,7PJQ_OWH,0.09999999999999998,0.96,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+3199,AF3,8AQL_PLG,0.2631578947368421,0.8947368421052632,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 4, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 4, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+3200,AF3,7VC5_9SF,0.4705882352941176,0.8117647058823529,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+3201,AF3,7AFX_R9K,0.42857142857142855,0.8285714285714285,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1}"
+3202,AF3,7RKW_5TV,0.4166666666666667,0.8333333333333333,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+3203,AF3,7TYP_KUR,0.3333333333333333,0.8666666666666667,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 6, 'UNL:PHE:VdWContact': 4, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 2, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+3204,AF3,7L03_F9F,0.05555555555555555,0.9777777777777777,"{'UNL:ALA:Hydrophobic': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+3205,AF3,7P1F_KFN,0.25,0.9,"{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+3206,AF3,7O0N_CDP,0.09523809523809529,0.9619047619047619,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 5, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 5, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+3207,AF3,7MYU_ZR7,0.26086956521739124,0.8956521739130435,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+3208,AF3,6YSP_PAL,0.11764705882352942,0.9529411764705882,"{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 4, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 3, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 4, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2}"
+3209,AF3,7XJN_NSD,0.16666666666666663,0.9333333333333333,"{'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+3210,AF3,7R6J_2I7,1.1428571428571428,0.5428571428571429,"{'UNL:ARG:VdWContact': 1, 'UNL:LIG:VdWContact': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 2, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+3211,AF3,8HFN_XGC,0.21739130434782605,0.9130434782608696,"{'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+3212,AF3,7BTT_F8R,0.3333333333333333,0.8666666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+3213,AF3,7MY1_IPE,0.1,0.96,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+3214,AF3,8FO5_Y4U,0.9,0.64,"{'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 2, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3}","{'UNL:GLN:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2}"
+3215,AF3,8AUH_L9I,0.3076923076923077,0.8769230769230769,"{'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:CYS:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+3216,AF3,7ECR_SIN,0.75,0.7,"{'UNL:GLN:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+3217,AF3,6TW5_9M2,0.07142857142857151,0.9714285714285714,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+3218,AF3,7ELT_TYM,0.18518518518518517,0.9259259259259259,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 3}"
+3219,AF3,7D5C_GV6,0.0869565217391304,0.9652173913043478,"{'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+3220,AF3,7W06_ITN,0.2857142857142857,0.8857142857142857,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 2}"
+3221,AF3,6YJA_2BA,0.0,1.0,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+3222,AF3,7P1M_4IU,0.0,1.0,"{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+3223,AF3,7PGX_FMN,0.2380952380952382,0.9047619047619048,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 4, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}"
+3224,AF3,7UAS_MBU,0.33333333333333337,0.8666666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ASP:Hydrophobic': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+3225,AF3,8GFD_ZHR,0.06666666666666665,0.9733333333333334,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+3226,AF3,7CTM_BDP,0.08333333333333333,0.9666666666666667,"{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CSD:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1}"
+3227,AF3,7UQ3_O2U,0.125,0.95,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+3228,AF3,7DKT_GLF,0.2727272727272727,0.8909090909090909,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+3229,AF3,7CNQ_G8X,,0.0,,
+3230,AF3,6Z1C_7EY,0.06666666666666676,0.9733333333333333,"{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 2}","{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 2}"
+3231,AF3,7M3H_YPV,0.3571428571428572,0.8571428571428571,"{'UNL:ALA:Hydrophobic': 4, 'UNL:ALA:VdWContact': 4, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1}"
+3232,AF3,7D6O_MTE,,0.0,,
+3233,AF3,7N4W_P4V,0.0625,0.975,"{'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+3234,AF3,6Z2C_Q5E,0.20000000000000007,0.9199999999999999,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+3235,AF3,7CIJ_G0C,0.3157894736842105,0.8736842105263158,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2}"
+3236,AF3,7USH_82V,0.08333333333333333,0.9666666666666667,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}"
+3237,AF3,7XG5_PLP,0.06666666666666667,0.9733333333333334,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}"
+3238,AF3,7PT3_3KK,0.2272727272727273,0.9090909090909091,"{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+3239,AF3,7KB1_WBJ,0.15000000000000002,0.94,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+3240,AF3,7WUX_6OI,,0.0,,
+3241,AF3,7OZ9_NGK,0.0,1.0,"{'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1}"
+3242,AF3,7N03_ZRP,0.3529411764705883,0.8588235294117647,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+3243,AF3,7BMI_U4B,0.15384615384615385,0.9384615384615385,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+3244,AF3,7RZL_NPO,0.10000000000000003,0.96,"{'UNL:GLY:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+3245,AF3,7QHL_D5P,0.21052631578947367,0.9157894736842105,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+3246,AF3,7N7B_T3F,0.1,0.96,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+3247,AF3,7Q5I_I0F,0.0,1.0,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}"
+3248,AF3,7BKA_4JC,0.1875,0.925,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+3249,AF3,7NXO_UU8,0.1818181818181818,0.9272727272727272,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+3250,AF3,6XG5_TOP,0.0,1.0,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1}"
+3251,AF3,6XBO_5MC,0.058823529411764705,0.9764705882352941,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}"
+3252,AF3,8DKO_TFB,0.125,0.95,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+3253,AF3,7LJN_GTP,0.23529411764705876,0.9058823529411765,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+3254,AF3,7MOI_HPS,0.27272727272727276,0.8909090909090909,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 2, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 1}"
+3255,AF3,8G6P_API,0.07142857142857142,0.9714285714285714,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1}"
+3256,AF3,7ULC_56B,0.2500000000000001,0.8999999999999999,"{'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+3257,AF3,7RC3_SAH,0.1904761904761904,0.9238095238095239,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+3258,AF3,7SFO_98L,0.23529411764705888,0.9058823529411765,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1}"
+3259,AF3,8DP2_UMA,0.12000000000000004,0.952,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}"
+3260,AF3,7ZZW_KKW,,0.0,,
+3261,AF3,7XFA_D9J,0.24999999999999992,0.9,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}"
+3262,AF3,7NP6_UK8,0.25,0.9,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+3263,AF3,7F5D_EUO,0.2857142857142857,0.8857142857142857,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+3264,AF3,6TW7_NZB,0.18181818181818185,0.9272727272727272,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+3265,AF3,7FHA_ADX,0.25,0.9,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 1}"
+3266,AF3,7ES1_UDP,0.10526315789473689,0.9578947368421052,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+3267,AF3,7OEO_V9Z,0.16666666666666666,0.9333333333333333,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}"
+3268,AF3,7DUA_HJ0,0.2631578947368421,0.8947368421052632,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+3269,AF3,7BCP_GCO,0.07692307692307693,0.9692307692307692,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1}"
+3270,AF3,7P2I_MFU,0.09090909090909094,0.9636363636363636,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2}"
+3271,AF3,7WDT_NGS,0.19999999999999998,0.92,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 4, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+3272,AF3,8AEM_LVF,0.5333333333333334,0.7866666666666666,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:MET:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+3273,AF3,7WY1_D0L,0.0869565217391304,0.9652173913043478,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 4, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 4, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+3274,AF3,7KRU_ATP,0.33333333333333326,0.8666666666666667,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 6, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 6, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2}"
+3275,AF3,7P4C_5OV,0.09090909090909094,0.9636363636363636,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:VdWContact': 2}"
+3276,AF3,7MWN_WI5,0.09999999999999995,0.96,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 3}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+3277,AF3,7ZHP_IQY,0.17391304347826084,0.9304347826086956,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+3278,AF3,7W05_GMP,0.07692307692307693,0.9692307692307692,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+3279,AF3,7UJF_R3V,0.23809523809523808,0.9047619047619048,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+3280,AF3,7LOE_Y84,0.0,1.0,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3}"
+3281,AF3,8AIE_M7L,0.3125,0.875,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 3, 'UNL:THR:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 3, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+3282,AF3,7JY3_VUD,0.2666666666666668,0.8933333333333333,"{'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+3283,AF3,6XM9_V55,0.125,0.95,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+3284,AF3,7POM_7VZ,0.14285714285714282,0.9428571428571428,"{'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:HIS:HBDonor': 2, 'UNL:HIS:VdWContact': 4, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+3285,AF3,7M31_TDR,,0.0,,
+3286,AF3,8EYE_X4I,0.14285714285714285,0.9428571428571428,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 5, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 5, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+3287,AF3,6YRV_PJ8,0.2727272727272729,0.8909090909090909,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 3, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+3288,AF3,7LZD_YHY,0.21428571428571444,0.9142857142857143,"{'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:Hydrophobic': 4, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:Hydrophobic': 4, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+3289,AF3,7EPV_FDA,0.04166666666666663,0.9833333333333334,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}"
+3290,AF3,7UY4_SMI,0.5384615384615384,0.7846153846153846,"{'UNL:ASN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+3291,AF3,7N4N_0BK,0.25,0.9,"{'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+3292,AF3,7UMW_NAD,0.08333333333333329,0.9666666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBAcceptor': 2, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBAcceptor': 2, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+3293,AF3,7U3J_L6U,0.28,0.888,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 3}"
+3294,AF3,6Z14_Q4Z,0.24999999999999992,0.9,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+3295,AF3,6ZK5_IMH,0.11111111111111102,0.9555555555555556,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:HBDonor': 2, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+3296,AF3,7QGP_DJ8,0.0,1.0,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+3297,AF3,7L5F_XNG,0.2777777777777778,0.8888888888888888,"{'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+3298,AF3,7FT9_4MB,0.28571428571428564,0.8857142857142858,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
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+3300,AF3,7JXX_VP7,0.0,1.0,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+3301,AF3,7CL8_TES,0.23076923076923078,0.9076923076923077,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+3302,AF3,7TM6_GPJ,0.13333333333333336,0.9466666666666667,"{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 2}"
+3303,AF3,7WQQ_5Z6,0.411764705882353,0.8352941176470587,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:Hydrophobic': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 4, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+3304,AF3,7WL4_JFU,0.04999999999999999,0.98,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+3305,AF3,7SCW_GSP,0.2962962962962963,0.8814814814814815,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 4, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 4, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+3306,AF3,7L7C_XQ1,0.16666666666666669,0.9333333333333333,"{'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:GLN:Hydrophobic': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PRO:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}"
+3307,AF3,7PUV_84Z,0.19999999999999998,0.92,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+3308,AF3,7KQU_YOF,0.29411764705882354,0.8823529411764706,"{'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+3309,AF3,7Z2O_IAJ,0.2727272727272727,0.8909090909090909,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}"
+3310,AF3,7PRM_81I,0.26086956521739135,0.8956521739130434,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 2, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+3311,AF3,8FLV_ZB9,0.04761904761904756,0.980952380952381,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+3312,AF3,7NLV_UJE,0.19999999999999996,0.92,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 2, 'UNL:SER:VdWContact': 4, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 2, 'UNL:SER:VdWContact': 4, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+3313,AF3,7T0D_FPP,1.3846153846153846,0.4461538461538461,"{'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 5}"
+3314,AF3,7MWU_ZPM,0.125,0.95,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+3315,AF3,7L00_XCJ,0.09999999999999998,0.96,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+3316,AF3,8C5M_MTA,1.0,0.6,{'UNL:LIG:VdWContact': 1},"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+3317,AF3,7Z7F_IF3,0.06666666666666665,0.9733333333333334,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+3318,AF3,7TSF_H4B,0.1875,0.925,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}"
+3319,AF3,7TUO_KL9,0.30434782608695643,0.8782608695652174,"{'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+3320,AF3,7ED2_A3P,0.15,0.94,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+3321,AF3,7ZL5_IWE,0.3571428571428572,0.8571428571428571,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 4, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1}"
+3322,AF3,8F8E_XJI,0.0,1.0,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
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+3327,AF3,8F4J_PHO,,0.0,,
+3328,AF3,7ZOC_T8E,0.2666666666666666,0.8933333333333333,"{'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 4, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 4, 'UNL:HIS:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
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+3335,AF3,7JMV_4NC,0.04761904761904756,0.980952380952381,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:HBAcceptor': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+3336,AF3,7A9E_R4W,0.9090909090909092,0.6363636363636364,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+3337,AF3,7TBU_S3P,0.2666666666666667,0.8933333333333333,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 4, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1}"
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+3342,AF3,7KZ9_XN7,0.24999999999999994,0.9,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+3343,AF3,7QE4_NGA,,0.0,,
+3344,AF3,8AP0_PRP,0.125,0.95,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
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+3347,AF3,7UXS_OJC,0.29999999999999993,0.88,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1}"
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+3350,AF3,8BTI_RFO,0.17647058823529413,0.9294117647058824,"{'UNL:ALA:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+3351,AF3,7RWS_4UR,0.2,0.92,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 3, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+3352,AF3,6YQV_8K2,0.3333333333333333,0.8666666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+3353,AF3,7PK0_BYC,0.16666666666666663,0.9333333333333333,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+3354,AF3,5SIS_JSM,0.1111111111111111,0.9555555555555556,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
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+3356,AF3,7F8T_FAD,0.18518518518518517,0.9259259259259259,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 4, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 3, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 4, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+3357,AF3,5SD5_HWI,0.2777777777777778,0.8888888888888888,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
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+3359,AF3,7R3D_APR,0.2631578947368421,0.8947368421052632,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3}","{'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 4}"
+3360,AF3,7WJB_BGC,0.2222222222222222,0.9111111111111111,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+3361,AF3,7A1P_QW2,0.20000000000000007,0.9199999999999999,"{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+3362,AF3,6ZPB_3D1,0.1875,0.925,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+3363,AF3,7UTW_NAI,0.1304347826086956,0.9478260869565218,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 4}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 3}"
+3364,AF3,7WUY_76N,1.1111111111111112,0.5555555555555556,{'UNL:MET:VdWContact': 1},"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+3365,AF3,8A2D_KXY,0.18518518518518517,0.9259259259259259,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3}"
+3366,AF3,7NR8_UOE,,0.0,,
+3367,AF3,7KC5_BJZ,0.2857142857142857,0.8857142857142857,"{'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+3368,AF3,7QPP_VDX,0.1666666666666667,0.9333333333333333,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 5, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+3369,AF3,7VKZ_NOJ,0.14285714285714282,0.9428571428571428,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 2}"
+3370,AF3,7F51_BA7,0.22580645161290322,0.9096774193548387,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 2}"
+3371,AF3,7PL1_SFG,0.125,0.95,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+3372,AF3,7VB8_STL,,0.0,,
+3373,AF3,8FAV_4Y5,0.17391304347826078,0.9304347826086957,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 3, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+3374,AF3,7CD9_FVR,0.3529411764705883,0.8588235294117647,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 6, 'UNL:TYR:VdWContact': 5}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3}"
+3375,AF3,7N7H_CTP,0.04347826086956519,0.9826086956521739,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 4, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 3, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 4, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+3376,AF3,7ODY_DGI,0.2727272727272727,0.8909090909090909,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2}"
+3377,AF3,8CSD_C5P,0.46666666666666673,0.8133333333333332,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 2, 'UNL:SER:VdWContact': 3, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+3378,AF3,7OFK_VCH,0.09523809523809512,0.9619047619047619,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+3379,AF3,7SDD_4IP,0.3846153846153847,0.8461538461538461,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBAcceptor': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:VdWContact': 4, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+3380,AF3,7OPG_06N,0.26666666666666666,0.8933333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3}"
+3381,AF3,7ZTL_BCN,0.4285714285714286,0.8285714285714285,"{'UNL:PHE:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1}"
+3382,AF3,7SIU_9ID,0.5217391304347827,0.7913043478260869,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+3383,AF3,7LCU_XTA,0.5555555555555556,0.7777777777777778,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+3384,AF3,7NGW_UAW,0.38888888888888895,0.8444444444444444,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+3385,AF3,7VYJ_CA0,1.0,0.6,"{'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+3386,AF3,7QHG_T3B,0.17241379310344834,0.9310344827586207,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 5, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+3387,AF3,8HO0_3ZI,0.16666666666666657,0.9333333333333333,"{'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
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@@ -0,0 +1,849 @@
+,Category,Target,Structured_EMD,Unstructured_EMD,Method_Histogram,Reference_Histogram
+0,P2Rank-Vina,7UAW_MF6,1.0,0.6153846153846152,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+1,P2Rank-Vina,8D19_GSH,0.75,0.4545454545454545,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+2,P2Rank-Vina,8C3N_ADP,0.22222222222222227,0.06666666666666665,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+3,P2Rank-Vina,7XQZ_FPF,0.5,0.16666666666666674,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+4,P2Rank-Vina,7R59_I5F,0.3333333333333333,0.09999999999999998,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+5,P2Rank-Vina,7XBV_APC,0.8,0.5,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+6,P2Rank-Vina,7ZDY_6MJ,0.0,0.5714285714285714,"{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 3}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+7,P2Rank-Vina,7THI_PGA,0.4999999999999999,0.25,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+8,P2Rank-Vina,7TE8_P0T,0.0,0.3809523809523811,"{'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 3, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+9,P2Rank-Vina,7QF4_RBF,1.25,0.2941176470588236,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}"
+10,P2Rank-Vina,7YZU_DO7,0.0,0.4166666666666667,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 2}"
+11,P2Rank-Vina,8B8H_OJQ,0.11111111111111116,0.09090909090909094,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 4}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}"
+12,P2Rank-Vina,7WKL_CAQ,0.3333333333333333,0.46153846153846145,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 3, 'UNL:ASN:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+13,P2Rank-Vina,7SZA_DUI,0.75,0.06666666666666665,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+14,P2Rank-Vina,7T3E_SLB,0.7142857142857143,0.7000000000000001,"{'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2}"
+15,P2Rank-Vina,8G0V_YHT,0.6666666666666667,0.25,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:GLU:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+16,P2Rank-Vina,8HFN_XGC,0.6666666666666667,0.39999999999999997,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}","{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+17,P2Rank-Vina,7W06_ITN,0.8333333333333334,0.29999999999999993,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 2}"
+18,P2Rank-Vina,8GFD_ZHR,0.3333333333333333,0.19999999999999996,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+19,P2Rank-Vina,7UQ3_O2U,0.5,0.7142857142857143,"{'UNL:GLU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+20,P2Rank-Vina,7XG5_PLP,0.8,0.45454545454545453,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}"
+21,P2Rank-Vina,7WUX_6OI,1.0,0.4545454545454545,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1}"
+22,P2Rank-Vina,7ULC_56B,0.5,0.5263157894736842,"{'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+23,P2Rank-Vina,7SFO_98L,0.3333333333333333,0.6190476190476193,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1}"
+24,P2Rank-Vina,7XFA_D9J,0.0,0.18181818181818177,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}"
+25,P2Rank-Vina,7WDT_NGS,0.0,0.4285714285714286,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+26,P2Rank-Vina,7W05_GMP,0.5,0.4444444444444445,"{'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+27,P2Rank-Vina,7WQQ_5Z6,0.0,0.6428571428571428,"{'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 2, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 4, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 4, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 4, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:Hydrophobic': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 4, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+28,P2Rank-Vina,7WL4_JFU,0.0,0.10526315789473684,"{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+29,P2Rank-Vina,7Z2O_IAJ,0.0,0.2941176470588236,"{'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}"
+30,P2Rank-Vina,7TUO_KL9,0.3333333333333333,0.16666666666666674,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+31,P2Rank-Vina,8F8E_XJI,0.3333333333333333,0.3684210526315789,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+32,P2Rank-Vina,7Q2B_M6H,0.0,0.1818181818181817,"{'UNL:GLU:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+33,P2Rank-Vina,7ZOC_T8E,0.3333333333333333,0.21428571428571425,"{'UNL:ASN:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 4, 'UNL:HIS:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+34,P2Rank-Vina,7WCF_ACP,0.6,0.3157894736842106,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 3, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+35,P2Rank-Vina,7TBU_S3P,0.5999999999999999,0.25,"{'UNL:ARG:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1}"
+36,P2Rank-Vina,8BOM_QU6,0.75,0.33333333333333337,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+37,P2Rank-Vina,5SIS_JSM,0.0,0.28571428571428575,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+38,P2Rank-Vina,7R3D_APR,0.5,0.588235294117647,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 4}"
+39,P2Rank-Vina,7QPP_VDX,0.25,0.41176470588235303,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+40,P2Rank-Vina,7VKZ_NOJ,0.6666666666666667,0.2727272727272726,"{'UNL:ASP:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 2}"
+41,P2Rank-Vina,7SIU_9ID,0.19999999999999996,0.3333333333333333,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+42,DiffDock-L,8AAU_LH0,0.5,0.5294117647058824,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+43,DiffDock-L,7UAW_MF6,0.875,0.5555555555555556,"{'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+44,DiffDock-L,7UJ5_DGL,0.8571428571428572,0.1538461538461538,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+45,DiffDock-L,8EX2_Q2Q,0.0,0.16666666666666669,"{'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+46,DiffDock-L,7UYB_OK0,0.5,0.07692307692307698,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+47,DiffDock-L,7U0U_FK5,0.0,0.22580645161290325,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU-:Hydrophobic': 1, 'UNL:GLU-:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE-:Hydrophobic': 1, 'UNL:PHE-:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:PRO-:Hydrophobic': 1, 'UNL:TRP-:HBAcceptor': 1, 'UNL:TRP-:Hydrophobic': 1, 'UNL:TRP-:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+48,DiffDock-L,8D19_GSH,0.75,0.16666666666666666,"{'UNL:ARG:HBDonor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+49,DiffDock-L,8C3N_ADP,0.4285714285714286,0.44444444444444436,"{'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+50,DiffDock-L,8A1H_DLZ,0.16666666666666666,0.1875,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+51,DiffDock-L,7XQZ_FPF,0.25,0.1666666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+52,DiffDock-L,7R59_I5F,0.5,0.0,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+53,DiffDock-L,7ZCC_OGA,0.5,0.1428571428571429,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+54,DiffDock-L,7QFM_AY3,0.6666666666666667,0.26666666666666666,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+55,DiffDock-L,7QTA_URI,0.6666666666666667,0.3999999999999999,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:VdWContact': 3, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}"
+56,DiffDock-L,7XBV_APC,0.0,0.15384615384615374,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+57,DiffDock-L,7ZDY_6MJ,0.6666666666666666,0.28571428571428575,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 3}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+58,DiffDock-L,7V14_ORU,0.0,0.26666666666666666,"{'UNL:ALA:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+59,DiffDock-L,7Q27_8KC,0.75,0.2666666666666666,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBDonor': 3, 'UNL:HIS:VdWContact': 3, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+60,DiffDock-L,7THI_PGA,1.0,0.6666666666666666,"{'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+61,DiffDock-L,7XPO_UPG,0.0,0.08333333333333337,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 3}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+62,DiffDock-L,7TE8_P0T,0.3333333333333333,0.49999999999999983,"{'UNL:ALA:Hydrophobic': 5, 'UNL:ALA:VdWContact': 3, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+63,DiffDock-L,7QF4_RBF,0.5,0.25,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}"
+64,DiffDock-L,7UJ4_OQ4,0.3333333333333333,0.4090909090909091,"{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 4, 'UNL:TYR:VdWContact': 4}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+65,DiffDock-L,8EAB_VN2,0.6666666666666667,0.75,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:HBAcceptor': 2, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+66,DiffDock-L,7TH4_FFO,0.1428571428571429,0.411764705882353,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 3}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+67,DiffDock-L,7YZU_DO7,0.14285714285714285,0.5000000000000001,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 2}"
+68,DiffDock-L,8B8H_OJQ,0.22222222222222215,0.0625,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 2, 'UNL:TYR:HBDonor': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}"
+69,DiffDock-L,7TOM_5AD,0.39999999999999997,0.19999999999999996,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+70,DiffDock-L,7XI7_4RI,0.0,0.10000000000000009,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+71,DiffDock-L,7WKL_CAQ,0.3333333333333333,0.23076923076923073,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+72,DiffDock-L,7WPW_F15,0.3333333333333333,0.3125,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+73,DiffDock-L,8SLG_G5A,0.25,0.3636363636363637,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 4, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 3, 'UNL:GLU:VdWContact': 5, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+74,DiffDock-L,7SZA_DUI,0.3333333333333333,0.1111111111111111,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+75,DiffDock-L,7T3E_SLB,0.8333333333333333,0.9,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PRO:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2}"
+76,DiffDock-L,8CNH_V6U,0.3333333333333333,0.5333333333333332,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 5, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+77,DiffDock-L,8G0V_YHT,0.2,0.4,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+78,DiffDock-L,7Z1Q_NIO,0.0,0.41666666666666674,"{'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+79,DiffDock-L,7X5N_5M5,0.6666666666666666,0.2142857142857143,"{'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+80,DiffDock-L,7VQ9_ISY,0.5,0.1333333333333333,"{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+81,DiffDock-L,8AQL_PLG,0.16666666666666674,0.2727272727272727,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 4, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 4, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+82,DiffDock-L,7TYP_KUR,0.0,0.6086956521739131,"{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 3}","{'UNL:ALA:Hydrophobic': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 2, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+83,DiffDock-L,8HFN_XGC,0.7999999999999999,0.44444444444444453,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:VdWContact': 4, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 3, 'UNL:TRP:VdWContact': 1}","{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+84,DiffDock-L,7W06_ITN,0.8333333333333334,0.18181818181818177,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 2}"
+85,DiffDock-L,7UQ3_O2U,0.25,0.08333333333333333,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+86,DiffDock-L,7USH_82V,0.0,0.16666666666666669,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}"
+87,DiffDock-L,7XG5_PLP,0.5999999999999999,0.25,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}"
+88,DiffDock-L,7WUX_6OI,0.22222222222222227,0.4444444444444445,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1}"
+89,DiffDock-L,7QHL_D5P,0.0,0.16666666666666669,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+90,DiffDock-L,7Q5I_I0F,0.16666666666666666,0.09090909090909094,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}"
+91,DiffDock-L,8DKO_TFB,0.6666666666666667,0.2727272727272727,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+92,DiffDock-L,8G6P_API,0.75,0.2727272727272726,"{'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1}"
+93,DiffDock-L,7ULC_56B,0.8333333333333334,0.33333333333333326,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+94,DiffDock-L,8DP2_UMA,0.625,0.1333333333333333,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}"
+95,DiffDock-L,7XFA_D9J,0.0,0.4000000000000001,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}"
+96,DiffDock-L,7WDT_NGS,0.5,0.6,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 4, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+97,DiffDock-L,8AEM_LVF,0.0,0.30000000000000004,"{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:MET:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+98,DiffDock-L,7ZHP_IQY,0.0,0.24999999999999997,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+99,DiffDock-L,7W05_GMP,0.4,0.6666666666666666,"{'UNL:ASN:HBDonor': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+100,DiffDock-L,8AIE_M7L,0.6,0.14285714285714282,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 4, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 4, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 3, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+101,DiffDock-L,8EYE_X4I,0.6,0.125,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 5, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 5, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+102,DiffDock-L,7UY4_SMI,0.0,0.33333333333333337,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+103,DiffDock-L,7UMW_NAD,0.33333333333333337,0.04999999999999999,"{'UNL:ALA:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBAcceptor': 2, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+104,DiffDock-L,7U3J_L6U,0.3333333333333333,0.30000000000000004,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 3}"
+105,DiffDock-L,7QGP_DJ8,0.5,0.3,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+106,DiffDock-L,7TM6_GPJ,0.5714285714285714,0.42857142857142855,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 2}"
+107,DiffDock-L,7WQQ_5Z6,0.5,0.375,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 4, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+108,DiffDock-L,7WL4_JFU,0.0,0.16666666666666657,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+109,DiffDock-L,7Z2O_IAJ,0.0,0.0,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}"
+110,DiffDock-L,8FLV_ZB9,0.3333333333333333,0.21739130434782614,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+111,DiffDock-L,7T0D_FPP,0.25,0.18181818181818185,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 4}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 5}"
+112,DiffDock-L,8C5M_MTA,0.3333333333333333,0.4166666666666667,"{'UNL:ASP:VdWContact': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+113,DiffDock-L,7Z7F_IF3,0.0,0.2000000000000001,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+114,DiffDock-L,7ZL5_IWE,0.0,0.6363636363636362,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:HIS:VdWContact': 4, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1}"
+115,DiffDock-L,7ZOC_T8E,0.5,0.27272727272727276,"{'UNL:ASN:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 3, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 4, 'UNL:HIS:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+116,DiffDock-L,7WCF_ACP,0.16666666666666666,0.1578947368421053,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 3, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+117,DiffDock-L,8D5D_5DK,0.16666666666666663,0.23529411764705885,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+118,DiffDock-L,7TBU_S3P,0.5999999999999999,0.375,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1}"
+119,DiffDock-L,7TB0_UD1,0.42857142857142855,0.375,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 2}"
+120,DiffDock-L,7QE4_NGA,0.5,0.6000000000000001,"{'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+121,DiffDock-L,8AP0_PRP,1.1428571428571428,0.4285714285714286,"{'UNL:ARG:VdWContact': 2, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+122,DiffDock-L,8BOM_QU6,0.5,0.1428571428571429,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+123,DiffDock-L,5SIS_JSM,0.6666666666666666,0.14999999999999997,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+124,DiffDock-L,5SD5_HWI,0.75,0.375,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+125,DiffDock-L,7R3D_APR,0.14285714285714285,0.1538461538461538,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:HBDonor': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 4}"
+126,DiffDock-L,7WJB_BGC,0.0,0.25,"{'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+127,DiffDock-L,7UTW_NAI,0.2857142857142857,0.3125,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 3}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 3}"
+128,DiffDock-L,7QPP_VDX,0.25,0.3529411764705883,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+129,DiffDock-L,7VKZ_NOJ,0.6,0.125,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 2}"
+130,DiffDock-L,8FAV_4Y5,0.6000000000000001,0.24999999999999994,"{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 3, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+131,DiffDock-L,8CSD_C5P,0.7999999999999999,0.3,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 2, 'UNL:SER:VdWContact': 3, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+132,DiffDock-L,7SIU_9ID,0.2,0.4761904761904761,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+133,DiffDock-L,7VYJ_CA0,0.5,0.15384615384615385,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+134,DiffDock-L,7QHG_T3B,0.4,0.12499999999999997,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+135,DynamicBind,7UJ5_DGL,0.8571428571428571,0.6363636363636364,"{'UNL:CYS:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+136,DynamicBind,8EX2_Q2Q,0.0,0.41666666666666663,"{'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+137,DynamicBind,8C3N_ADP,0.625,0.3333333333333333,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 4, 'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+138,DynamicBind,7R59_I5F,0.0,0.3333333333333333,"{'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+139,DynamicBind,7V14_ORU,0.0,0.3333333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+140,DynamicBind,7Q27_8KC,0.5999999999999999,0.3999999999999999,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+141,DynamicBind,8DHG_T78,0.6666666666666667,0.4814814814814814,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+142,DynamicBind,8EXL_799,0.25,0.3684210526315789,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:MET:Hydrophobic': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}"
+143,DynamicBind,7THI_PGA,1.2,0.5714285714285715,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+144,DynamicBind,7XPO_UPG,0.9999999999999999,0.06666666666666665,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+145,DynamicBind,7TE8_P0T,0.3333333333333333,0.25000000000000006,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+146,DynamicBind,7QF4_RBF,1.25,0.375,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}"
+147,DynamicBind,7UJ4_OQ4,0.0,0.27272727272727276,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+148,DynamicBind,7YZU_DO7,0.5,0.5,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 2}"
+149,DynamicBind,8B8H_OJQ,0.75,0.3333333333333332,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}"
+150,DynamicBind,7TOM_5AD,0.49999999999999994,0.0434782608695653,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+151,DynamicBind,7VWF_K55,0.0,0.5454545454545455,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 3}","{'UNL:ARG:Hydrophobic': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 1}"
+152,DynamicBind,7XI7_4RI,0.0,0.25000000000000006,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+153,DynamicBind,7WKL_CAQ,0.0,0.23076923076923078,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+154,DynamicBind,7WPW_F15,0.3333333333333333,0.1875,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+155,DynamicBind,8SLG_G5A,0.125,0.4545454545454546,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 4, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 3, 'UNL:GLU:VdWContact': 5, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+156,DynamicBind,7SZA_DUI,0.75,0.3076923076923077,"{'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+157,DynamicBind,7ZF0_DHR,0.0,0.3,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 3}"
+158,DynamicBind,7XRL_FWK,0.6666666666666666,0.5294117647058824,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+159,DynamicBind,7X5N_5M5,0.16666666666666669,0.2222222222222223,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+160,DynamicBind,7VQ9_ISY,0.25,0.3333333333333333,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+161,DynamicBind,8AQL_PLG,0.16666666666666666,0.41666666666666663,"{'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 4, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+162,DynamicBind,7TYP_KUR,0.0,0.5384615384615383,"{'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 2, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+163,DynamicBind,7XJN_NSD,0.3333333333333333,1.125,"{'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+164,DynamicBind,8HFN_XGC,0.2857142857142857,0.19047619047619047,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+165,DynamicBind,7W06_ITN,1.0,0.41666666666666663,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 2}"
+166,DynamicBind,8GFD_ZHR,0.0,0.4000000000000001,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:SER:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+167,DynamicBind,7UQ3_O2U,0.6666666666666666,0.08333333333333326,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+168,DynamicBind,7USH_82V,0.0,0.16666666666666669,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}"
+169,DynamicBind,7XG5_PLP,1.0,0.30769230769230765,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}"
+170,DynamicBind,7QHL_D5P,0.0,0.05882352941176472,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+171,DynamicBind,8G6P_API,0.625,0.09090909090909088,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1}"
+172,DynamicBind,7ULC_56B,0.8333333333333334,0.3333333333333335,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+173,DynamicBind,8DP2_UMA,0.5555555555555556,0.4736842105263159,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}"
+174,DynamicBind,7ZZW_KKW,0.0,0.4375,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:VdWContact': 2}"
+175,DynamicBind,7XFA_D9J,0.0,0.1111111111111111,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}"
+176,DynamicBind,7WDT_NGS,0.6000000000000001,0.8888888888888888,"{'UNL:GLU:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 3}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+177,DynamicBind,8AEM_LVF,0.0,0.38461538461538464,"{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:MET:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+178,DynamicBind,7ZHP_IQY,0.3333333333333333,0.4210526315789474,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+179,DynamicBind,8AIE_M7L,1.2,0.3999999999999999,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 3, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+180,DynamicBind,8EYE_X4I,1.0,0.23529411764705888,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 5, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+181,DynamicBind,7UMW_NAD,0.5714285714285714,0.5238095238095237,"{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBAcceptor': 2, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+182,DynamicBind,7TM6_GPJ,0.8333333333333333,0.6666666666666665,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LYS:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 2}"
+183,DynamicBind,7WQQ_5Z6,0.0,0.625,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 3, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 4, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+184,DynamicBind,7WL4_JFU,0.0,0.33333333333333326,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+185,DynamicBind,7Z2O_IAJ,0.5,0.29999999999999993,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}"
+186,DynamicBind,7Z7F_IF3,0.0,0.18181818181818185,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+187,DynamicBind,7ZL5_IWE,0.5,0.6923076923076923,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1}"
+188,DynamicBind,7ZOC_T8E,0.0,0.30769230769230765,"{'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 4, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 4, 'UNL:HIS:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+189,DynamicBind,7WCF_ACP,0.2857142857142857,0.09523809523809518,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 3, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 3, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+190,DynamicBind,8D5D_5DK,1.1666666666666665,0.19047619047619052,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+191,DynamicBind,7TBU_S3P,0.39999999999999997,0.49999999999999994,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1}"
+192,DynamicBind,8BOM_QU6,0.75,0.09090909090909094,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+193,DynamicBind,5SIS_JSM,0.5,0.2222222222222222,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+194,DynamicBind,5SD5_HWI,1.0,0.3529411764705883,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+195,DynamicBind,7WJB_BGC,0.5,0.42857142857142855,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+196,DynamicBind,7UTW_NAI,0.22222222222222215,0.38888888888888895,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 3}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 3}"
+197,DynamicBind,7QPP_VDX,0.5,0.5,"{'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+198,DynamicBind,7VKZ_NOJ,0.6,0.42857142857142866,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 3}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 2}"
+199,DynamicBind,8CSD_C5P,0.5,0.75,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 2, 'UNL:SER:VdWContact': 3, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+200,DynamicBind,7SIU_9ID,0.3333333333333333,0.17647058823529416,"{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 4, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+201,DynamicBind,7QHG_T3B,0.6,0.409090909090909,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 4, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+202,NeuralPLexer,7UAW_MF6,0.7777777777777779,0.29411764705882343,"{'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+203,NeuralPLexer,7UJ5_DGL,0.25,0.08333333333333334,"{'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+204,NeuralPLexer,7UYB_OK0,0.39999999999999997,0.2857142857142858,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+205,NeuralPLexer,8D19_GSH,0.39999999999999997,0.24999999999999994,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+206,NeuralPLexer,8C3N_ADP,0.625,0.44444444444444436,"{'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+207,NeuralPLexer,7XQZ_FPF,0.75,0.2222222222222223,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+208,NeuralPLexer,7XBV_APC,0.5,0.21428571428571422,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+209,NeuralPLexer,7ZDY_6MJ,0.0,0.14285714285714285,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+210,NeuralPLexer,7Q27_8KC,0.8,0.4736842105263158,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+211,NeuralPLexer,7THI_PGA,1.2,0.7142857142857144,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+212,NeuralPLexer,7QF4_RBF,0.75,0.375,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}"
+213,NeuralPLexer,8EAB_VN2,0.6666666666666667,0.8333333333333335,"{'UNL:ASN:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 7, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:HBAcceptor': 2, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+214,NeuralPLexer,8D39_QDB,0.0,0.2727272727272727,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+215,NeuralPLexer,7YZU_DO7,0.5,0.3571428571428571,"{'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 2}"
+216,NeuralPLexer,8B8H_OJQ,0.5,0.2,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}"
+217,NeuralPLexer,7TOM_5AD,0.8,0.5555555555555557,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+218,NeuralPLexer,7XI7_4RI,0.5,0.08333333333333334,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+219,NeuralPLexer,7WKL_CAQ,0.3333333333333333,0.08333333333333334,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+220,NeuralPLexer,7WPW_F15,0.3333333333333333,0.33333333333333337,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+221,NeuralPLexer,8SLG_G5A,1.0,0.45454545454545453,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 3, 'UNL:GLU:VdWContact': 5, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+222,NeuralPLexer,7T3E_SLB,1.0,0.875,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2}"
+223,NeuralPLexer,8CNH_V6U,0.6000000000000001,0.4285714285714286,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+224,NeuralPLexer,8G0V_YHT,0.0,0.4117647058823529,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+225,NeuralPLexer,7X5N_5M5,0.19999999999999996,0.1578947368421052,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+226,NeuralPLexer,7VQ9_ISY,1.0,0.7692307692307693,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+227,NeuralPLexer,8AQL_PLG,0.1428571428571429,0.08333333333333334,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 4, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 4, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+228,NeuralPLexer,7XJN_NSD,0.0,1.25,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+229,NeuralPLexer,8AUH_L9I,0.6666666666666667,0.3333333333333333,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:CYS:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+230,NeuralPLexer,7W06_ITN,1.0,0.2222222222222222,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 2}"
+231,NeuralPLexer,7UAS_MBU,0.0,0.27777777777777773,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+232,NeuralPLexer,7UQ3_O2U,0.3333333333333333,0.5454545454545454,"{'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+233,NeuralPLexer,7XG5_PLP,0.75,0.3846153846153846,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}"
+234,NeuralPLexer,7QHL_D5P,0.0,0.42105263157894746,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 3, 'UNL:LYS:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+235,NeuralPLexer,7Q5I_I0F,0.375,0.35294117647058826,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}"
+236,NeuralPLexer,8DKO_TFB,0.6666666666666667,0.375,"{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+237,NeuralPLexer,8G6P_API,1.0,0.22222222222222215,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1}"
+238,NeuralPLexer,7ULC_56B,0.125,0.3571428571428572,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+239,NeuralPLexer,8DP2_UMA,0.39999999999999997,0.19999999999999998,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}"
+240,NeuralPLexer,7WY1_D0L,0.6000000000000001,0.3500000000000001,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 4, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+241,NeuralPLexer,7ZHP_IQY,0.3333333333333333,0.2727272727272727,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+242,NeuralPLexer,7W05_GMP,1.0,0.75,"{'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+243,NeuralPLexer,8AIE_M7L,1.5,0.15384615384615374,"{'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 3, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+244,NeuralPLexer,7UY4_SMI,0.0,0.5,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+245,NeuralPLexer,7UMW_NAD,0.5,0.13636363636363635,"{'UNL:ALA:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBAcceptor': 2, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+246,NeuralPLexer,7TM6_GPJ,1.0,0.7142857142857143,"{'UNL:ARG:VdWContact': 1, 'UNL:GLU:HBAcceptor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 2}"
+247,NeuralPLexer,7WQQ_5Z6,0.5,0.33333333333333326,"{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 4, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:Hydrophobic': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 4, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+248,NeuralPLexer,7WL4_JFU,0.0,0.1578947368421053,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+249,NeuralPLexer,8FLV_ZB9,0.3333333333333333,0.1999999999999999,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+250,NeuralPLexer,8C5M_MTA,0.19999999999999996,0.07692307692307693,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+251,NeuralPLexer,7TUO_KL9,0.0,0.1250000000000001,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+252,NeuralPLexer,7ZL5_IWE,0.3333333333333333,0.5384615384615384,"{'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1}"
+253,NeuralPLexer,8F8E_XJI,0.3333333333333333,0.25000000000000006,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+254,NeuralPLexer,7WCF_ACP,0.125,0.25,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 3, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+255,NeuralPLexer,8D5D_5DK,0.7142857142857143,0.375,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 5, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+256,NeuralPLexer,7TBU_S3P,0.49999999999999994,0.5,"{'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1}"
+257,NeuralPLexer,7TB0_UD1,0.625,0.19999999999999996,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 2}"
+258,NeuralPLexer,8AP0_PRP,1.0,0.25,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+259,NeuralPLexer,7UXS_OJC,0.6666666666666666,0.2666666666666666,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1}"
+260,NeuralPLexer,7X9K_8OG,0.875,0.1333333333333333,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+261,NeuralPLexer,5SIS_JSM,0.0,0.10526315789473684,"{'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+262,NeuralPLexer,7R3D_APR,0.16666666666666666,0.3333333333333334,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 4}"
+263,NeuralPLexer,7WJB_BGC,0.25,0.33333333333333337,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+264,NeuralPLexer,7UTW_NAI,0.5,0.3157894736842106,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 5, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 3}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 3}"
+265,NeuralPLexer,7QPP_VDX,1.0,0.3529411764705883,"{'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+266,NeuralPLexer,7VKZ_NOJ,0.8,0.5,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 3}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 2}"
+267,NeuralPLexer,8CSD_C5P,0.25,0.7000000000000001,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 2, 'UNL:SER:VdWContact': 3, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+268,NeuralPLexer,7VYJ_CA0,0.6666666666666666,0.23529411764705885,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+269,RFAA,8EX2_Q2Q,0.0,0.1666666666666667,"{'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+270,RFAA,7U0U_FK5,0.5,0.22222222222222227,"{'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 4, 'UNL:TYR:VdWContact': 4, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU-:Hydrophobic': 1, 'UNL:GLU-:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE-:Hydrophobic': 1, 'UNL:PHE-:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:PRO-:Hydrophobic': 1, 'UNL:TRP-:HBAcceptor': 1, 'UNL:TRP-:Hydrophobic': 1, 'UNL:TRP-:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+271,RFAA,8C3N_ADP,0.4285714285714286,0.5555555555555555,"{'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+272,RFAA,7R59_I5F,0.0,0.33333333333333326,"{'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+273,RFAA,7TOM_5AD,0.19999999999999996,0.4117647058823529,"{'UNL:GLN:VdWContact': 2, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+274,RFAA,7XI7_4RI,0.3333333333333333,0.08333333333333331,"{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+275,RFAA,8HFN_XGC,0.5,0.368421052631579,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+276,RFAA,7ULC_56B,0.8333333333333334,0.6153846153846152,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 5, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+277,RFAA,7UY4_SMI,0.0,0.4999999999999999,"{'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 5, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+278,RFAA,7UMW_NAD,0.5714285714285714,0.6190476190476191,"{'UNL:ALA:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 4, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 5, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 4, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBAcceptor': 2, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+279,RFAA,8FLV_ZB9,0.3333333333333333,0.26315789473684204,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 3, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+280,RFAA,8C5M_MTA,0.3333333333333333,0.26666666666666666,"{'UNL:ASP:VdWContact': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+281,RFAA,8F8E_XJI,0.39999999999999997,0.5263157894736843,"{'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 4}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+282,RFAA,5SIS_JSM,0.0,0.2727272727272727,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+283,RFAA,7WJB_BGC,0.6666666666666666,0.4285714285714285,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 4, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+284,RFAA,7QPP_VDX,0.19999999999999996,0.9375,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+285,Chai-1-Single-Seq,8AAU_LH0,0.0,0.25000000000000006,"{'UNL:ALA:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+286,Chai-1-Single-Seq,7UAW_MF6,0.75,0.29411764705882343,"{'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+287,Chai-1-Single-Seq,7UJ5_DGL,0.28571428571428575,0.0,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+288,Chai-1-Single-Seq,8EX2_Q2Q,0.0,0.33333333333333337,"{'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+289,Chai-1-Single-Seq,7UYB_OK0,0.0,0.23076923076923084,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+290,Chai-1-Single-Seq,7U0U_FK5,0.5,0.4,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 4, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU-:Hydrophobic': 1, 'UNL:GLU-:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE-:Hydrophobic': 1, 'UNL:PHE-:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:PRO-:Hydrophobic': 1, 'UNL:TRP-:HBAcceptor': 1, 'UNL:TRP-:Hydrophobic': 1, 'UNL:TRP-:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+291,Chai-1-Single-Seq,8D19_GSH,0.2,0.125,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+292,Chai-1-Single-Seq,8C3N_ADP,0.14285714285714285,0.2000000000000001,"{'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+293,Chai-1-Single-Seq,8A1H_DLZ,0.16666666666666666,0.3571428571428571,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+294,Chai-1-Single-Seq,7XQZ_FPF,0.39999999999999997,0.21052631578947367,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+295,Chai-1-Single-Seq,7TXK_LW8,0.5,0.0625,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+296,Chai-1-Single-Seq,7R59_I5F,0.5,0.25,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+297,Chai-1-Single-Seq,7ZCC_OGA,0.5,0.7142857142857143,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:PRO:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+298,Chai-1-Single-Seq,7QFM_AY3,0.5,0.1666666666666667,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+299,Chai-1-Single-Seq,7QTA_URI,0.5,0.08333333333333331,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}"
+300,Chai-1-Single-Seq,7XBV_APC,0.16666666666666666,0.23076923076923073,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+301,Chai-1-Single-Seq,7V14_ORU,0.0,0.14285714285714285,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+302,Chai-1-Single-Seq,7Q27_8KC,0.25,0.21428571428571425,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+303,Chai-1-Single-Seq,8DHG_T78,0.3333333333333333,0.22222222222222227,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 5, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+304,Chai-1-Single-Seq,8EXL_799,0.25,0.23809523809523808,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}"
+305,Chai-1-Single-Seq,7THI_PGA,0.5,0.16666666666666666,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+306,Chai-1-Single-Seq,7XPO_UPG,0.125,0.2727272727272728,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+307,Chai-1-Single-Seq,7TE8_P0T,0.0,0.5789473684210528,"{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+308,Chai-1-Single-Seq,7QF4_RBF,0.25,0.1875,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 4, 'UNL:GLN:HBAcceptor': 3, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}"
+309,Chai-1-Single-Seq,7UJ4_OQ4,0.0,0.11111111111111113,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+310,Chai-1-Single-Seq,8EAB_VN2,1.0,0.4615384615384615,"{'UNL:ASP:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 3, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:HBAcceptor': 2, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+311,Chai-1-Single-Seq,7Q25_8J9,1.25,0.19999999999999996,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 3, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+312,Chai-1-Single-Seq,7TH4_FFO,0.39999999999999997,0.375,"{'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+313,Chai-1-Single-Seq,8D39_QDB,0.0,0.09999999999999998,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+314,Chai-1-Single-Seq,7YZU_DO7,0.28571428571428575,0.23076923076923073,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 2}"
+315,Chai-1-Single-Seq,8B8H_OJQ,0.0,0.11111111111111113,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBDonor': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}"
+316,Chai-1-Single-Seq,7TOM_5AD,0.16666666666666663,0.5,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+317,Chai-1-Single-Seq,7VWF_K55,1.0,0.12500000000000006,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:Hydrophobic': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 1}"
+318,Chai-1-Single-Seq,7XI7_4RI,0.3333333333333333,0.30000000000000004,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+319,Chai-1-Single-Seq,7WPW_F15,0.5,0.2666666666666668,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+320,Chai-1-Single-Seq,8SLG_G5A,0.42857142857142866,0.3333333333333333,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 4, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 3, 'UNL:GLU:VdWContact': 5, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+321,Chai-1-Single-Seq,7SZA_DUI,0.3333333333333333,0.23529411764705882,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+322,Chai-1-Single-Seq,7T3E_SLB,0.6666666666666666,0.2222222222222222,"{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2}"
+323,Chai-1-Single-Seq,7X5N_5M5,0.6666666666666666,0.06666666666666667,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+324,Chai-1-Single-Seq,7VQ9_ISY,0.6666666666666667,0.41666666666666674,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 4, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+325,Chai-1-Single-Seq,7XJN_NSD,0.5,0.875,"{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+326,Chai-1-Single-Seq,8HFN_XGC,0.6,0.11111111111111102,"{'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+327,Chai-1-Single-Seq,8AUH_L9I,0.6666666666666667,0.5,"{'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:CYS:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+328,Chai-1-Single-Seq,7W06_ITN,0.6666666666666667,0.33333333333333326,"{'UNL:ALA:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 2}"
+329,Chai-1-Single-Seq,7UAS_MBU,0.0,0.4375,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+330,Chai-1-Single-Seq,8GFD_ZHR,0.0,0.0714285714285714,"{'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+331,Chai-1-Single-Seq,7UQ3_O2U,0.25,0.08333333333333333,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+332,Chai-1-Single-Seq,7USH_82V,0.5,0.18181818181818185,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}"
+333,Chai-1-Single-Seq,7XG5_PLP,0.0,0.18181818181818185,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}"
+334,Chai-1-Single-Seq,7WUX_6OI,0.4444444444444445,0.5714285714285714,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1}"
+335,Chai-1-Single-Seq,7QHL_D5P,0.0,0.0,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+336,Chai-1-Single-Seq,7Q5I_I0F,0.7142857142857142,0.2666666666666666,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}"
+337,Chai-1-Single-Seq,8DKO_TFB,0.33333333333333337,0.33333333333333337,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+338,Chai-1-Single-Seq,7ULC_56B,0.4,0.19999999999999996,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+339,Chai-1-Single-Seq,7SFO_98L,0.0,0.2941176470588236,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1}"
+340,Chai-1-Single-Seq,8DP2_UMA,0.3333333333333333,0.14285714285714285,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}"
+341,Chai-1-Single-Seq,7XFA_D9J,0.0,0.2,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}"
+342,Chai-1-Single-Seq,7WDT_NGS,0.25,0.0,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+343,Chai-1-Single-Seq,7WY1_D0L,0.0,0.3157894736842105,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 4, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+344,Chai-1-Single-Seq,7ZHP_IQY,0.6666666666666666,0.36842105263157904,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+345,Chai-1-Single-Seq,7W05_GMP,0.0,0.125,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+346,Chai-1-Single-Seq,7UJF_R3V,0.5,0.21052631578947367,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 9, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+347,Chai-1-Single-Seq,8AIE_M7L,1.0,0.33333333333333337,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 3, 'UNL:THR:VdWContact': 5, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 3, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+348,Chai-1-Single-Seq,8EYE_X4I,0.16666666666666663,0.17647058823529405,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 5, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 5, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+349,Chai-1-Single-Seq,7UMW_NAD,0.33333333333333337,0.11111111111111113,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:HBAcceptor': 2, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBAcceptor': 2, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+350,Chai-1-Single-Seq,7U3J_L6U,0.5,0.09090909090909086,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 3}"
+351,Chai-1-Single-Seq,7QGP_DJ8,0.5,0.19999999999999996,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+352,Chai-1-Single-Seq,7TM6_GPJ,0.14285714285714285,0.0,"{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 2}"
+353,Chai-1-Single-Seq,7WQQ_5Z6,0.5,0.5714285714285714,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 3, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 4, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+354,Chai-1-Single-Seq,7WL4_JFU,0.0,0.1666666666666666,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+355,Chai-1-Single-Seq,7Z2O_IAJ,0.0,0.08333333333333326,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}"
+356,Chai-1-Single-Seq,7T0D_FPP,0.2,0.29999999999999993,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 4, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 5}"
+357,Chai-1-Single-Seq,8C5M_MTA,0.3333333333333333,0.33333333333333337,"{'UNL:ASP:VdWContact': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+358,Chai-1-Single-Seq,7Z7F_IF3,0.5,0.18181818181818182,"{'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+359,Chai-1-Single-Seq,7TSF_H4B,0.75,0.5714285714285714,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}"
+360,Chai-1-Single-Seq,7TUO_KL9,0.5,0.5909090909090909,"{'UNL:ALA:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+361,Chai-1-Single-Seq,7Q2B_M6H,0.0,0.4666666666666668,"{'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}","{'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+362,Chai-1-Single-Seq,7WCF_ACP,0.14285714285714285,0.058823529411764705,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 3, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 3, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+363,Chai-1-Single-Seq,7TS6_KMI,0.3333333333333333,0.6,"{'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+364,Chai-1-Single-Seq,8D5D_5DK,0.39999999999999997,0.125,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:HBDonor': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+365,Chai-1-Single-Seq,7TBU_S3P,0.2,0.5,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1}"
+366,Chai-1-Single-Seq,8AP0_PRP,0.09090909090909094,0.33333333333333337,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 3, 'UNL:SER:HBDonor': 2, 'UNL:SER:VdWContact': 4, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+367,Chai-1-Single-Seq,7UXS_OJC,0.6,0.35714285714285715,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1}"
+368,Chai-1-Single-Seq,7X9K_8OG,0.2222222222222222,0.07692307692307687,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+369,Chai-1-Single-Seq,8BOM_QU6,0.0,0.0,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+370,Chai-1-Single-Seq,5SIS_JSM,0.0,0.2777777777777778,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+371,Chai-1-Single-Seq,5SD5_HWI,0.5,0.3076923076923078,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+372,Chai-1-Single-Seq,7R3D_APR,0.2,0.5833333333333334,"{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 5}","{'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 4}"
+373,Chai-1-Single-Seq,7WJB_BGC,0.0,0.16666666666666674,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+374,Chai-1-Single-Seq,7UTW_NAI,0.30000000000000004,0.1875,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 3}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 3}"
+375,Chai-1-Single-Seq,7QPP_VDX,0.33333333333333337,0.33333333333333326,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 5, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 4, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+376,Chai-1-Single-Seq,8CSD_C5P,0.2,0.2727272727272727,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 2, 'UNL:SER:VdWContact': 3, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+377,Chai-1-Single-Seq,7SIU_9ID,0.0,0.3500000000000001,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+378,Chai-1-Single-Seq,7VYJ_CA0,0.1428571428571429,0.25,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+379,Chai-1-Single-Seq,7QHG_T3B,0.4,0.5909090909090908,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+380,Chai-1-Single-Seq,8HO0_3ZI,0.5,0.1538461538461538,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+381,Chai-1,8AAU_LH0,0.0,0.2857142857142857,"{'UNL:ALA:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+382,Chai-1,7UAW_MF6,0.5,0.2727272727272728,"{'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+383,Chai-1,7UJ5_DGL,0.4285714285714286,0.1538461538461539,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+384,Chai-1,8EX2_Q2Q,0.0,0.33333333333333337,"{'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+385,Chai-1,7UYB_OK0,0.0,0.14285714285714293,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+386,Chai-1,7U0U_FK5,0.0,0.3600000000000001,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 3}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU-:Hydrophobic': 1, 'UNL:GLU-:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE-:Hydrophobic': 1, 'UNL:PHE-:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:PRO-:Hydrophobic': 1, 'UNL:TRP-:HBAcceptor': 1, 'UNL:TRP-:Hydrophobic': 1, 'UNL:TRP-:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+387,Chai-1,8D19_GSH,0.2,0.5,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+388,Chai-1,8C3N_ADP,0.1111111111111111,0.10000000000000009,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+389,Chai-1,8A1H_DLZ,0.0,0.13333333333333336,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+390,Chai-1,7XQZ_FPF,0.25,0.22222222222222218,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+391,Chai-1,7R59_I5F,0.5,0.3333333333333333,"{'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+392,Chai-1,7ZCC_OGA,0.5,0.8571428571428571,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+393,Chai-1,7QFM_AY3,0.5,0.21428571428571427,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+394,Chai-1,7QTA_URI,0.0,0.28571428571428575,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}"
+395,Chai-1,8DSC_NCA,0.0,0.3333333333333333,"{'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1}"
+396,Chai-1,7XBV_APC,0.4,0.30769230769230765,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+397,Chai-1,7V14_ORU,0.0,0.26666666666666666,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+398,Chai-1,7Q27_8KC,0.5,0.4285714285714285,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:VdWContact': 3, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+399,Chai-1,8DHG_T78,0.0,0.2222222222222223,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 5, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+400,Chai-1,8EXL_799,0.25,0.05263157894736842,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}"
+401,Chai-1,7THI_PGA,0.16666666666666674,0.16666666666666663,"{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 2, 'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+402,Chai-1,7XPO_UPG,0.0,0.16666666666666669,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+403,Chai-1,7TE8_P0T,0.0,0.47368421052631565,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+404,Chai-1,7QF4_RBF,0.0,0.25,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 4, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}"
+405,Chai-1,7UJ4_OQ4,0.5,0.1578947368421052,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+406,Chai-1,8EAB_VN2,0.33333333333333337,0.2727272727272727,"{'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:HBAcceptor': 2, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+407,Chai-1,7Q25_8J9,0.20000000000000007,0.06666666666666665,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 3, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 3, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+408,Chai-1,7TH4_FFO,0.39999999999999997,0.21428571428571425,"{'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+409,Chai-1,8D39_QDB,0.0,0.2727272727272728,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+410,Chai-1,7YZU_DO7,0.0,0.08333333333333333,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 2}"
+411,Chai-1,8B8H_OJQ,0.0,0.058823529411764705,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBDonor': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}"
+412,Chai-1,7TOM_5AD,0.33333333333333326,0.375,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+413,Chai-1,7VWF_K55,0.5,0.21739130434782622,"{'UNL:ARG:Hydrophobic': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 1}"
+414,Chai-1,7XI7_4RI,0.3333333333333333,0.11111111111111116,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+415,Chai-1,7WPW_F15,0.5,0.14285714285714282,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+416,Chai-1,8SLG_G5A,0.42857142857142866,0.45454545454545453,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 3, 'UNL:GLU:VdWContact': 5, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+417,Chai-1,7SZA_DUI,0.6000000000000001,0.14285714285714282,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+418,Chai-1,7T3E_SLB,0.5,0.20000000000000007,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2}"
+419,Chai-1,8CNH_V6U,0.6000000000000001,0.3333333333333333,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 3, 'UNL:SER:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+420,Chai-1,7XRL_FWK,0.3333333333333333,0.27272727272727265,"{'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 4, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+421,Chai-1,7Z1Q_NIO,0.0,0.0,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+422,Chai-1,7X5N_5M5,0.0,0.06666666666666667,"{'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+423,Chai-1,7VQ9_ISY,0.3333333333333333,0.0,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+424,Chai-1,8AQL_PLG,0.14285714285714285,0.41666666666666663,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 4, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+425,Chai-1,7TYP_KUR,0.0,0.22727272727272713,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 2, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+426,Chai-1,8HFN_XGC,0.6,0.11111111111111113,"{'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+427,Chai-1,8AUH_L9I,0.5,0.75,"{'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:CYS:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+428,Chai-1,7W06_ITN,0.6000000000000001,0.1111111111111111,"{'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 2}"
+429,Chai-1,7UAS_MBU,0.0,0.2857142857142857,"{'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 2, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ASP:Hydrophobic': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+430,Chai-1,8GFD_ZHR,0.0,0.21428571428571436,"{'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+431,Chai-1,7UQ3_O2U,0.25,0.08333333333333333,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+432,Chai-1,7USH_82V,0.0,0.09090909090909091,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}"
+433,Chai-1,7XG5_PLP,0.0,0.10000000000000009,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}"
+434,Chai-1,7WUX_6OI,0.3333333333333334,0.0,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1}"
+435,Chai-1,7QHL_D5P,0.0,0.125,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+436,Chai-1,7Q5I_I0F,0.14285714285714285,0.0,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}"
+437,Chai-1,8DKO_TFB,0.0,0.0,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+438,Chai-1,8G6P_API,1.1666666666666667,0.9999999999999999,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1}"
+439,Chai-1,7ULC_56B,0.0,0.35294117647058826,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+440,Chai-1,7SFO_98L,0.0,0.1875,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1}"
+441,Chai-1,8DP2_UMA,0.4444444444444445,0.21428571428571425,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}"
+442,Chai-1,7ZZW_KKW,0.3333333333333333,0.39999999999999997,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:VdWContact': 2}"
+443,Chai-1,7XFA_D9J,0.0,0.22222222222222215,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}"
+444,Chai-1,7WDT_NGS,0.25,0.11111111111111105,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+445,Chai-1,7WY1_D0L,0.0,0.10526315789473684,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 4, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 4, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+446,Chai-1,7ZHP_IQY,0.3333333333333333,0.13636363636363627,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+447,Chai-1,7W05_GMP,0.39999999999999997,0.0,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+448,Chai-1,7UJF_R3V,0.0,0.35000000000000003,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 9, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+449,Chai-1,8AIE_M7L,0.2,0.4545454545454546,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 3, 'UNL:THR:VdWContact': 5, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 3, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+450,Chai-1,8EYE_X4I,0.39999999999999997,0.3125,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 5, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 5, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+451,Chai-1,7UY4_SMI,0.0,0.5555555555555556,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+452,Chai-1,7UMW_NAD,0.33333333333333337,0.05263157894736842,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBAcceptor': 2, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBAcceptor': 2, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+453,Chai-1,7U3J_L6U,0.28571428571428575,0.19047619047619035,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 3}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 3}"
+454,Chai-1,7QGP_DJ8,0.5,0.2777777777777777,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+455,Chai-1,7FT9_4MB,0.0,0.1538461538461538,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+456,Chai-1,7TM6_GPJ,0.1428571428571428,0.0,"{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:HBDonor': 2, 'UNL:LYS:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 2}"
+457,Chai-1,7WQQ_5Z6,0.6666666666666666,0.23076923076923062,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 4, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:Hydrophobic': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 4, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+458,Chai-1,7WL4_JFU,0.0,0.19999999999999998,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+459,Chai-1,7Z2O_IAJ,0.0,0.33333333333333337,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}"
+460,Chai-1,8FLV_ZB9,0.0,0.21052631578947367,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+461,Chai-1,7T0D_FPP,0.0,0.16666666666666669,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 4}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 5}"
+462,Chai-1,7Z7F_IF3,0.0,0.4,"{'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+463,Chai-1,7TSF_H4B,0.25,0.07692307692307693,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}"
+464,Chai-1,7TUO_KL9,0.3333333333333333,0.14285714285714285,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+465,Chai-1,7ZL5_IWE,0.5,0.6363636363636362,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:HIS:VdWContact': 4, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1}"
+466,Chai-1,8F8E_XJI,0.5,0.09999999999999998,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+467,Chai-1,7Q2B_M6H,0.0,0.1666666666666667,"{'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 3}","{'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+468,Chai-1,7ZOC_T8E,0.0,0.09090909090909094,"{'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:HIS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 4, 'UNL:HIS:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+469,Chai-1,7WCF_ACP,0.16666666666666666,0.0,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 3, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 3, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+470,Chai-1,7TS6_KMI,0.0,0.36363636363636365,"{'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+471,Chai-1,8D5D_5DK,0.4000000000000001,0.26666666666666666,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+472,Chai-1,7TBU_S3P,0.5,0.14285714285714285,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1}"
+473,Chai-1,8AP0_PRP,0.25,0.125,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+474,Chai-1,7UXS_OJC,0.14285714285714285,0.2777777777777778,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 4, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1}"
+475,Chai-1,7X9K_8OG,0.25,0.1538461538461538,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+476,Chai-1,8BOM_QU6,0.0,0.09523809523809534,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 4, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+477,Chai-1,5SIS_JSM,0.0,0.1666666666666666,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+478,Chai-1,5SD5_HWI,0.25,0.3333333333333334,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+479,Chai-1,7R3D_APR,0.14285714285714285,0.27272727272727276,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3}","{'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 4}"
+480,Chai-1,7WJB_BGC,0.4000000000000001,0.16666666666666666,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+481,Chai-1,7UTW_NAI,0.2222222222222222,0.1875,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 4}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 3}"
+482,Chai-1,7QPP_VDX,0.33333333333333337,0.0625,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+483,Chai-1,8FAV_4Y5,0.25,0.16666666666666657,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 3, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 3, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+484,Chai-1,8CSD_C5P,0.39999999999999997,0.36363636363636365,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 2, 'UNL:SER:VdWContact': 3, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+485,Chai-1,7SIU_9ID,0.3333333333333333,0.55,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+486,Chai-1,7VYJ_CA0,0.0,0.16666666666666669,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+487,Chai-1,7QHG_T3B,0.16666666666666666,0.3043478260869564,"{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+488,Boltz-1-Single-Seq,8AAU_LH0,0.0,0.4285714285714285,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+489,Boltz-1-Single-Seq,7UAW_MF6,0.5,0.29999999999999993,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+490,Boltz-1-Single-Seq,7UJ5_DGL,0.4285714285714286,0.16666666666666663,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+491,Boltz-1-Single-Seq,7UYB_OK0,0.0,0.07692307692307698,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+492,Boltz-1-Single-Seq,7U0U_FK5,0.0,0.2857142857142857,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 5, 'UNL:PHE:VdWContact': 5, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 3}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU-:Hydrophobic': 1, 'UNL:GLU-:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE-:Hydrophobic': 1, 'UNL:PHE-:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:PRO-:Hydrophobic': 1, 'UNL:TRP-:HBAcceptor': 1, 'UNL:TRP-:Hydrophobic': 1, 'UNL:TRP-:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+493,Boltz-1-Single-Seq,8D19_GSH,0.16666666666666669,0.18181818181818188,"{'UNL:ARG:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+494,Boltz-1-Single-Seq,8C3N_ADP,0.16666666666666666,0.22222222222222215,"{'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+495,Boltz-1-Single-Seq,7XQZ_FPF,0.75,0.05882352941176472,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+496,Boltz-1-Single-Seq,7TXK_LW8,0.0,0.125,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+497,Boltz-1-Single-Seq,7R59_I5F,0.0,0.1111111111111111,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+498,Boltz-1-Single-Seq,7QFM_AY3,0.3333333333333333,0.4375,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+499,Boltz-1-Single-Seq,8DSC_NCA,0.0,0.4000000000000001,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1}"
+500,Boltz-1-Single-Seq,7XBV_APC,0.0,0.23076923076923078,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+501,Boltz-1-Single-Seq,7ZDY_6MJ,0.5,0.16666666666666663,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 3}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+502,Boltz-1-Single-Seq,7V14_ORU,0.0,0.1538461538461539,"{'UNL:ALA:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+503,Boltz-1-Single-Seq,7Q27_8KC,0.25,0.25,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 3, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+504,Boltz-1-Single-Seq,8DHG_T78,0.0,0.3157894736842105,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+505,Boltz-1-Single-Seq,8EXL_799,0.6666666666666666,0.09999999999999998,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}"
+506,Boltz-1-Single-Seq,7THI_PGA,0.16666666666666663,0.14285714285714285,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+507,Boltz-1-Single-Seq,7XPO_UPG,0.3333333333333333,0.33333333333333326,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+508,Boltz-1-Single-Seq,7TE8_P0T,0.0,0.49999999999999994,"{'UNL:ALA:Hydrophobic': 3, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+509,Boltz-1-Single-Seq,7QF4_RBF,0.0,0.0,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}"
+510,Boltz-1-Single-Seq,7UJ4_OQ4,0.5,0.22222222222222215,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+511,Boltz-1-Single-Seq,7TH4_FFO,0.3333333333333333,0.4285714285714286,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+512,Boltz-1-Single-Seq,7YZU_DO7,0.16666666666666666,0.41666666666666674,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 2}"
+513,Boltz-1-Single-Seq,8B8H_OJQ,0.375,0.05555555555555555,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}"
+514,Boltz-1-Single-Seq,7TOM_5AD,0.5,0.33333333333333337,"{'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+515,Boltz-1-Single-Seq,7VWF_K55,0.5,0.2173913043478261,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:Hydrophobic': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 1}"
+516,Boltz-1-Single-Seq,7XI7_4RI,0.3333333333333333,0.2222222222222222,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+517,Boltz-1-Single-Seq,7WKL_CAQ,0.5,0.0,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+518,Boltz-1-Single-Seq,7WPW_F15,0.5,0.2666666666666668,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+519,Boltz-1-Single-Seq,8SLG_G5A,0.33333333333333326,0.2727272727272728,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 4, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 3, 'UNL:GLU:VdWContact': 5, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+520,Boltz-1-Single-Seq,7SZA_DUI,0.39999999999999997,0.2666666666666667,"{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+521,Boltz-1-Single-Seq,7T3E_SLB,0.4285714285714285,0.25,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2}"
+522,Boltz-1-Single-Seq,7ZF0_DHR,0.5,0.33333333333333326,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 3}"
+523,Boltz-1-Single-Seq,7X5N_5M5,0.0,0.2777777777777778,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+524,Boltz-1-Single-Seq,7VQ9_ISY,1.3333333333333335,0.07692307692307687,"{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+525,Boltz-1-Single-Seq,7TYP_KUR,0.5,0.2727272727272727,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 5, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 2, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+526,Boltz-1-Single-Seq,7XJN_NSD,0.3333333333333333,0.6666666666666667,"{'UNL:ASP:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 5, 'UNL:TRP:VdWContact': 4, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+527,Boltz-1-Single-Seq,8HFN_XGC,0.16666666666666666,0.17647058823529405,"{'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+528,Boltz-1-Single-Seq,8AUH_L9I,0.5,0.25,"{'UNL:ALA:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:CYS:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+529,Boltz-1-Single-Seq,7W06_ITN,0.5,0.11111111111111105,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 2}"
+530,Boltz-1-Single-Seq,7UAS_MBU,0.0,0.25,"{'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 2, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ASP:Hydrophobic': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+531,Boltz-1-Single-Seq,8GFD_ZHR,0.25,0.3333333333333333,"{'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+532,Boltz-1-Single-Seq,7UQ3_O2U,0.0,0.09090909090909091,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+533,Boltz-1-Single-Seq,7USH_82V,0.0,0.18181818181818182,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}"
+534,Boltz-1-Single-Seq,7XG5_PLP,0.0,0.30000000000000004,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}"
+535,Boltz-1-Single-Seq,7QHL_D5P,0.5,0.1666666666666667,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+536,Boltz-1-Single-Seq,7Q5I_I0F,0.14285714285714285,0.3333333333333334,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}"
+537,Boltz-1-Single-Seq,8DKO_TFB,0.0,0.16666666666666666,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+538,Boltz-1-Single-Seq,8G6P_API,0.1111111111111111,0.09090909090909094,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:HBDonor': 2, 'UNL:LYS:VdWContact': 2, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1}"
+539,Boltz-1-Single-Seq,7ULC_56B,0.3333333333333333,0.19999999999999996,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+540,Boltz-1-Single-Seq,7SFO_98L,0.5,0.25,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1}"
+541,Boltz-1-Single-Seq,8DP2_UMA,0.0,0.06666666666666665,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}"
+542,Boltz-1-Single-Seq,7XFA_D9J,0.0,0.4000000000000001,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}"
+543,Boltz-1-Single-Seq,7WDT_NGS,0.16666666666666669,0.5555555555555556,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+544,Boltz-1-Single-Seq,7ZHP_IQY,0.0,0.21052631578947367,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+545,Boltz-1-Single-Seq,7W05_GMP,0.39999999999999997,0.1111111111111111,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+546,Boltz-1-Single-Seq,7UJF_R3V,0.5,0.2272727272727272,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 9, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+547,Boltz-1-Single-Seq,8AIE_M7L,0.5,0.3,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 3, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 5, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 3, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+548,Boltz-1-Single-Seq,8EYE_X4I,0.25,0.25,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 5, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 5, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+549,Boltz-1-Single-Seq,7UY4_SMI,0.3333333333333333,0.25000000000000006,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+550,Boltz-1-Single-Seq,7UMW_NAD,0.2857142857142857,0.05263157894736836,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:HBAcceptor': 2, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBAcceptor': 2, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+551,Boltz-1-Single-Seq,7U3J_L6U,0.1428571428571429,0.15789473684210525,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 3}"
+552,Boltz-1-Single-Seq,7QGP_DJ8,0.0,0.21052631578947362,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+553,Boltz-1-Single-Seq,7FT9_4MB,0.0,0.16666666666666669,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+554,Boltz-1-Single-Seq,7TM6_GPJ,0.4285714285714286,0.75,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 3, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 2}"
+555,Boltz-1-Single-Seq,7WQQ_5Z6,0.5,0.19999999999999998,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 5, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 4, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 4, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+556,Boltz-1-Single-Seq,7WL4_JFU,0.0,0.11111111111111105,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+557,Boltz-1-Single-Seq,7Z2O_IAJ,0.0,0.23076923076923078,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}"
+558,Boltz-1-Single-Seq,8FLV_ZB9,0.0,0.15,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+559,Boltz-1-Single-Seq,7Z7F_IF3,0.3333333333333333,0.09090909090909094,"{'UNL:ASP:VdWContact': 2, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+560,Boltz-1-Single-Seq,7TUO_KL9,0.25,0.48000000000000004,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+561,Boltz-1-Single-Seq,7ZL5_IWE,0.0,0.5833333333333333,"{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 2, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1}"
+562,Boltz-1-Single-Seq,8F8E_XJI,0.0,0.49999999999999994,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+563,Boltz-1-Single-Seq,7WCF_ACP,0.0,0.11111111111111113,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 4, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 3, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+564,Boltz-1-Single-Seq,8D5D_5DK,0.33333333333333337,0.11764705882352944,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+565,Boltz-1-Single-Seq,7TBU_S3P,0.39999999999999997,0.5,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 5, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1}"
+566,Boltz-1-Single-Seq,8AP0_PRP,0.11111111111111116,0.25,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+567,Boltz-1-Single-Seq,7UXS_OJC,0.0,0.2857142857142856,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 4, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1}"
+568,Boltz-1-Single-Seq,7X9K_8OG,0.125,0.0,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+569,Boltz-1-Single-Seq,8BOM_QU6,0.0,0.09523809523809534,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 4, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+570,Boltz-1-Single-Seq,5SIS_JSM,0.0,0.16666666666666669,"{'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+571,Boltz-1-Single-Seq,5SD5_HWI,0.5,0.3076923076923078,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+572,Boltz-1-Single-Seq,7R3D_APR,0.0,0.33333333333333337,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 4}","{'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 4}"
+573,Boltz-1-Single-Seq,7WJB_BGC,0.0,0.16666666666666666,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+574,Boltz-1-Single-Seq,7UTW_NAI,0.0,0.0625,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 3}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 3}"
+575,Boltz-1-Single-Seq,7QPP_VDX,0.25,0.125,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+576,Boltz-1-Single-Seq,7VKZ_NOJ,0.8,0.125,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 2}"
+577,Boltz-1-Single-Seq,8FAV_4Y5,0.6000000000000001,0.1363636363636363,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:Hydrophobic': 4, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 3, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+578,Boltz-1-Single-Seq,8CSD_C5P,0.6,0.2727272727272728,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 2, 'UNL:SER:VdWContact': 3, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+579,Boltz-1-Single-Seq,7SIU_9ID,0.0,0.4210526315789473,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+580,Boltz-1-Single-Seq,7QHG_T3B,0.4,0.20833333333333337,"{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 3, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 3}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+581,Boltz-1,8AAU_LH0,0.0,0.3571428571428571,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+582,Boltz-1,7UAW_MF6,0.4999999999999999,0.3,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+583,Boltz-1,7UJ5_DGL,0.4285714285714286,0.24999999999999997,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+584,Boltz-1,7UYB_OK0,0.0,0.23076923076923084,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+585,Boltz-1,7U0U_FK5,0.5,0.3214285714285714,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 5, 'UNL:PHE:VdWContact': 5, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 3}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU-:Hydrophobic': 1, 'UNL:GLU-:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE-:Hydrophobic': 1, 'UNL:PHE-:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:PRO-:Hydrophobic': 1, 'UNL:TRP-:HBAcceptor': 1, 'UNL:TRP-:Hydrophobic': 1, 'UNL:TRP-:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+586,Boltz-1,8D19_GSH,0.39999999999999997,0.5454545454545456,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+587,Boltz-1,8C3N_ADP,0.30000000000000004,0.22222222222222215,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+588,Boltz-1,7XQZ_FPF,0.0,0.15789473684210525,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+589,Boltz-1,7TXK_LW8,0.5,0.23529411764705888,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+590,Boltz-1,7R59_I5F,0.0,0.1111111111111111,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+591,Boltz-1,7QFM_AY3,0.6666666666666667,0.4375,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+592,Boltz-1,8DSC_NCA,0.0,0.5,"{'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1}"
+593,Boltz-1,7XBV_APC,0.0,0.16666666666666663,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+594,Boltz-1,7ZDY_6MJ,0.5,0.16666666666666663,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 3}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+595,Boltz-1,7V14_ORU,0.0,0.1538461538461539,"{'UNL:ALA:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+596,Boltz-1,7Q27_8KC,0.25,0.3529411764705882,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+597,Boltz-1,8DHG_T78,0.3333333333333333,0.09999999999999987,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+598,Boltz-1,8EXL_799,0.25,0.23809523809523808,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}"
+599,Boltz-1,7THI_PGA,0.6666666666666666,0.33333333333333326,"{'UNL:ARG:VdWContact': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+600,Boltz-1,7XPO_UPG,0.25,0.33333333333333326,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+601,Boltz-1,7TE8_P0T,0.0,0.36363636363636365,"{'UNL:ALA:Hydrophobic': 4, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 3, 'UNL:ASN:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+602,Boltz-1,7QF4_RBF,0.0,0.0625,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 4, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}"
+603,Boltz-1,7UJ4_OQ4,0.5,0.25,"{'UNL:ALA:Hydrophobic': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+604,Boltz-1,8EAB_VN2,0.0,0.4166666666666665,"{'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:HBAcceptor': 2, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:HBAcceptor': 2, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+605,Boltz-1,7TH4_FFO,0.1428571428571429,0.39999999999999997,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+606,Boltz-1,7YZU_DO7,0.16666666666666666,0.5000000000000001,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 2}"
+607,Boltz-1,8B8H_OJQ,0.29999999999999993,0.05263157894736842,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}"
+608,Boltz-1,7TOM_5AD,0.39999999999999997,0.22222222222222224,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+609,Boltz-1,7VWF_K55,0.33333333333333337,0.13043478260869568,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:Hydrophobic': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 1}"
+610,Boltz-1,7XI7_4RI,0.3333333333333333,0.11111111111111116,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+611,Boltz-1,7WPW_F15,0.0,0.3125,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+612,Boltz-1,8SLG_G5A,0.33333333333333326,0.2727272727272727,"{'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 4, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 3, 'UNL:GLU:VdWContact': 5, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+613,Boltz-1,7SZA_DUI,0.6000000000000001,0.0,"{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+614,Boltz-1,7T3E_SLB,0.3333333333333333,0.19999999999999998,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2}"
+615,Boltz-1,7ZF0_DHR,0.5,0.2,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 3}"
+616,Boltz-1,7X5N_5M5,0.25,0.16666666666666669,"{'UNL:ARG:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+617,Boltz-1,7VQ9_ISY,1.0,0.07692307692307687,"{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+618,Boltz-1,8HFN_XGC,0.16666666666666666,0.11764705882352942,"{'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+619,Boltz-1,8AUH_L9I,0.5,0.25,"{'UNL:ALA:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:CYS:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+620,Boltz-1,7W06_ITN,0.2857142857142857,0.3,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 2}"
+621,Boltz-1,7UAS_MBU,0.0,0.19999999999999996,"{'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 2, 'UNL:CYS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ASP:Hydrophobic': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+622,Boltz-1,8GFD_ZHR,0.25,0.3125,"{'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+623,Boltz-1,7UQ3_O2U,0.0,0.09090909090909091,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+624,Boltz-1,7USH_82V,0.0,0.18181818181818182,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}"
+625,Boltz-1,7XG5_PLP,0.0,0.30000000000000004,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}"
+626,Boltz-1,7QHL_D5P,0.6666666666666666,1.0952380952380953,"{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 3, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 3}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+627,Boltz-1,7Q5I_I0F,0.2857142857142857,0.38461538461538464,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1}"
+628,Boltz-1,8DKO_TFB,0.0,0.2,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+629,Boltz-1,8G6P_API,0.22222222222222215,0.09090909090909094,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:HBDonor': 2, 'UNL:LYS:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1}"
+630,Boltz-1,7ULC_56B,0.0,0.19999999999999996,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}"
+631,Boltz-1,7SFO_98L,0.5,0.1875,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 4, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1}"
+632,Boltz-1,8DP2_UMA,0.2222222222222222,0.06666666666666665,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}"
+633,Boltz-1,7XFA_D9J,0.0,0.4000000000000001,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}"
+634,Boltz-1,7WDT_NGS,0.8,0.7777777777777778,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+635,Boltz-1,7ZHP_IQY,0.0,0.21052631578947367,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+636,Boltz-1,7W05_GMP,0.2,0.25,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+637,Boltz-1,7UJF_R3V,0.0,0.2727272727272727,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+638,Boltz-1,8AIE_M7L,1.0,0.25000000000000006,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 3, 'UNL:THR:VdWContact': 5, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 3, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+639,Boltz-1,8EYE_X4I,0.1428571428571429,0.125,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 5, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 5, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+640,Boltz-1,7UY4_SMI,0.3333333333333333,0.36363636363636365,"{'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+641,Boltz-1,7UMW_NAD,0.2857142857142857,0.05555555555555555,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBAcceptor': 2, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBAcceptor': 2, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+642,Boltz-1,7U3J_L6U,0.14285714285714285,0.04999999999999999,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 3}"
+643,Boltz-1,7QGP_DJ8,0.0,0.2631578947368421,"{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+644,Boltz-1,7FT9_4MB,0.3333333333333333,0.21428571428571427,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+645,Boltz-1,7TM6_GPJ,0.8333333333333333,0.375,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 3, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 2}"
+646,Boltz-1,7WQQ_5Z6,0.5,0.23076923076923078,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 4, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:Hydrophobic': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 4, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+647,Boltz-1,7WL4_JFU,0.0,0.17647058823529416,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+648,Boltz-1,7Z2O_IAJ,0.0,0.15384615384615385,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}"
+649,Boltz-1,8FLV_ZB9,0.0,0.19999999999999993,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+650,Boltz-1,7Z7F_IF3,0.6666666666666667,0.29999999999999993,"{'UNL:ASP:VdWContact': 2, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 2, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}"
+651,Boltz-1,7TUO_KL9,0.3333333333333333,0.5416666666666666,"{'UNL:ARG:Hydrophobic': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+652,Boltz-1,7ZL5_IWE,0.0,0.7272727272727273,"{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 6, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1}"
+653,Boltz-1,8F8E_XJI,0.3333333333333333,0.6499999999999999,"{'UNL:ALA:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+654,Boltz-1,7ZOC_T8E,0.0,0.2500000000000001,"{'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 4, 'UNL:HIS:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+655,Boltz-1,7WCF_ACP,0.0,0.10526315789473689,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 4, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 3, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+656,Boltz-1,8D5D_5DK,0.6000000000000001,0.1875,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+657,Boltz-1,7TBU_S3P,0.2857142857142857,0.909090909090909,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 2, 'UNL:LYS:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 4, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1}"
+658,Boltz-1,8AP0_PRP,0.16666666666666669,0.2222222222222222,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+659,Boltz-1,7UXS_OJC,0.0,0.38461538461538447,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 4, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1}"
+660,Boltz-1,7X9K_8OG,0.125,0.07692307692307693,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+661,Boltz-1,8BOM_QU6,0.0,0.09523809523809534,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 4, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+662,Boltz-1,5SIS_JSM,0.5,0.11764705882352941,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+663,Boltz-1,5SD5_HWI,0.25,0.3571428571428572,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+664,Boltz-1,7R3D_APR,0.2,0.5454545454545455,"{'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 2, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 5}","{'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 4}"
+665,Boltz-1,7WJB_BGC,0.3333333333333334,0.2857142857142857,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+666,Boltz-1,7UTW_NAI,0.0,0.1875,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 3}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 3}"
+667,Boltz-1,7QPP_VDX,0.5,0.1875,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+668,Boltz-1,7VKZ_NOJ,0.5,0.25,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 2}"
+669,Boltz-1,8CSD_C5P,0.5,0.16666666666666669,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 2, 'UNL:SER:VdWContact': 3, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+670,Boltz-1,7SIU_9ID,0.3333333333333333,0.6,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+671,Boltz-1,7QHG_T3B,0.4,0.19999999999999993,"{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 5, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+672,AF3-Single-Seq,7UAW_MF6,1.2857142857142856,1.1666666666666667,"{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+673,AF3-Single-Seq,7UJ5_DGL,0.5555555555555556,0.39999999999999997,"{'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+674,AF3-Single-Seq,7UYB_OK0,0.3333333333333333,0.17647058823529416,"{'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
+675,AF3-Single-Seq,7U0U_FK5,0.3333333333333333,0.4137931034482759,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 5, 'UNL:PHE:VdWContact': 5, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ASN:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU-:Hydrophobic': 1, 'UNL:GLU-:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE-:Hydrophobic': 1, 'UNL:PHE-:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:PRO-:Hydrophobic': 1, 'UNL:TRP-:HBAcceptor': 1, 'UNL:TRP-:Hydrophobic': 1, 'UNL:TRP-:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+676,AF3-Single-Seq,8D19_GSH,0.3333333333333333,0.2857142857142858,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1}"
+677,AF3-Single-Seq,8C3N_ADP,0.14285714285714285,0.44444444444444436,"{'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1}"
+678,AF3-Single-Seq,8A1H_DLZ,0.5,1.125,"{'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 3, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
+679,AF3-Single-Seq,7XQZ_FPF,0.8,0.4500000000000001,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+680,AF3-Single-Seq,7TXK_LW8,0.3333333333333333,0.5714285714285714,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 4, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+681,AF3-Single-Seq,7QFM_AY3,0.3333333333333333,0.14285714285714282,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+682,AF3-Single-Seq,8DSC_NCA,0.0,0.6666666666666665,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1}"
+683,AF3-Single-Seq,7XBV_APC,0.1111111111111111,0.5,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+684,AF3-Single-Seq,7ZDY_6MJ,0.0,0.4444444444444445,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+685,AF3-Single-Seq,7V14_ORU,0.0,0.5,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 4, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+686,AF3-Single-Seq,7Q27_8KC,0.8,0.40000000000000013,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+687,AF3-Single-Seq,7THI_PGA,0.2222222222222222,0.6666666666666666,"{'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 3, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 5}","{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:HBDonor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+688,AF3-Single-Seq,7XPO_UPG,0.9999999999999999,0.4285714285714285,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+689,AF3-Single-Seq,7TE8_P0T,0.3333333333333333,0.5238095238095237,"{'UNL:ALA:Hydrophobic': 4, 'UNL:ALA:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 2, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 5, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 3, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+690,AF3-Single-Seq,7UJ4_OQ4,0.0,0.6500000000000001,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+691,AF3-Single-Seq,8EAB_VN2,0.25,0.4782608695652173,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 6}","{'UNL:ILE:Hydrophobic': 4, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:HBAcceptor': 2, 'UNL:LYS:Hydrophobic': 2, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}"
+692,AF3-Single-Seq,7TH4_FFO,0.16666666666666663,0.5555555555555556,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+693,AF3-Single-Seq,8D39_QDB,0.3333333333333333,0.14285714285714282,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+694,AF3-Single-Seq,7YZU_DO7,0.8333333333333334,0.2666666666666666,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 2}"
+695,AF3-Single-Seq,8B8H_OJQ,0.49999999999999994,0.5,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}"
+696,AF3-Single-Seq,7TOM_5AD,0.5999999999999999,0.5882352941176471,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 3, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+697,AF3-Single-Seq,7XI7_4RI,0.0,0.4285714285714286,"{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+698,AF3-Single-Seq,7WPW_F15,0.5,0.3125,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+699,AF3-Single-Seq,8SLG_G5A,1.0,0.375,"{'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 3, 'UNL:GLU:VdWContact': 5, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+700,AF3-Single-Seq,7SZA_DUI,0.6000000000000001,0.3125,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+701,AF3-Single-Seq,7T3E_SLB,0.6666666666666666,0.4000000000000001,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2}"
+702,AF3-Single-Seq,8G0V_YHT,0.5714285714285715,0.3333333333333333,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+703,AF3-Single-Seq,7XRL_FWK,0.5,0.25,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+704,AF3-Single-Seq,7VQ9_ISY,0.19999999999999996,0.6000000000000001,"{'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:MET:Hydrophobic': 2, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
+705,AF3-Single-Seq,8AQL_PLG,1.0,0.5384615384615383,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 4, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+706,AF3-Single-Seq,8HFN_XGC,0.6666666666666667,0.5454545454545454,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 6, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+707,AF3-Single-Seq,7W06_ITN,1.2000000000000002,1.1428571428571428,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 2}"
+708,AF3-Single-Seq,7UAS_MBU,0.0,0.29411764705882354,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ASP:Hydrophobic': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+709,AF3-Single-Seq,8GFD_ZHR,0.3333333333333333,0.21428571428571425,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+710,AF3-Single-Seq,7UQ3_O2U,0.5,0.125,"{'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+711,AF3-Single-Seq,7XG5_PLP,0.49999999999999994,0.2142857142857142,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}"
+712,AF3-Single-Seq,8G6P_API,0.9999999999999999,0.625,"{'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1}"
+713,AF3-Single-Seq,8DP2_UMA,0.5,0.23529411764705876,"{'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1}"
+714,AF3-Single-Seq,7XFA_D9J,0.3333333333333333,0.5714285714285714,"{'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}"
+715,AF3-Single-Seq,7WDT_NGS,0.6000000000000001,0.4285714285714286,"{'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 3, 'UNL:TRP:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+716,AF3-Single-Seq,8AEM_LVF,0.0,0.2857142857142857,"{'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:MET:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+717,AF3-Single-Seq,7W05_GMP,0.5714285714285715,0.4,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
+718,AF3-Single-Seq,8AIE_M7L,1.2,0.3076923076923076,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 3, 'UNL:THR:HBDonor': 2, 'UNL:THR:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+719,AF3-Single-Seq,8EYE_X4I,0.5714285714285715,0.4000000000000002,"{'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 2, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 5, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+720,AF3-Single-Seq,7UMW_NAD,0.25,0.4761904761904762,"{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 4, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBAcceptor': 2, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 3, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+721,AF3-Single-Seq,7U3J_L6U,0.8333333333333334,0.2857142857142858,"{'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 3}"
+722,AF3-Single-Seq,7QGP_DJ8,0.3333333333333333,0.11538461538461547,"{'UNL:ALA:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+723,AF3-Single-Seq,7WQQ_5Z6,0.3333333333333333,0.4705882352941177,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 5, 'UNL:LEU:VdWContact': 5, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2}","{'UNL:ARG:Hydrophobic': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 4, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+724,AF3-Single-Seq,7TSF_H4B,0.3333333333333333,0.22222222222222227,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}"
+725,AF3-Single-Seq,7TUO_KL9,0.5,0.45000000000000007,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:Hydrophobic': 3, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+726,AF3-Single-Seq,7ZL5_IWE,0.3333333333333333,0.6875,"{'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 2, 'UNL:HIS:VdWContact': 6, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1}"
+727,AF3-Single-Seq,8F8E_XJI,0.0,0.44444444444444436,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+728,AF3-Single-Seq,7ZOC_T8E,0.0,0.1875,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ASN:Hydrophobic': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 4, 'UNL:HIS:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2}"
+729,AF3-Single-Seq,7WCF_ACP,0.4285714285714286,0.18181818181818182,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 3, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}"
+730,AF3-Single-Seq,8D5D_5DK,0.8333333333333334,0.23809523809523808,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 3, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+731,AF3-Single-Seq,7TBU_S3P,0.6000000000000001,0.4,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:SER:HBAcceptor': 3, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1}"
+732,AF3-Single-Seq,7TB0_UD1,0.375,0.5263157894736843,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 2}"
+733,AF3-Single-Seq,8AP0_PRP,0.22222222222222215,0.22222222222222232,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBAcceptor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 3, 'UNL:THR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}"
+734,AF3-Single-Seq,7UXS_OJC,0.5714285714285715,0.2941176470588236,"{'UNL:ALA:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 3, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1}"
+735,AF3-Single-Seq,7X9K_8OG,0.875,0.20000000000000007,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+736,AF3-Single-Seq,5SD5_HWI,0.5,0.17647058823529416,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 4}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
+737,AF3-Single-Seq,7WJB_BGC,0.75,0.5714285714285714,"{'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:VdWContact': 2, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
+738,AF3-Single-Seq,7UTW_NAI,0.375,0.2631578947368421,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 2, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 2, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 3}"
+739,AF3-Single-Seq,8A2D_KXY,0.5,0.4074074074074075,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:THR:Hydrophobic': 3, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3}"
+740,AF3-Single-Seq,7VKZ_NOJ,0.5,0.22222222222222227,"{'UNL:ALA:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 2}"
+741,AF3-Single-Seq,8CSD_C5P,0.5,0.1875,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 2, 'UNL:SER:VdWContact': 3, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 2, 'UNL:SER:VdWContact': 3, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+742,AF3-Single-Seq,7SIU_9ID,0.5,0.3684210526315788,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 4, 'UNL:TRP:VdWContact': 4, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+743,AF3-Single-Seq,8HO0_3ZI,0.0,0.17647058823529405,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1}","{'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+744,AF3,8AAU_LH0,0.0,0.4666666666666666,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+745,AF3,7UAW_MF6,0.42857142857142855,0.49999999999999994,"{'UNL:ARG:HBAcceptor': 3, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 4, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 4, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:VdWContact': 1, 'UNL:THR:VdWContact': 1}"
+746,AF3,7UJ5_DGL,0.29999999999999993,0.09090909090909083,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+747,AF3,7UYB_OK0,0.0,0.1538461538461539,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 3, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}"
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+754,AF3,7R59_I5F,0.5,0.125,"{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
+755,AF3,7QFM_AY3,0.5,0.07692307692307693,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+756,AF3,7QTA_URI,0.0,0.25,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 2, 'UNL:HIS:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1}"
+757,AF3,8DSC_NCA,0.0,0.5,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 2, 'UNL:ASP:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1}"
+758,AF3,7XBV_APC,0.0,0.08333333333333337,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+759,AF3,7ZDY_6MJ,0.75,0.33333333333333337,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 3}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:VdWContact': 2}"
+760,AF3,7V14_ORU,0.0,0.21428571428571425,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:ILE:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+761,AF3,7Q27_8KC,0.75,0.28571428571428564,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:HBAcceptor': 3, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 2, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 4, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+762,AF3,8DHG_T78,0.3333333333333333,0.22222222222222227,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 5, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 4, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2}"
+763,AF3,8EXL_799,0.0,0.23809523809523814,"{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}"
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+766,AF3,7QF4_RBF,0.25,0.25,"{'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 4, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 3, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:Hydrophobic': 1, 'UNL:ASN:VdWContact': 3, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 4, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 2}"
+767,AF3,7UJ4_OQ4,0.0,0.16666666666666669,"{'UNL:ALA:Hydrophobic': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}"
+768,AF3,7TH4_FFO,0.25,0.16666666666666669,"{'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+769,AF3,8D39_QDB,0.0,0.09090909090909094,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+770,AF3,7YZU_DO7,0.33333333333333326,0.08333333333333333,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 3, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:VdWContact': 2}"
+771,AF3,8B8H_OJQ,0.29999999999999993,0.11764705882352942,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:HBDonor': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 1, 'UNL:TYR:HBDonor': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:HBAcceptor': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 3, 'UNL:VAL:Hydrophobic': 1}"
+772,AF3,7TOM_5AD,0.19999999999999996,0.11764705882352941,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 2, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
+773,AF3,7VWF_K55,0.33333333333333337,0.23809523809523808,"{'UNL:ARG:Hydrophobic': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:Hydrophobic': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 4, 'UNL:VAL:VdWContact': 1}"
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+775,AF3,7WKL_CAQ,0.0,0.09090909090909091,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:HBAcceptor': 1, 'UNL:TRP:Hydrophobic': 2, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}"
+776,AF3,7WPW_F15,0.5,0.14285714285714285,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+777,AF3,8SLG_G5A,0.28571428571428575,0.6363636363636364,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 2, 'UNL:GLU:VdWContact': 4, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:HBDonor': 1, 'UNL:THR:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 3, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 3, 'UNL:GLU:VdWContact': 5, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:HBAcceptor': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:VdWContact': 1}"
+778,AF3,7T3E_SLB,0.5,0.4444444444444444,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 2, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2}"
+779,AF3,8CNH_V6U,0.5,0.27272727272727276,"{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:HBDonor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+780,AF3,7ZF0_DHR,0.0,0.3333333333333333,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3}","{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:VAL:Hydrophobic': 3}"
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+782,AF3,7XRL_FWK,0.25,0.19999999999999996,"{'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 4, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:CYS:VdWContact': 1, 'UNL:GLY:HBDonor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 3, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
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+784,AF3,7VQ9_ISY,0.3333333333333333,0.07692307692307693,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:Hydrophobic': 1}"
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+786,AF3,7TYP_KUR,0.0,0.3636363636363636,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 6, 'UNL:PHE:VdWContact': 4, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 2, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 6, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
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+789,AF3,8AUH_L9I,0.3333333333333333,0.5,"{'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:CYS:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 2, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:VdWContact': 1}"
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+791,AF3,7UAS_MBU,0.0,0.35294117647058826,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 3, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ASP:Hydrophobic': 2, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 4, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:VdWContact': 2, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}"
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+794,AF3,7USH_82V,0.0,0.09090909090909091,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2}"
+795,AF3,7XG5_PLP,0.0,0.1,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:THR:HBAcceptor': 2, 'UNL:THR:VdWContact': 3, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:HBDonor': 1, 'UNL:VAL:VdWContact': 1}"
+796,AF3,7QHL_D5P,0.6666666666666666,0.125,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:VdWContact': 2, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
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+798,AF3,8DKO_TFB,0.5,0.33333333333333326,"{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 2, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:TYR:Hydrophobic': 2, 'UNL:TYR:VdWContact': 1}"
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+817,AF3,7WL4_JFU,0.0,0.05263157894736842,"{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 2, 'UNL:MET:Hydrophobic': 2, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
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+819,AF3,8FLV_ZB9,0.0,0.05555555555555558,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:HBAcceptor': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
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+823,AF3,8F8E_XJI,0.0,0.0,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 2, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 2, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
+824,AF3,7Q2B_M6H,0.0,0.2142857142857143,"{'UNL:CYS:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:GLU:HBDonor': 1, 'UNL:GLU:Hydrophobic': 2, 'UNL:GLU:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
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+827,AF3,7TS6_KMI,0.0,0.19999999999999998,"{'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:TRP:HBDonor': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
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+829,AF3,7TBU_S3P,0.2,0.5,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 4, 'UNL:THR:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:SER:HBAcceptor': 2, 'UNL:SER:VdWContact': 4, 'UNL:TYR:Hydrophobic': 1}"
+830,AF3,7TB0_UD1,0.5,0.11764705882352944,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 2, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:THR:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 2, 'UNL:GLY:HBAcceptor': 1, 'UNL:GLY:VdWContact': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:PRO:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:VAL:HBAcceptor': 1, 'UNL:VAL:VdWContact': 2}"
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+832,AF3,7UXS_OJC,0.6,0.19999999999999998,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 1, 'UNL:LYS:VdWContact': 2, 'UNL:PHE:VdWContact': 1, 'UNL:SER:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:HBAcceptor': 2, 'UNL:GLY:VdWContact': 2, 'UNL:LEU:HBAcceptor': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LEU:VdWContact': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:SER:VdWContact': 1, 'UNL:TRP:VdWContact': 1}"
+833,AF3,7X9K_8OG,0.125,0.07692307692307687,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:GLU:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:HBDonor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:Hydrophobic': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:HBDonor': 1, 'UNL:PHE:VdWContact': 2, 'UNL:PRO:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}"
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+836,AF3,5SD5_HWI,0.25,0.2857142857142858,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ARG:HBAcceptor': 2, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 3, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLN:Hydrophobic': 1, 'UNL:ILE:HBDonor': 2, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1}"
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+838,AF3,7WJB_BGC,0.6666666666666666,0.0,"{'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:TRP:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 2, 'UNL:ASP:VdWContact': 3, 'UNL:GLN:HBDonor': 1, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:VdWContact': 3, 'UNL:TYR:VdWContact': 1}"
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+840,AF3,8A2D_KXY,0.5,0.30434782608695654,"{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:LEU:Hydrophobic': 4, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}","{'UNL:ALA:Hydrophobic': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBDonor': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:Hydrophobic': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 2, 'UNL:THR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 3}"
+841,AF3,7QPP_VDX,0.0,0.19999999999999996,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 5, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:CYS:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:HBDonor': 1, 'UNL:HIS:VdWContact': 2, 'UNL:ILE:Hydrophobic': 2, 'UNL:LEU:Hydrophobic': 6, 'UNL:LEU:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:SER:VdWContact': 3, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 3, 'UNL:TYR:VdWContact': 2, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 1}"
+842,AF3,7VKZ_NOJ,0.14285714285714285,0.1428571428571429,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:HBDonor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:VdWContact': 2}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:VdWContact': 1, 'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASN:HBAcceptor': 1, 'UNL:ASN:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:VdWContact': 1, 'UNL:TYR:HBDonor': 1, 'UNL:TYR:VdWContact': 2}"
+843,AF3,8FAV_4Y5,0.25,0.15789473684210542,"{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 2, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TRP:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:ALA:HBAcceptor': 1, 'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:GLN:HBAcceptor': 1, 'UNL:GLN:Hydrophobic': 2, 'UNL:GLN:VdWContact': 3, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:HBAcceptor': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TRP:Hydrophobic': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 1}"
+844,AF3,8CSD_C5P,0.39999999999999997,0.5,"{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:VAL:Hydrophobic': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 2, 'UNL:GLN:VdWContact': 1, 'UNL:HIS:HBAcceptor': 1, 'UNL:HIS:Hydrophobic': 1, 'UNL:HIS:VdWContact': 1, 'UNL:LEU:HBDonor': 1, 'UNL:LEU:VdWContact': 1, 'UNL:PRO:Hydrophobic': 1, 'UNL:SER:HBAcceptor': 1, 'UNL:SER:HBDonor': 2, 'UNL:SER:VdWContact': 3, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+845,AF3,7SIU_9ID,0.0,0.6315789473684209,"{'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:ILE:Hydrophobic': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 3, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ALA:HBDonor': 1, 'UNL:ALA:Hydrophobic': 2, 'UNL:ALA:VdWContact': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:CYS:HBAcceptor': 1, 'UNL:CYS:VdWContact': 1, 'UNL:GLU:HBDonor': 1, 'UNL:GLU:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:PHE:Hydrophobic': 1, 'UNL:PHE:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 1}"
+846,AF3,7QHG_T3B,0.4,0.29166666666666663,"{'UNL:ALA:VdWContact': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 1, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 2, 'UNL:ILE:VdWContact': 1, 'UNL:LEU:Hydrophobic': 8, 'UNL:LEU:VdWContact': 5, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 2, 'UNL:PHE:Hydrophobic': 2, 'UNL:PHE:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:TYR:VdWContact': 1, 'UNL:VAL:Hydrophobic': 2, 'UNL:VAL:VdWContact': 2}","{'UNL:ARG:HBAcceptor': 1, 'UNL:ARG:Hydrophobic': 1, 'UNL:ARG:VdWContact': 1, 'UNL:ASP:HBAcceptor': 1, 'UNL:ASP:Hydrophobic': 1, 'UNL:ASP:VdWContact': 1, 'UNL:GLU:VdWContact': 1, 'UNL:GLY:VdWContact': 2, 'UNL:HIS:VdWContact': 1, 'UNL:ILE:HBAcceptor': 1, 'UNL:ILE:HBDonor': 1, 'UNL:ILE:Hydrophobic': 3, 'UNL:ILE:VdWContact': 2, 'UNL:LEU:Hydrophobic': 7, 'UNL:LEU:VdWContact': 4, 'UNL:LYS:Hydrophobic': 1, 'UNL:LYS:VdWContact': 1, 'UNL:MET:Hydrophobic': 1, 'UNL:MET:VdWContact': 1, 'UNL:PHE:Hydrophobic': 2, 'UNL:THR:HBDonor': 1, 'UNL:THR:Hydrophobic': 1, 'UNL:THR:VdWContact': 1, 'UNL:TYR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 3, 'UNL:VAL:VdWContact': 2}"
+847,AF3,8HO0_3ZI,0.0,0.18181818181818185,"{'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 1, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1}","{'UNL:GLN:Hydrophobic': 1, 'UNL:GLN:VdWContact': 1, 'UNL:LEU:Hydrophobic': 3, 'UNL:LEU:VdWContact': 2, 'UNL:LYS:VdWContact': 1, 'UNL:PHE:Hydrophobic': 3, 'UNL:PHE:VdWContact': 2, 'UNL:SER:HBDonor': 1, 'UNL:SER:VdWContact': 2, 'UNL:THR:Hydrophobic': 1, 'UNL:VAL:Hydrophobic': 1, 'UNL:VAL:VdWContact': 1}"
diff --git a/notebooks/posebusters_benchmark_structured_vs_unstructured_plif_emd_values.png b/notebooks/posebusters_benchmark_structured_vs_unstructured_plif_emd_values.png
new file mode 100644
index 00000000..b7aa002d
Binary files /dev/null and b/notebooks/posebusters_benchmark_structured_vs_unstructured_plif_emd_values.png differ
diff --git a/notebooks/posebusters_method_interaction_analysis_plotting.ipynb b/notebooks/posebusters_method_interaction_analysis_plotting.ipynb
index 86bde59e..dde7ed9f 100644
--- a/notebooks/posebusters_method_interaction_analysis_plotting.ipynb
+++ b/notebooks/posebusters_method_interaction_analysis_plotting.ipynb
@@ -88,6 +88,8 @@
     "    \"rfaa\",\n",
     "    \"chai-lab_ss\",\n",
     "    \"chai-lab\",\n",
+    "    \"boltz_ss\",\n",
+    "    \"boltz\",\n",
     "    \"alphafold3_ss\",\n",
     "    \"alphafold3\",\n",
     "]\n",
@@ -103,7 +105,7 @@
     ")\n",
     "assert os.path.exists(\n",
     "    pb_set_dir\n",
-    "), \"Please download the PoseBusters Benchmark set from `https://zenodo.org/records/14629652` before proceeding.\"\n",
+    "), \"Please download the PoseBusters Benchmark set from `https://zenodo.org/records/16791095` before proceeding.\"\n",
     "\n",
     "# PoseBusters Benchmark deposition dates\n",
     "pb_deposition_dates_filepath = \"posebusters_benchmark_complex_pdb_deposition_dates.csv\"\n",
@@ -134,6 +136,8 @@
     "    \"rfaa\": \"RFAA\",\n",
     "    \"chai-lab_ss\": \"Chai-1-Single-Seq\",\n",
     "    \"chai-lab\": \"Chai-1\",\n",
+    "    \"boltz_ss\": \"Boltz-1-Single-Seq\",\n",
+    "    \"boltz\": \"Boltz-1\",\n",
     "    \"alphafold3_ss\": \"AF3-Single-Seq\",\n",
     "    \"alphafold3\": \"AF3\",\n",
     "}\n",
diff --git a/notebooks/posebusters_method_interaction_analysis_plotting.py b/notebooks/posebusters_method_interaction_analysis_plotting.py
index b38e313d..20707235 100644
--- a/notebooks/posebusters_method_interaction_analysis_plotting.py
+++ b/notebooks/posebusters_method_interaction_analysis_plotting.py
@@ -53,6 +53,8 @@
     "rfaa",
     "chai-lab_ss",
     "chai-lab",
+    "boltz_ss",
+    "boltz",
     "alphafold3_ss",
     "alphafold3",
 ]
@@ -68,7 +70,7 @@
 )
 assert os.path.exists(
     pb_set_dir
-), "Please download the PoseBusters Benchmark set from `https://zenodo.org/records/14629652` before proceeding."
+), "Please download the PoseBusters Benchmark set from `https://zenodo.org/records/16791095` before proceeding."
 
 # PoseBusters Benchmark deposition dates
 pb_deposition_dates_filepath = "posebusters_benchmark_complex_pdb_deposition_dates.csv"
@@ -99,6 +101,8 @@
     "rfaa": "RFAA",
     "chai-lab_ss": "Chai-1-Single-Seq",
     "chai-lab": "Chai-1",
+    "boltz_ss": "Boltz-1-Single-Seq",
+    "boltz": "Boltz-1",
     "alphafold3_ss": "AF3-Single-Seq",
     "alphafold3": "AF3",
 }
diff --git a/posebench/__init__.py b/posebench/__init__.py
index 0c7eeb80..c96c6d76 100644
--- a/posebench/__init__.py
+++ b/posebench/__init__.py
@@ -14,8 +14,9 @@
     "dynamicbind": "DynamicBind",
     "neuralplexer": "NeuralPLexer",
     "flowdock": "FlowDock",
-    "rfaa": "RFAA",
+    "rfaa": "RoseTTAFold-All-Atom",
     "chai-lab": "chai-lab",
+    "boltz": "boltz",
     "alphafold3": "alphafold3",
     "vina": "Vina",
     "tulip": "TULIP",
@@ -113,7 +114,7 @@ def resolve_method_protein_dir(
             "results",
             f"{dataset}{pocket_only_suffix}",
         )
-    elif method in ["neuralplexer", "flowdock", "rfaa", "chai-lab", "alphafold3"]:
+    elif method in ["neuralplexer", "flowdock", "rfaa", "chai-lab", "boltz", "alphafold3"]:
         return os.path.join(
             "forks",
             METHOD_TITLE_MAPPING.get(method, method),
@@ -165,6 +166,7 @@ def resolve_method_ligand_dir(
         "flowdock",
         "rfaa",
         "chai-lab",
+        "boltz",
         "alphafold3",
         "tulip",
     ]:
@@ -176,6 +178,7 @@ def resolve_method_ligand_dir(
                 "flowdock",
                 "rfaa",
                 "chai-lab",
+                "boltz",
                 "alphafold3",
                 "tulip",
             ]
@@ -250,6 +253,7 @@ def resolve_method_output_dir(
         "flowdock",
         "rfaa",
         "chai-lab",
+        "boltz",
         "alphafold3",
         "tulip",
     ]:
@@ -261,6 +265,7 @@ def resolve_method_output_dir(
                 "flowdock",
                 "rfaa",
                 "chai-lab",
+                "boltz",
                 "alphafold3",
                 "tulip",
             ]
@@ -321,6 +326,7 @@ def resolve_method_input_csv_path(
         "flowdock",
         "rfaa",
         "chai-lab",
+        "boltz",
         "alphafold3",
         "vina",
         "tulip",
diff --git a/posebench/analysis/complex_alignment.py b/posebench/analysis/complex_alignment.py
index 22334ecd..9fe6171d 100644
--- a/posebench/analysis/complex_alignment.py
+++ b/posebench/analysis/complex_alignment.py
@@ -328,6 +328,7 @@ def main(cfg: DictConfig):
             "flowdock",
             "rfaa",
             "chai-lab",
+            "boltz",
             "alphafold3",
         ]:
             output_dir = Path(str(output_dir).replace("_relaxed", ""))
@@ -374,6 +375,20 @@ def main(cfg: DictConfig):
                     and "_LIG_" not in file.stem
                 ]
             )
+        elif cfg.method == "boltz":
+            output_ligand_files = list(
+                output_dir.rglob(f"*_model_{cfg.rank_to_align - 1}_ligand*{config}.sdf")
+            )
+            output_ligand_files = sorted(
+                [
+                    file
+                    for file in output_ligand_files
+                    if config == "_relaxed"
+                    or (config == "" and "_relaxed" not in file.stem)
+                    and "_aligned" not in file.stem
+                    and "_LIG" not in file.stem
+                ]
+            )
         elif cfg.method == "alphafold3":
             output_ligand_files = list(output_dir.rglob(f"*_model_ligand{config}.sdf"))
             output_ligand_files = sorted(
@@ -431,6 +446,18 @@ def main(cfg: DictConfig):
                     and "_aligned" not in file.stem
                 ]
             )
+        elif cfg.method == "boltz":
+            output_protein_files = list(
+                output_dir.rglob(f"*_model_{cfg.rank_to_align - 1}_protein*.pdb")
+            )
+            output_protein_files = sorted(
+                [
+                    file
+                    for file in output_protein_files
+                    if (config == "_relaxed" or (config == "" and "_relaxed" not in file.stem))
+                    and "_aligned" not in file.stem
+                ]
+            )
         elif cfg.method == "alphafold3":
             output_protein_files = list(output_dir.rglob("*_model_protein.pdb"))
             output_protein_files = sorted(
@@ -469,6 +496,19 @@ def main(cfg: DictConfig):
                         )
                     ]
                 )
+            elif cfg.method == "boltz":
+                output_protein_files = sorted(
+                    [
+                        item
+                        for item in output_dir.rglob(
+                            f"*_model_{cfg.rank_to_align - 1}_protein*.pdb"
+                        )
+                        if "_aligned" not in item.stem
+                        and any(
+                            [item.parent.stem in file.parent.stem for file in output_ligand_files]
+                        )
+                    ]
+                )
             else:
                 raise ValueError(
                     f"Number of protein files ({len(output_protein_files)}) is less than the number of ligand files ({len(output_ligand_files)})."
diff --git a/posebench/analysis/inference_analysis.py b/posebench/analysis/inference_analysis.py
index cc242ee6..63777882 100644
--- a/posebench/analysis/inference_analysis.py
+++ b/posebench/analysis/inference_analysis.py
@@ -249,7 +249,7 @@ def create_mol_table(
         with open(cfg.dockgen_test_ids_filepath) as f:
             pdb_ids = {line.replace(" ", "-") for line in f.read().splitlines()}
 
-    if cfg.method in ["dynamicbind", "rfaa", "chai-lab", "alphafold3"]:
+    if cfg.method in ["dynamicbind", "rfaa", "chai-lab", "boltz", "alphafold3"]:
         # NOTE: for methods such as DynamicBind and RoseTTAFold-All-Atom,
         # the input CSV file needs to be created manually from the input data directory
         input_smiles_and_pdb_ids = parse_inference_inputs_from_dir(input_data_dir, pdb_ids=pdb_ids)
@@ -343,6 +343,24 @@ def create_mol_table(
                 else None
             )
         )
+    elif cfg.method == "boltz":
+        mol_table["mol_cond"] = input_table["pdb_id"].apply(
+            lambda x: (
+                list(
+                    (Path(str(inference_dir).replace("_relaxed", "")) / x).rglob(
+                        f"*_model_0_protein{'_relaxed' if relaxed_protein else ''}_aligned.pdb"
+                    )
+                )[0]
+                if len(
+                    list(
+                        (Path(str(inference_dir).replace("_relaxed", "")) / x).rglob(
+                            f"*_model_0_protein{'_relaxed' if relaxed_protein else ''}_aligned.pdb"
+                        )
+                    )
+                )
+                else None
+            )
+        )
     elif cfg.method == "alphafold3":
         mol_table["mol_cond"] = input_table["pdb_id"].apply(
             lambda x: (
@@ -503,6 +521,24 @@ def create_mol_table(
                 else None
             )
         )
+    elif cfg.method == "boltz":
+        mol_table["mol_pred"] = input_table["pdb_id"].apply(
+            lambda x: (
+                list(
+                    (Path(str(inference_dir).replace("_relaxed", "")) / x).rglob(
+                        f"*_model_0_ligand{'_relaxed' if relaxed else ''}_aligned.sdf"
+                    )
+                )[0]
+                if len(
+                    list(
+                        (Path(str(inference_dir).replace("_relaxed", "")) / x).rglob(
+                            f"*_model_0_ligand{'_relaxed' if relaxed else ''}_aligned.sdf"
+                        )
+                    )
+                )
+                else None
+            )
+        )
     elif cfg.method == "alphafold3":
         mol_table["mol_pred"] = input_table["pdb_id"].apply(
             lambda x: (
@@ -782,6 +818,30 @@ def create_mol_table(
                         else None
                     )
                 )
+            elif cfg.method == "boltz":
+                mol_table.loc[missing_pred_indices, "mol_pred"] = input_table.loc[
+                    missing_pred_indices, "pdb_id"
+                ].apply(
+                    lambda x: (
+                        glob.glob(
+                            os.path.join(
+                                Path(str(inference_dir).replace("_relaxed", "")),
+                                x,
+                                "*_model_0_ligand_aligned.sdf",
+                            )
+                        )[0]
+                        if len(
+                            glob.glob(
+                                os.path.join(
+                                    Path(str(inference_dir).replace("_relaxed", "")),
+                                    x,
+                                    "*_model_0_ligand_aligned.sdf",
+                                )
+                            )
+                        )
+                        else None
+                    )
+                )
             elif cfg.method == "alphafold3":
                 mol_table.loc[missing_pred_indices, "mol_pred"] = input_table.loc[
                     missing_pred_indices, "pdb_id"
diff --git a/posebench/analysis/inference_analysis_casp.py b/posebench/analysis/inference_analysis_casp.py
index 6631f20a..c0d4d4c8 100644
--- a/posebench/analysis/inference_analysis_casp.py
+++ b/posebench/analysis/inference_analysis_casp.py
@@ -228,7 +228,7 @@ def main(cfg: DictConfig):
         os.makedirs(scoring_results_filepath.parent, exist_ok=True)
 
         # collect analysis results
-        if os.path.exists(scoring_results_filepath) and not cfg.force_rescore:
+        if os.path.exists(scoring_results_filepath) and not cfg.force_casp15_rescore:
             logger.info(
                 f"{resolve_method_title(cfg.method)}{config} analysis results for inference directory `{output_dir}` already exist at `{scoring_results_filepath}`. Directly analyzing..."
             )
@@ -279,7 +279,7 @@ def main(cfg: DictConfig):
             )
 
         # collect bust results
-        if os.path.exists(bust_results_filepath) and not cfg.force_rescore:
+        if os.path.exists(bust_results_filepath) and not cfg.force_pb_rescore:
             logger.info(
                 f"{resolve_method_title(cfg.method)}{config} bust results for inference directory `{output_dir}` already exist at `{bust_results_filepath}`. Directly analyzing..."
             )
diff --git a/posebench/analysis/similarity_scoring.py b/posebench/analysis/similarity_scoring.py
new file mode 100644
index 00000000..0d60bc8e
--- /dev/null
+++ b/posebench/analysis/similarity_scoring.py
@@ -0,0 +1,450 @@
+# -------------------------------------------------------------------------------------------------------------------------------------
+# Following code adapted from runs-n-poses: (https://github.com/plinder-org/runs-n-poses)
+# -------------------------------------------------------------------------------------------------------------------------------------
+
+import logging
+import os
+from collections import defaultdict
+from pathlib import Path
+from typing import Optional, Tuple
+
+import numpy as np
+import pandas as pd
+import rootutils
+from plinder.core import get_config
+from plinder.core.scores import query_index
+from plinder.data.utils.annotations.aggregate_annotations import Entry
+from plinder.data.utils.annotations.get_similarity_scores import Scorer
+from rdkit import Chem, DataStructs, RDConfig
+from rdkit.Chem import AllChem, rdShapeAlign, rdShapeHelpers
+from rdkit.Chem.FeatMaps import FeatMaps
+from tqdm import tqdm
+
+rootutils.setup_root(__file__, indicator=".project-root", pythonpath=True)
+
+logging.basicConfig(format="[%(asctime)s] {%(filename)s:%(lineno)d} %(levelname)s - %(message)s")
+logger = logging.getLogger(__name__)
+
+
+PLINDER_DIR = Path(get_config().data.plinder_dir)
+MAIN_DIRECTORY = Path("scoring")
+MAIN_DIRECTORY.mkdir(exist_ok=True, parents=True)
+DIRECTORIES = {
+    "db": MAIN_DIRECTORY / "db",
+    "search": MAIN_DIRECTORY / "search",
+    "scores": MAIN_DIRECTORY / "scores",
+}
+
+
+def align_molecules_crippen(mol_ref, mol_probe, iterations=100):
+    """Align two molecules using the Crippen O3A method.
+
+    :param mol_ref: The reference molecule.
+    :param mol_probe: The probe molecule.
+    :param iterations: The number of iterations for the alignment.
+    """
+    crippenO3A = Chem.rdMolAlign.GetCrippenO3A(mol_probe, mol_ref, maxIters=iterations)
+    crippenO3A.Align()
+
+
+def align_molecules(
+    reference: Chem.Mol,
+    mobile: Chem.Mol,
+    max_preiters: int = 100,
+    max_postiters: int = 100,
+) -> Tuple[float, float, np.ndarray]:
+    """Align two molecules and return the RMSD, Tanimoto, and aligned
+    coordinates.
+
+    :param reference: The reference molecule.
+    :param mobile: The mobile molecule.
+    :param max_preiters: The maximum number of pre-alignment iterations.
+    :param max_postiters: The maximum number of post-alignment
+        iterations.
+    :return: A tuple containing the RMSD, Tanimoto, and aligned
+        coordinates.
+    """
+    align_molecules_crippen(reference, mobile, iterations=max_preiters)
+    return rdShapeAlign.AlignMol(
+        reference,
+        mobile,
+        max_preiters=max_preiters,
+        max_postiters=max_postiters,
+    )
+
+
+# Adapted from https://github.com/susanhleung/SuCOS
+# Initialize feature factory for pharmacophore scoring
+FDEF = AllChem.BuildFeatureFactory(os.path.join(RDConfig.RDDataDir, "BaseFeatures.fdef"))
+
+# Feature map parameters
+FEAT_MAP_PARAMS = {k: FeatMaps.FeatMapParams() for k in FDEF.GetFeatureFamilies()}
+
+# Feature types to keep for pharmacophore scoring
+PHARMACOPHORE_FEATURES = (
+    "Donor",
+    "Acceptor",
+    "NegIonizable",
+    "PosIonizable",
+    "ZnBinder",
+    "Aromatic",
+    "Hydrophobe",
+    "LumpedHydrophobe",
+)
+
+
+def get_feature_map_score(
+    mol_1: Chem.Mol,
+    mol_2: Chem.Mol,
+    score_mode: FeatMaps.FeatMapScoreMode = FeatMaps.FeatMapScoreMode.All,
+) -> float:
+    """Calculate the feature map score between two molecules.
+
+    :param mol_1: The first molecule.
+    :param mol_2: The second molecule.
+    :param score_mode: The scoring mode to use.
+    :return: The feature map score.
+    """
+    feat_lists = []
+    for molecule in [mol_1, mol_2]:
+        raw_feats = FDEF.GetFeaturesForMol(molecule)
+        feat_lists.append([f for f in raw_feats if f.GetFamily() in PHARMACOPHORE_FEATURES])
+
+    feat_maps = [
+        FeatMaps.FeatMap(feats=x, weights=[1] * len(x), params=FEAT_MAP_PARAMS) for x in feat_lists
+    ]
+    feat_maps[0].scoreMode = score_mode
+
+    score = feat_maps[0].ScoreFeats(feat_lists[1])
+    return score / min(feat_maps[0].GetNumFeatures(), len(feat_lists[1]))
+
+
+def get_sucos_score(
+    mol_1: Chem.Mol,
+    mol_2: Chem.Mol,
+    score_mode: FeatMaps.FeatMapScoreMode = FeatMaps.FeatMapScoreMode.All,
+) -> float:
+    """Calculate the SuCOS similarity score of two molecules.
+
+    :param mol_1: The first molecule.
+    :param mol_2: The second molecule.
+    :param score_mode: The scoring mode to use.
+    :return: The SuCOS similarity score.
+    """
+    fm_score = get_feature_map_score(mol_1, mol_2, score_mode)
+    fm_score = np.clip(fm_score, 0, 1)
+
+    protrude_dist = rdShapeHelpers.ShapeProtrudeDist(mol_1, mol_2, allowReordering=False)
+    protrude_dist = np.clip(protrude_dist, 0, 1)
+
+    return 0.5 * fm_score + 0.5 * (1 - protrude_dist)
+
+
+def get_random_conformer(
+    molecule: Chem.Mol,
+    random_seed: int = 42,
+    max_iterations: Optional[int] = None,
+) -> Optional[Chem.Conformer]:
+    """Generate a random conformer using ETKDGv3.
+
+    :param mol: Input molecule
+    :param random_seed: Random seed for reproducibility
+    :param max_iterations: Maximum number of iterations for conformer
+        generation
+    :return: Generated conformer or None if generation fails
+    """
+    params = AllChem.ETKDGv3()
+    params.randomSeed = random_seed
+    if max_iterations is not None:
+        params.maxIterations = max_iterations
+
+    mol_copy = Chem.Mol(molecule)
+    try:
+        conformer_id = AllChem.EmbedMolecule(mol_copy, params)
+        if conformer_id >= 0:
+            return mol_copy
+        return None
+    except ValueError:
+        return None
+
+
+class SimilarityScorer:
+    """Class for calculating similarity scores between systems."""
+
+    def __init__(self):
+        self.db_dir = DIRECTORIES["scores"]
+        self.training_cutoff = pd.to_datetime("2021-09-30")
+        self.output_dir = self.db_dir / "all_scores"
+        self.output_dir.mkdir(parents=True, exist_ok=True)
+        with open("new_pdb_ids.txt") as f:
+            self.new_pdb_ids = set(f.read().split(","))
+        self.fpgen = AllChem.GetRDKitFPGenerator()
+
+    def score_system_plinder(self, pdb_id: str) -> None:
+        """Score a system using PLINDER.
+
+        :param pdb_id: The PDB ID of the system to score.
+        """
+        filename = self.db_dir / f"holo_foldseek/aln/{pdb_id}.parquet"
+        if not filename.exists():
+            logger.info(f"No Foldseek file for {pdb_id}")
+            return None
+        df = pd.read_parquet(filename)
+        target_ids = set(df["target_pdb_id"])
+        entries = {}
+        for p in target_ids.intersection(self.new_pdb_ids):
+            try:
+                entries[p] = Entry.from_json(
+                    PLINDER_DIR / "systems" / p[-3:-1] / f"{p}.json"
+                ).prune(
+                    clear_non_pocket_residues=True,
+                    load_for_scoring=True,
+                    max_protein_chains=20,
+                    max_ligand_chains=20,
+                )
+            except Exception as e:
+                logger.error(f"Failed to load entry for {p} due to: {e}")
+                continue
+        scorer = Scorer(
+            entries=entries,
+            source_to_full_db_file={},
+            db_dir=self.db_dir,
+            scores_dir=Path("scores"),
+            minimum_threshold=0.0,
+        )
+        scorer.get_score_df(PLINDER_DIR, pdb_id=pdb_id, search_db="holo", overwrite=False)
+
+    def score_system_ligand(self, pdb_id: str):
+        """Score a system using ligand-based methods.
+
+        :param pdb_id: The PDB ID of the system to score.
+        """
+        plinder_score_file = self.db_dir / f"search_db=holo/{pdb_id}.parquet"
+        scores_df = pd.read_parquet(plinder_score_file)
+        system_id_pairs = set(zip(scores_df["query_system"], scores_df["target_system"]))
+        all_systems_to_load = set(scores_df["query_system"]).union(set(scores_df["target_system"]))
+        plindex = query_index(
+            columns=[
+                "system_id",
+                "system_biounit_id",
+                "ligand_instance_chain",
+                "ligand_ccd_code",
+                "ligand_rdkit_canonical_smiles",
+                "system_protein_chains_auth_id",
+            ],
+            filters=[
+                ("system_id", "in", all_systems_to_load),
+                ("ligand_is_proper", "==", True),
+            ],
+            splits=["*"],
+        ).drop(columns=["split"])
+        fps = defaultdict(dict)
+        mols = defaultdict(dict)
+        for system_id, ligand_instance_chain, smiles in tqdm(
+            zip(
+                plindex["system_id"],
+                plindex["ligand_instance_chain"],
+                plindex["ligand_rdkit_canonical_smiles"],
+            ),
+            total=len(plindex),
+            desc="getting fingerprints",
+        ):
+            try:
+                mol = Chem.MolFromSmiles(smiles)
+                mols[system_id][ligand_instance_chain] = mol
+                fps[system_id][ligand_instance_chain] = self.fpgen.GetFingerprint(mol)
+            except Exception as e:
+                logger.info(f"Failed to get fingerprint for {system_id} due to: {e}")
+                continue
+        system_id_to_protein_chains = defaultdict(set)
+        system_id_to_ligand_instance_chain = defaultdict(set)
+        for system_id, protein_chains, ligand_instance_chain in zip(
+            plindex["system_id"],
+            plindex["system_protein_chains_auth_id"],
+            plindex["ligand_instance_chain"],
+        ):
+            system_id_to_protein_chains[system_id].update(set(protein_chains))
+            system_id_to_ligand_instance_chain[system_id].add(ligand_instance_chain)
+        score_dict = defaultdict(lambda: defaultdict(list))
+        errors = []
+        for system_1, system_2 in tqdm(system_id_pairs):
+            if system_1.split("__")[1] != "1":
+                continue
+            if (
+                system_1 not in system_id_to_protein_chains
+                or system_2 not in system_id_to_protein_chains
+            ):
+                continue
+            if (
+                system_1 not in system_id_to_ligand_instance_chain
+                or system_2 not in system_id_to_ligand_instance_chain
+            ):
+                continue
+            foldseek_results = (
+                pd.read_parquet(
+                    self.db_dir / f"holo_foldseek/aln/{system_1[:4]}.parquet",
+                    filters=[
+                        ("target_pdb_id", "==", system_2[:4]),
+                        ("query_chain", "in", system_id_to_protein_chains[system_1]),
+                        ("target_chain", "in", system_id_to_protein_chains[system_2]),
+                    ],
+                    columns=["u", "t", "lddt"],
+                )
+                .sort_values(by="lddt", ascending=False)
+                .head(1)
+            )
+            if foldseek_results.empty:
+                continue
+            rotation = np.array(list(map(float, foldseek_results.u[0].split(","))))
+            translation = np.array(list(map(float, foldseek_results.t[0].split(","))))
+            for ligand_instance_chain_1 in system_id_to_ligand_instance_chain[system_1]:
+                key = (system_1, ligand_instance_chain_1)
+                try:
+                    score_dict["tanimoto"][(key, system_2)] = [
+                        max(
+                            [
+                                DataStructs.TanimotoSimilarity(
+                                    fps[system_1][ligand_instance_chain_1],
+                                    fps[system_2][ligand_instance_chain_2],
+                                )
+                                for ligand_instance_chain_2 in system_id_to_ligand_instance_chain[
+                                    system_2
+                                ]
+                            ]
+                        )
+                    ]
+                except Exception as e:
+                    errors.append((key, system_2, "tanimoto", e))
+                for ligand_instance_chain_2 in system_id_to_ligand_instance_chain[system_2]:
+                    sdf_file_1 = (
+                        PLINDER_DIR
+                        / "systems"
+                        / system_1
+                        / "ligand_files"
+                        / f"{ligand_instance_chain_1}.sdf"
+                    )
+                    sdf_file_2 = (
+                        PLINDER_DIR
+                        / "systems"
+                        / system_2
+                        / "ligand_files"
+                        / f"{ligand_instance_chain_2}.sdf"
+                    )
+                    if not sdf_file_1.exists() or not sdf_file_2.exists():
+                        continue
+                    try:
+                        # ALIGN USING FOLDSEEK
+                        mol_1 = Chem.MolFromMolFile(str(sdf_file_1))
+                        mol_2 = Chem.MolFromMolFile(str(sdf_file_2))
+                        conf = mol_2.GetConformer()
+                        coords = np.array(
+                            [list(conf.GetAtomPosition(i)) for i in range(mol_2.GetNumAtoms())]
+                        )
+                        rotated_coords = coords @ rotation.reshape(3, 3).T + translation
+                        for i in range(mol_2.GetNumAtoms()):
+                            conf.SetAtomPosition(i, rotated_coords[i])
+                        score_dict["sucos_protein"][(key, system_2)].append(
+                            get_sucos_score(mol_1, mol_2)
+                        )
+                    except Exception as e:
+                        errors.append((key, system_2, "sucos_protein", e))
+                    # ALIGN USING SHAPE
+                    try:
+                        mol_1 = Chem.MolFromMolFile(str(sdf_file_1))
+                        mol_2 = Chem.MolFromMolFile(str(sdf_file_2))
+                    except Exception:
+                        try:
+                            mol_1 = Chem.MolFromMolFile(
+                                str(sdf_file_1), sanitize=False, strictParsing=False
+                            )
+                            mol_2 = Chem.MolFromMolFile(
+                                str(sdf_file_2), sanitize=False, strictParsing=False
+                            )
+                        except Exception as e:
+                            errors.append((key, system_2, "sucos_shape", e))
+                            continue
+                    try:
+                        shape_similarity, color_similarity = align_molecules(mol_1, mol_2)
+                    except Exception as e:
+                        errors.append((key, system_2, "shape", e))
+                        continue
+                    try:
+                        score_dict["sucos_shape"][(key, system_2)].append(
+                            get_sucos_score(mol_1, mol_2)
+                        )
+                    except Exception:
+                        score_dict["sucos_shape"][(key, system_2)].append(0)
+                    score_dict["shape"][(key, system_2)].append(shape_similarity)
+                    score_dict["color"][(key, system_2)].append(color_similarity)
+
+        dfs = []
+        for metric in score_dict:
+            df = pd.DataFrame(
+                [
+                    {
+                        "query_system": key[0],
+                        "query_ligand_instance_chain": key[1],
+                        "target_system": system_2,
+                        "metric": metric,
+                        "similarity": (
+                            np.nanmax(score_dict[metric][(key, system_2)])
+                            if len(score_dict[metric][(key, system_2)]) > 0
+                            else np.nan
+                        ),
+                    }
+                    for key, system_2 in score_dict[metric]
+                ]
+            )
+            dfs.append(df)
+        if len(dfs) > 0:
+            df = (
+                pd.concat(dfs)
+                .pivot_table(
+                    index=[
+                        "query_system",
+                        "query_ligand_instance_chain",
+                        "target_system",
+                    ],
+                    columns="metric",
+                    values="similarity",
+                    observed=False,
+                )
+                .reset_index()
+            )
+            scores_df = scores_df.pivot_table(
+                index=["query_system", "target_system"],
+                columns="metric",
+                values="similarity",
+                observed=False,
+            ).reset_index()
+            scores_df = (
+                pd.merge(scores_df, df, on=["query_system", "target_system"], how="outer")
+                .reset_index(drop=True)
+                .drop_duplicates()
+            )
+            scores_df.to_parquet(self.output_dir / f"{pdb_id}.parquet", index=False)
+        if len(errors):
+            with open(self.output_dir / f"{pdb_id}.errors", "w") as f:
+                for line in errors:
+                    f.write("\t".join([str(x) for x in line]) + "\n")
+
+
+def main():
+    """Execute similarity scoring."""
+    import sys
+
+    pdb_id = sys.argv[1]
+    scorer = SimilarityScorer()
+
+    filename = DIRECTORIES["scores"] / f"holo_foldseek/aln/{pdb_id}.parquet"
+    plinder_score_file = DIRECTORIES["scores"] / f"search_db=holo/{pdb_id}.parquet"
+    output_file = DIRECTORIES["scores"] / f"scores/all_scores/{pdb_id}.parquet"
+    if filename.exists():
+        if not plinder_score_file.exists():
+            scorer.score_system_plinder(pdb_id)
+        if plinder_score_file.exists() and not output_file.exists():
+            scorer.score_system_ligand(pdb_id)
+
+
+if __name__ == "__main__":
+    main()
diff --git a/posebench/data/boltz_input_preparation.py b/posebench/data/boltz_input_preparation.py
new file mode 100644
index 00000000..df5da1ab
--- /dev/null
+++ b/posebench/data/boltz_input_preparation.py
@@ -0,0 +1,214 @@
+# -------------------------------------------------------------------------------------------------------------------------------------
+# Following code curated for PoseBench: (https://github.com/BioinfoMachineLearning/PoseBench)
+# -------------------------------------------------------------------------------------------------------------------------------------
+
+import logging
+import os
+
+import hydra
+import rootutils
+from beartype import beartype
+from beartype.typing import Any, List, Optional, Tuple
+from omegaconf import DictConfig
+
+rootutils.setup_root(__file__, indicator=".project-root", pythonpath=True)
+
+from posebench import register_custom_omegaconf_resolvers
+from posebench.utils.data_utils import (
+    extract_sequences_from_protein_structure_file,
+    parse_inference_inputs_from_dir,
+)
+
+logging.basicConfig(format="[%(asctime)s] {%(filename)s:%(lineno)d} %(levelname)s - %(message)s")
+logger = logging.getLogger(__name__)
+
+
+@beartype
+def write_scripts(
+    smiles_and_pdb_id_list: List[Tuple[Any, str]],
+    input_data_dir: str,
+    msa_dir: str | None,
+    output_scripts_path: str,
+    dataset: str,
+    pocket_only_baseline: bool = False,
+    protein_filepath: Optional[str] = None,
+    ligand_smiles: Optional[Any] = None,
+    input_id: Optional[str] = None,
+):
+    """Write a Boltz inference CSV file.
+
+    :param smiles_and_pdb_id_list: A list of tuples each containing a
+        SMILES string and a PDB ID.
+    :param input_data_dir: Path to directory of input protein-ligand
+        complex subdirectories.
+    :param msa_dir: Path to directory of MSA files.
+    :param output_scripts_path: Path to directory of output FASTA
+        sequence files.
+    :param dataset: Dataset name.
+    :param pocket_only_baseline: Whether to provide only the protein
+        pocket as a baseline experiment.
+    :param protein_filepath: Optional path to the protein structure
+        file.
+    :param ligand_smiles: Optional SMILES string of the ligand.
+    :param input_id: Optional input ID.
+    """
+    if pocket_only_baseline:
+        output_scripts_path = output_scripts_path.replace(dataset, f"{dataset}_pocket_only")
+
+    os.makedirs(output_scripts_path, exist_ok=True)
+    if protein_filepath is not None and ligand_smiles is not None:
+        input_id = (
+            "_".join(os.path.splitext(os.path.basename(protein_filepath))[0].split("_")[:2])
+            if input_id is None
+            else input_id
+        )
+        # only parse protein chains (e.g., not nucleic acids)
+        protein_sequence_list = [
+            seq
+            for seq in extract_sequences_from_protein_structure_file(protein_filepath)
+            if len(seq) > 0
+        ]
+        output_dir = os.path.join(output_scripts_path, input_id)
+        fasta_filepath = os.path.join(output_dir, f"{input_id}.fasta")
+        if os.path.exists(fasta_filepath):
+            logger.warning(
+                f"FASTA file already exists for input ID {input_id}. Skipping writing to file..."
+            )
+            return
+        for chain_index, sequence in enumerate(protein_sequence_list, start=1):
+            chain_id = chr(ord("A") + chain_index - 1)
+            msa_path = (
+                os.path.join(msa_dir, f"{input_id}_chain_{chain_index - 1}.csv")
+                if msa_dir is not None
+                else None
+            )
+            msa_suffix = msa_path if msa_path is not None else "empty"
+            with open(fasta_filepath, "a") as f:
+                f.write(f">{chain_id}|protein|{msa_suffix}\n{sequence}\n")
+        # NOTE: in the inference setting, `:` is used to separate ligand SMILES strings
+        for chain_index, smiles in enumerate(ligand_smiles.split(":"), start=1):
+            chain_id = chr(ord("A") + chain_index - 1)
+            with open(fasta_filepath, "a") as f:
+                f.write(f">{chain_id}|smiles\n{smiles}\n")
+    else:
+        for smiles_string, pdb_id in smiles_and_pdb_id_list:
+            output_dir = os.path.join(output_scripts_path, pdb_id)
+            os.makedirs(output_dir, exist_ok=True)
+            casp_dataset_requested = os.path.basename(input_data_dir) == "targets"
+            if casp_dataset_requested:
+                protein_filepath = os.path.join(input_data_dir, f"{pdb_id}_lig.pdb")
+            else:
+                if pocket_only_baseline:
+                    protein_filepath = os.path.join(
+                        input_data_dir,
+                        f"{dataset}_holo_aligned_predicted_structures_bs_cropped",
+                        f"{pdb_id}_holo_aligned_predicted_protein.pdb",
+                    )
+                    if not os.path.exists(protein_filepath):
+                        logger.warning(
+                            f"Protein structure file not found for PDB ID {pdb_id}. Skipping..."
+                        )
+                        continue
+                else:
+                    protein_id = pdb_id.split("_")[0] if dataset == "dockgen" else pdb_id
+                    protein_file_suffix = "_processed" if dataset == "dockgen" else "_protein"
+                    protein_filepath = os.path.join(
+                        input_data_dir, pdb_id, f"{protein_id}{protein_file_suffix}.pdb"
+                    )
+            protein_sequence_list = [
+                seq
+                for seq in extract_sequences_from_protein_structure_file(protein_filepath)
+                if len(seq) > 0
+            ]
+            ligand_smiles_list = smiles_string.split(".")
+            fasta_filepath = os.path.join(output_dir, f"{pdb_id}.fasta")
+            if os.path.exists(fasta_filepath):
+                logger.warning(
+                    f"FASTA file already exists for PDB ID {pdb_id}. Skipping writing to file..."
+                )
+                continue
+            same_seq_chain_mapping = {}
+            for chain_index, sequence in enumerate(protein_sequence_list, start=1):
+                if sequence not in same_seq_chain_mapping:
+                    same_seq_chain_mapping[sequence] = chain_index - 1
+                chain_id = chr(ord("A") + chain_index - 1)
+                msa_path = (
+                    # NOTE: for Boltz, identical protein sequences are mapped to the same (first) MSA chain ID of the same sequence
+                    os.path.join(msa_dir, f"{pdb_id}_chain_{same_seq_chain_mapping[sequence]}.csv")
+                    if msa_dir is not None
+                    else None
+                )
+                msa_suffix = msa_path if msa_path is not None else "empty"
+                with open(fasta_filepath, "a") as f:
+                    f.write(f">{chain_id}|protein|{msa_suffix}\n{sequence}\n")
+            for chain_index, sequence in enumerate(
+                ligand_smiles_list, start=len(protein_sequence_list) + 1
+            ):
+                chain_id = chr(ord("A") + chain_index - 1)
+                with open(fasta_filepath, "a") as f:
+                    f.write(f">{chain_id}|smiles\n{sequence}\n")
+
+
+@hydra.main(
+    version_base="1.3",
+    config_path="../../configs/data",
+    config_name="boltz_input_preparation.yaml",
+)
+def main(cfg: DictConfig):
+    """Parse a data directory containing subdirectories of protein-ligand
+    complexes and prepare corresponding inference CSV file for the Boltz model.
+
+    :param cfg: Configuration dictionary from the hydra YAML file.
+    """
+    # load ID subset if requested
+    pdb_ids = None
+    if cfg.dataset == "posebusters_benchmark" and cfg.posebusters_ccd_ids_filepath is not None:
+        assert os.path.exists(
+            cfg.posebusters_ccd_ids_filepath
+        ), f"Invalid CCD IDs file path for PoseBusters Benchmark: {os.path.exists(cfg.posebusters_ccd_ids_filepath)}."
+        with open(cfg.posebusters_ccd_ids_filepath) as f:
+            pdb_ids = set(f.read().splitlines())
+    elif cfg.dataset == "dockgen" and cfg.dockgen_test_ids_filepath is not None:
+        assert os.path.exists(
+            cfg.dockgen_test_ids_filepath
+        ), f"Invalid test IDs file path for DockGen: {os.path.exists(cfg.dockgen_test_ids_filepath)}."
+        with open(cfg.dockgen_test_ids_filepath) as f:
+            pdb_ids = {line.replace(" ", "-") for line in f.read().splitlines()}
+    elif cfg.dataset not in ["posebusters_benchmark", "astex_diverse", "dockgen", "casp15"]:
+        raise ValueError(f"Dataset `{cfg.dataset}` not supported.")
+
+    if cfg.protein_filepath is not None and cfg.ligand_smiles is None:
+        write_scripts(
+            smiles_and_pdb_id_list=[],
+            input_data_dir=cfg.input_data_dir,
+            msa_dir=cfg.msa_dir,
+            output_scripts_path=cfg.output_scripts_path,
+            dataset=cfg.dataset,
+            pocket_only_baseline=cfg.pocket_only_baseline,
+            protein_filepath=cfg.protein_filepath,
+            ligand_smiles=cfg.ligand_smiles,
+            input_id=cfg.input_id,
+        )
+    else:
+        smiles_and_pdb_id_list = parse_inference_inputs_from_dir(
+            input_data_dir=cfg.input_data_dir,
+            pdb_ids=pdb_ids,
+        )
+        write_scripts(
+            smiles_and_pdb_id_list=smiles_and_pdb_id_list,
+            input_data_dir=cfg.input_data_dir,
+            msa_dir=cfg.msa_dir,
+            output_scripts_path=cfg.output_scripts_path,
+            dataset=cfg.dataset,
+            pocket_only_baseline=cfg.pocket_only_baseline,
+            protein_filepath=cfg.protein_filepath,
+            ligand_smiles=cfg.ligand_smiles,
+            input_id=cfg.input_id,
+        )
+
+    logger.info(f"Boltz input files for dataset `{cfg.dataset}` are fully prepared for inference.")
+
+
+if __name__ == "__main__":
+    register_custom_omegaconf_resolvers()
+    main()
diff --git a/posebench/data/boltz_output_extraction.py b/posebench/data/boltz_output_extraction.py
new file mode 100644
index 00000000..71ccdc43
--- /dev/null
+++ b/posebench/data/boltz_output_extraction.py
@@ -0,0 +1,144 @@
+# -------------------------------------------------------------------------------------------------------------------------------------
+# Following code curated for PoseBench: (https://github.com/BioinfoMachineLearning/PoseBench)
+# -------------------------------------------------------------------------------------------------------------------------------------
+
+import logging
+import os
+
+import hydra
+import numpy as np
+import rootutils
+from omegaconf import DictConfig, open_dict
+
+rootutils.setup_root(__file__, indicator=".project-root", pythonpath=True)
+
+from posebench.utils.data_utils import (
+    extract_protein_and_ligands_with_prody,
+    parse_inference_inputs_from_dir,
+)
+
+logging.basicConfig(format="[%(asctime)s] {%(filename)s:%(lineno)d} %(levelname)s - %(message)s")
+logger = logging.getLogger(__name__)
+
+
+@hydra.main(
+    version_base="1.3",
+    config_path="../../configs/data",
+    config_name="boltz_output_extraction.yaml",
+)
+def main(cfg: DictConfig):
+    """Extract proteins and ligands separately from the prediction outputs."""
+    pdb_ids = None
+    if cfg.dataset == "posebusters_benchmark" and cfg.posebusters_ccd_ids_filepath is not None:
+        assert os.path.exists(
+            cfg.posebusters_ccd_ids_filepath
+        ), f"Invalid CCD IDs file path for PoseBusters Benchmark: {os.path.exists(cfg.posebusters_ccd_ids_filepath)}."
+        with open(cfg.posebusters_ccd_ids_filepath) as f:
+            pdb_ids = set(f.read().splitlines())
+    elif cfg.dataset == "dockgen" and cfg.dockgen_test_ids_filepath is not None:
+        assert os.path.exists(
+            cfg.dockgen_test_ids_filepath
+        ), f"Invalid test IDs file path for DockGen: {os.path.exists(cfg.dockgen_test_ids_filepath)}."
+        with open(cfg.dockgen_test_ids_filepath) as f:
+            pdb_ids = {line.replace(" ", "-") for line in f.read().splitlines()}
+    elif cfg.dataset not in ["posebusters_benchmark", "astex_diverse", "dockgen", "casp15"]:
+        raise ValueError(f"Dataset `{cfg.dataset}` not supported.")
+
+    if cfg.pocket_only_baseline:
+        with open_dict(cfg):
+            cfg.prediction_inputs_dir = cfg.prediction_inputs_dir.replace(
+                cfg.dataset, f"{cfg.dataset}_pocket_only"
+            )
+            cfg.prediction_outputs_dir = cfg.prediction_outputs_dir.replace(
+                cfg.dataset, f"{cfg.dataset}_pocket_only"
+            )
+            cfg.inference_outputs_dir = cfg.inference_outputs_dir.replace(
+                f"boltz_{cfg.dataset}", f"boltz_pocket_only_{cfg.dataset}"
+            )
+
+    if cfg.complex_filepath is not None:
+        # process single-complex inputs
+        assert os.path.exists(
+            cfg.complex_filepath
+        ), f"Complex PDB file not found: {cfg.complex_filepath}"
+        assert (
+            cfg.complex_id is not None
+        ), "Complex ID must be provided when extracting single complex outputs."
+        assert (
+            cfg.ligand_smiles is not None
+        ), "Ligand SMILES must be provided when extracting single complex outputs."
+        assert (
+            cfg.output_dir is not None
+        ), "Output directory must be provided when extracting single complex outputs."
+        intermediate_output_filepath = cfg.complex_filepath
+        final_output_filepath = os.path.join(
+            cfg.output_dir, cfg.complex_id, os.path.basename(cfg.complex_filepath)
+        )
+        os.makedirs(os.path.dirname(final_output_filepath), exist_ok=True)
+        try:
+            extract_protein_and_ligands_with_prody(
+                intermediate_output_filepath,
+                final_output_filepath.replace(".cif", "_protein.pdb"),
+                final_output_filepath.replace(".cif", "_ligand.sdf"),
+                sanitize=False,
+                generify_resnames=True,
+                clear_ligand_segnames=True,
+                add_element_types=True,
+                ligand_smiles=cfg.ligand_smiles,
+            )
+        except Exception as e:
+            logger.error(f"Failed to extract protein and ligands for {cfg.complex_id} due to: {e}")
+    else:
+        # process all complexes in a dataset
+        smiles_and_pdb_id_list = parse_inference_inputs_from_dir(
+            cfg.input_data_dir,
+            pdb_ids=pdb_ids,
+        )
+        pdb_id_to_smiles = {pdb_id: smiles for smiles, pdb_id in smiles_and_pdb_id_list}
+        for item in os.listdir(cfg.prediction_inputs_dir):
+            input_item_path = os.path.join(cfg.prediction_inputs_dir, item)
+            output_item_path = os.path.join(
+                # NOTE: Boltz pre-rank orders its outputs by their aggregate score
+                cfg.prediction_outputs_dir,
+                f"boltz_results_{item}",
+                "predictions",
+                item,
+            )
+
+            if os.path.isdir(input_item_path) and os.path.isdir(output_item_path):
+                for file in os.listdir(output_item_path):
+                    if not file.endswith(".cif"):
+                        continue
+                    intermediate_output_filepath = os.path.join(output_item_path, file)
+                    final_output_filepath = os.path.join(cfg.inference_outputs_dir, item, file)
+                    os.makedirs(os.path.dirname(final_output_filepath), exist_ok=True)
+
+                    if cfg.dataset in ["posebusters_benchmark", "astex_diverse", "dockgen"]:
+                        ligand_smiles = pdb_id_to_smiles[item]
+                    else:
+                        # NOTE: for the `casp15` dataset, standalone ligand SMILES are not available
+                        ligand_smiles = None
+
+                    try:
+                        extract_protein_and_ligands_with_prody(
+                            intermediate_output_filepath,
+                            final_output_filepath.replace(".cif", "_protein.pdb"),
+                            final_output_filepath.replace(".cif", "_ligand.sdf"),
+                            sanitize=False,
+                            generify_resnames=True,
+                            clear_ligand_segnames=True,
+                            add_element_types=True,
+                            ligand_smiles=ligand_smiles,
+                        )
+                    except Exception as e:
+                        logger.error(
+                            f"Failed to extract protein and ligands for {item} due to: {e}"
+                        )
+
+    logger.info(
+        f"Finished extracting {cfg.dataset} protein and ligands from all prediction outputs."
+    )
+
+
+if __name__ == "__main__":
+    main()
diff --git a/posebench/data/chai_input_preparation.py b/posebench/data/chai_input_preparation.py
index 07349e23..834bcedd 100644
--- a/posebench/data/chai_input_preparation.py
+++ b/posebench/data/chai_input_preparation.py
@@ -100,9 +100,10 @@ def write_scripts(
                         )
                         continue
                 else:
-                    dockgen_suffix = "_processed" if dataset == "dockgen" else ""
+                    protein_id = pdb_id.split("_")[0] if dataset == "dockgen" else pdb_id
+                    protein_file_suffix = "_processed" if dataset == "dockgen" else "_protein"
                     protein_filepath = os.path.join(
-                        input_data_dir, pdb_id, f"{pdb_id}_protein{dockgen_suffix}.pdb"
+                        input_data_dir, pdb_id, f"{protein_id}{protein_file_suffix}.pdb"
                     )
             protein_sequence_list = [
                 seq
diff --git a/posebench/data/components/prepare_boltz_msas.py b/posebench/data/components/prepare_boltz_msas.py
new file mode 100644
index 00000000..27574a7c
--- /dev/null
+++ b/posebench/data/components/prepare_boltz_msas.py
@@ -0,0 +1,171 @@
+# -------------------------------------------------------------------------------------------------------------------------------------
+# Following code curated for PoseBench: (https://github.com/BioinfoMachineLearning/PoseBench)
+# -------------------------------------------------------------------------------------------------------------------------------------
+
+import logging
+import os
+
+import hydra
+import numpy as np
+import pandas as pd
+import rootutils
+from omegaconf import DictConfig
+from tqdm import tqdm
+
+rootutils.setup_root(__file__, indicator=".project-root", pythonpath=True)
+# ------------------------------------------------------------------------------------ #
+# the setup_root above is equivalent to:
+# - adding project root dir to PYTHONPATH
+#       (so you don't need to force user to install project as a package)
+#       (necessary before importing any local modules e.g. `from posebench import utils`)
+# - setting up PROJECT_ROOT environment variable
+#       (which is used as a base for paths in "configs/paths/default.yaml")
+#       (this way all filepaths are the same no matter where you run the code)
+# - loading environment variables from ".env" in root dir
+#
+# you can remove it if you:
+# 1. either install project as a package or move entry files to project root dir
+# 2. set `root_dir` to "." in "configs/paths/default.yaml"
+#
+# more info: https://github.com/ashleve/rootutils
+# ------------------------------------------------------------------------------------ #
+
+from posebench.utils.data_utils import extract_sequences_from_protein_structure_file
+
+logging.basicConfig(format="[%(asctime)s] {%(filename)s:%(lineno)d} %(levelname)s - %(message)s")
+logger = logging.getLogger(__name__)
+
+
+ID_TO_HHBLITS_AA = {
+    0: "A",
+    1: "C",  # Also U.
+    2: "D",  # Also B.
+    3: "E",  # Also Z.
+    4: "F",
+    5: "G",
+    6: "H",
+    7: "I",
+    8: "K",
+    9: "L",
+    10: "M",
+    11: "N",
+    12: "P",
+    13: "Q",
+    14: "R",
+    15: "S",
+    16: "T",
+    17: "V",
+    18: "W",
+    19: "Y",
+    20: "X",  # Includes J and O.
+    21: "-",
+}
+
+
+@hydra.main(
+    version_base="1.3",
+    config_path="../../../configs/data/components",
+    config_name="prepare_boltz_msas.yaml",
+)
+def main(cfg: DictConfig):
+    """Prepare Boltz MSAs for PoseBench."""
+    assert os.path.exists(cfg.input_msa_dir), f"Input MSA directory not found: {cfg.input_msa_dir}"
+    os.makedirs(cfg.output_msa_dir, exist_ok=True)
+
+    for msa_file in tqdm(os.listdir(cfg.input_msa_dir), desc="Preparing Boltz MSAs"):
+        if not msa_file.endswith(".npz"):
+            continue
+
+        item = msa_file.split("_protein")[0]
+        input_msa_path = os.path.join(cfg.input_msa_dir, msa_file)
+
+        casp_dataset_requested = os.path.basename(cfg.input_data_dir) == "targets"
+        if casp_dataset_requested:
+            protein_filepath = os.path.join(cfg.input_data_dir, f"{item}_lig.pdb")
+        else:
+            if cfg.pocket_only_baseline:
+                protein_filepath = os.path.join(
+                    cfg.input_data_dir,
+                    f"{cfg.dataset}_holo_aligned_predicted_structures_bs_cropped",
+                    f"{item}_holo_aligned_predicted_protein.pdb",
+                )
+                if not os.path.exists(protein_filepath):
+                    logger.warning(
+                        f"Protein structure file not found for PDB ID {item}. Skipping..."
+                    )
+                    continue
+            else:
+                protein_item = item.split("_")[0] if cfg.dataset == "dockgen" else item
+                protein_file_suffix = "_processed" if cfg.dataset == "dockgen" else "_protein"
+                protein_filepath = os.path.join(
+                    cfg.input_data_dir, item, f"{protein_item}{protein_file_suffix}.pdb"
+                )
+        protein_sequence_list = [
+            seq
+            for seq in extract_sequences_from_protein_structure_file(protein_filepath)
+            if len(seq) > 0
+        ]
+
+        try:
+            input_msa = dict(np.load(input_msa_path))
+
+            assert (
+                len(protein_sequence_list) == input_msa["n"]
+            ), f"Number of chains in protein structure file ({len(protein_sequence_list)}) does not match number of MSA chains ({input_msa['n']}) for {item}. Skipping..."
+
+            for chain_index in range(input_msa["n"]):
+                output_msa_path = os.path.join(
+                    cfg.output_msa_dir, item + f"_chain_{chain_index}.csv"
+                )
+                if os.path.exists(output_msa_path) and cfg.skip_existing:
+                    logger.info(f"MSA already exists: {output_msa_path}. Skipping...")
+                    continue
+
+                protein_sequence = protein_sequence_list[chain_index]
+                msa_sequence = "".join(
+                    ID_TO_HHBLITS_AA[c] for c in input_msa[f"msa_{chain_index}"][0]
+                )
+
+                max_sequence_len = max(len(protein_sequence), len(msa_sequence))
+
+                if protein_sequence != msa_sequence and len(protein_sequence) == len(msa_sequence):
+                    logger.warning(
+                        f"Input protein sequence {protein_sequence} does not match first MSA sequence {msa_sequence} for chain {chain_index} in {item}. Using input protein sequence instead..."
+                    )
+                    msa_sequence = protein_sequence
+                elif protein_sequence != msa_sequence:
+                    logger.warning(
+                        f"Input protein sequence {protein_sequence} does not match first MSA sequence length of {msa_sequence} for chain {chain_index} in {item}. Using input protein sequence instead and right-padding rest of MSA..."
+                    )
+                    msa_sequence = protein_sequence
+
+                output_msas = [
+                    {
+                        "sequence": (
+                            msa_sequence
+                            if seq_index == 0
+                            else "".join(ID_TO_HHBLITS_AA[c] for c in seq).rjust(
+                                max_sequence_len, "-"
+                            )
+                        ),
+                        "key": (
+                            seq_index
+                            if input_msa[f"is_paired_{chain_index}"][seq_index].item() is True
+                            else ""
+                        ),
+                    }
+                    for seq_index, seq in enumerate(input_msa[f"msa_{chain_index}"])
+                ]
+                output_msa_df = pd.DataFrame(output_msas)
+
+                logger.info(
+                    f"Converting chain MSA to DataFrame: {input_msa_path} -> {output_msa_path}"
+                )
+                output_msa_df.to_csv(output_msa_path, index=False)
+
+        except Exception as e:
+            logger.error(f"Failed to process MSA {input_msa_path} due to: {e}. Skipping...")
+
+
+if __name__ == "__main__":
+    main()
diff --git a/posebench/data/rfaa_input_preparation.py b/posebench/data/rfaa_input_preparation.py
index 82c9cd06..47ae514f 100644
--- a/posebench/data/rfaa_input_preparation.py
+++ b/posebench/data/rfaa_input_preparation.py
@@ -110,9 +110,10 @@ def write_scripts(
                         )
                         continue
                 else:
-                    dockgen_suffix = "_processed" if dataset == "dockgen" else ""
+                    protein_id = pdb_id.split("_")[0] if dataset == "dockgen" else pdb_id
+                    protein_file_suffix = "_processed" if dataset == "dockgen" else "_protein"
                     protein_filepath = os.path.join(
-                        input_data_dir, pdb_id, f"{pdb_id}_protein{dockgen_suffix}.pdb"
+                        input_data_dir, pdb_id, f"{protein_id}{protein_file_suffix}.pdb"
                     )
                 if dataset == "dockgen":
                     ligand_filepaths = [
diff --git a/posebench/models/boltz_inference.py b/posebench/models/boltz_inference.py
new file mode 100644
index 00000000..d02f565b
--- /dev/null
+++ b/posebench/models/boltz_inference.py
@@ -0,0 +1,133 @@
+# -------------------------------------------------------------------------------------------------------------------------------------
+# Following code curated for PoseBench: (https://github.com/BioinfoMachineLearning/PoseBench)
+# -------------------------------------------------------------------------------------------------------------------------------------
+
+import glob
+import logging
+import os
+import subprocess  # nosec
+import traceback
+
+import hydra
+import rootutils
+from omegaconf import DictConfig, open_dict
+
+rootutils.setup_root(__file__, indicator=".project-root", pythonpath=True)
+
+from posebench import register_custom_omegaconf_resolvers
+
+logging.basicConfig(format="[%(asctime)s] {%(filename)s:%(lineno)d} %(levelname)s - %(message)s")
+logger = logging.getLogger(__name__)
+
+
+def run_boltz_inference(fasta_file: str, cfg: DictConfig):
+    """Run inference using a trained Boltz model checkpoint.
+
+    :param fasta_filepath: Path to the input FASTA file.
+    :param cfg: Configuration dictionary from the hydra YAML file.
+    """
+    assert os.path.exists(fasta_file), f"FASTA file `{fasta_file}` not found."
+    os.makedirs(cfg.output_dir, exist_ok=True)
+    try:
+        cmd = [
+            "boltz",
+            "predict",
+            fasta_file,
+            "--out_dir",
+            cfg.output_dir,
+            "--model",
+            cfg.model,
+        ]
+        if cfg.use_potentials:
+            cmd.append("--use_potentials")
+        subprocess.run(cmd, check=True)  # nosec
+    except Exception as e:
+        raise e
+    logger.info(f"Boltz inference for FASTA file `{fasta_file}` complete.")
+
+
+@hydra.main(
+    version_base="1.3",
+    config_path="../../configs/model",
+    config_name="boltz_inference.yaml",
+)
+def main(cfg: DictConfig):
+    """Create SLURM job submission scripts for inference with Boltz.
+
+    :param cfg: Configuration dictionary from the hydra YAML file.
+    """
+    assert cfg.model in [
+        "boltz1",
+        "boltz2",
+    ], f"Invalid model `{cfg.model}` specified. Must be one of (`boltz1`, `boltz2`)."
+
+    with open_dict(cfg):
+        if cfg.pocket_only_baseline:
+            cfg.input_dir = cfg.input_dir.replace(cfg.dataset, f"{cfg.dataset}_pocket_only")
+            cfg.output_dir = cfg.output_dir.replace(cfg.dataset, f"{cfg.dataset}_pocket_only")
+
+        if cfg.max_num_inputs:
+            cfg.output_dir = cfg.output_dir.replace(
+                cfg.dataset, f"{cfg.dataset}_first_{cfg.max_num_inputs}"
+            )
+
+    num_dir_items_found = 0
+    for item in os.listdir(cfg.input_dir):
+        item_path = os.path.join(cfg.input_dir, item)
+        if os.path.isdir(item_path):
+            num_dir_items_found += 1
+            if cfg.max_num_inputs and num_dir_items_found > cfg.max_num_inputs:
+                logger.info(
+                    f"Maximum number of input directories reached ({cfg.max_num_inputs}). Exiting inference loop."
+                )
+                break
+            if (
+                cfg.skip_existing
+                and os.path.exists(
+                    os.path.join(
+                        cfg.output_dir,
+                        f"boltz_results_{item}",
+                        "predictions",
+                        item,
+                        f"{item}_model_0.cif",
+                    )
+                )
+                and not os.path.exists(
+                    os.path.join(cfg.output_dir, f"boltz_results_{item}", "error_log.txt")
+                )
+            ):
+                logger.info(f"Skipping inference for `{item}` as output directory already exists.")
+                continue
+            fasta_filepaths = list(glob.glob(os.path.join(item_path, "*.fasta")))
+            if not fasta_filepaths:
+                logger.error(f"Failed to find all required files for item `{item}`. Skipping...")
+                continue
+            fasta_filepath = fasta_filepaths[0]
+            try:
+                run_boltz_inference(
+                    fasta_file=fasta_filepath,
+                    cfg=cfg,
+                )
+                if os.path.isfile(
+                    os.path.join(cfg.output_dir, f"boltz_results_{item}", item, "error_log.txt")
+                ):
+                    os.remove(
+                        os.path.join(
+                            cfg.output_dir, f"boltz_results_{item}", item, "error_log.txt"
+                        )
+                    )
+            except Exception as e:
+                logger.error(
+                    f"Failed to run Boltz inference for item `{item}` due to: {e}. Skipping..."
+                )
+                with open(
+                    os.path.join(cfg.output_dir, f"boltz_results_{item}", "error_log.txt"), "w"
+                ) as f:
+                    traceback.print_exception(type(e), e, e.__traceback__, file=f)
+
+    logger.info("Boltz inference complete.")
+
+
+if __name__ == "__main__":
+    register_custom_omegaconf_resolvers()
+    main()
diff --git a/posebench/models/ensemble_generation.py b/posebench/models/ensemble_generation.py
index 997e9050..2461df4e 100644
--- a/posebench/models/ensemble_generation.py
+++ b/posebench/models/ensemble_generation.py
@@ -50,6 +50,7 @@
     "flowdock",
     "rfaa",
     "chai-lab",
+    "boltz",
     "alphafold3",
 }
 
@@ -629,6 +630,59 @@ def create_chai_bash_script(
     logger.info(f"Bash script '{output_filepath}' created successfully.")
 
 
+def create_boltz_bash_script(
+    protein_filepath: str,
+    ligand_smiles: str,
+    input_id: str,
+    cfg: DictConfig,
+    output_filepath: Optional[str] = None,
+    generate_hpc_scripts: bool = True,
+):
+    """Create a bash script to run Boltz protein-ligand complex prediction.
+
+    :param protein_filepath: Path to the input protein structure PDB
+        file.
+    :param ligand_smiles: SMILES string of the input ligand.
+    :param input_id: Input ID.
+    :param cfg: Configuration dictionary for runtime arguments.
+    :param output_filepath: Optional path to the output bash script
+        file.
+    :param generate_hpc_scripts: Whether to generate HPC scripts for
+        RoseTTAFold-All-Atom.
+    """
+
+    if output_filepath is None:
+        output_filepath = os.path.join(cfg.output_dir, input_id, f"{input_id}_rfaa_inference.sh")
+        os.makedirs(os.path.dirname(output_filepath), exist_ok=True)
+
+    bash_script_content = f"""#!/bin/bash -l
+{insert_hpc_headers(method='boltz', time_limit='0-24:00:00') if generate_hpc_scripts else 'source /home/$USER/mambaforge/etc/profile.d/conda.sh'}
+conda activate {"$project_dir/forks/boltz/boltz/" if generate_hpc_scripts else 'forks/boltz/boltz/'}
+echo "Beginning Boltz inference for input '{input_id}'!"
+
+# command to run boltz_input_preparation.py
+python posebench/data/boltz_input_preparation.py \\
+    dataset=ensemble \\
+    protein_filepath='{protein_filepath}' \\
+    ligand_smiles='"{ligand_smiles}"' \\
+    input_id='{input_id}'
+
+# command to run boltz_inference.py
+echo "Calling boltz_inference.py!"
+python posebench/models/boltz_inference.py \\
+    dataset=ensemble \\
+    cuda_device_index={cfg.cuda_device_index} \\
+    skip_existing={cfg.boltz_skip_existing}
+
+echo "Finished calling boltz_inference.py!"
+    """
+
+    with open(output_filepath, "w") as file:
+        file.write(bash_script_content)
+
+    logger.info(f"Bash script '{output_filepath}' created successfully.")
+
+
 def create_vina_bash_script(
     binding_site_method: Literal[
         "diffdock", "fabind", "dynamicbind", "neuralplexer", "flowdock", "rfaa"
@@ -820,6 +874,15 @@ def extract_protein_chains_to_fasta_files(protein_filepath: str) -> List[str]:
             output_filepath=output_filepath,
             generate_hpc_scripts=generate_hpc_scripts,
         )
+    elif method == "boltz":
+        create_boltz_bash_script(
+            protein_filepath=protein_filepath,
+            ligand_smiles=ligand_smiles,
+            input_id=input_id,
+            cfg=cfg,
+            output_filepath=output_filepath,
+            generate_hpc_scripts=generate_hpc_scripts,
+        )
     elif method == "alphafold3":
         logger.info(
             "AlphaFold-3 ensemble prediction Bash scripts are not supported. Skipping script creation."
@@ -1144,6 +1207,40 @@ def get_method_predictions(
             ],
             key=rank_key,
         )[: cfg.method_top_n_to_select]
+    elif method == "boltz":
+        ensemble_benchmarking_output_dir = (
+            Path(cfg.input_dir if cfg.input_dir else cfg.boltz_out_path).parent
+            / f"boltz{single_seq_suffix}{pocket_only_suffix}_{cfg.ensemble_benchmarking_dataset}_outputs_{cfg.ensemble_benchmarking_repeat_index}"
+            if cfg.ensemble_benchmarking
+            else (cfg.input_dir if cfg.input_dir else cfg.boltz_out_path)
+        )
+        protein_output_files = sorted(
+            [
+                file
+                for file in map(
+                    str,
+                    Path(os.path.join(ensemble_benchmarking_output_dir, target)).rglob("*.pdb"),
+                )
+                if "model_" in os.path.basename(file)
+                and "relaxed" not in os.path.basename(file)
+                and "aligned" not in os.path.basename(file)
+            ],
+            key=rank_key,
+        )[: cfg.method_top_n_to_select]
+        ligand_output_files = sorted(
+            [
+                file
+                for file in map(
+                    str,
+                    Path(os.path.join(ensemble_benchmarking_output_dir, target)).rglob("*.sdf"),
+                )
+                if "model_" in os.path.basename(file)
+                and "relaxed" not in os.path.basename(file)
+                and "aligned" not in os.path.basename(file)
+                and "_LIG" not in os.path.basename(file)
+            ],
+            key=rank_key,
+        )[: cfg.method_top_n_to_select]
     elif method == "alphafold3":
         ensemble_benchmarking_output_dir = (
             Path(cfg.input_dir if cfg.input_dir else cfg.alphafold3_out_path).parent
diff --git a/posebench/models/inference_relaxation.py b/posebench/models/inference_relaxation.py
index 331a173c..7e3481c5 100644
--- a/posebench/models/inference_relaxation.py
+++ b/posebench/models/inference_relaxation.py
@@ -75,6 +75,12 @@ def relax_inference_results(
                 if "model_idx_0_protein.pdb" in filepath.name
                 and "relaxed" not in filepath.parent.stem
             ]
+        elif cfg.method == "boltz":
+            protein_filepaths = [
+                filepath
+                for filepath in protein_filepaths
+                if "model_0_protein.pdb" in filepath.name and "relaxed" not in filepath.parent.stem
+            ]
         elif cfg.method == "alphafold3":
             protein_filepaths = [
                 filepath
@@ -119,6 +125,12 @@ def relax_inference_results(
                 if "model_idx_0_ligand.sdf" in filepath.name
                 and "relaxed" not in filepath.parent.stem
             ]
+        elif cfg.method == "boltz":
+            ligand_filepaths = [
+                filepath
+                for filepath in ligand_filepaths
+                if "model_0_ligand.sdf" in filepath.name and "relaxed" not in filepath.parent.stem
+            ]
         elif cfg.method == "alphafold3":
             ligand_filepaths = [
                 filepath
@@ -178,9 +190,9 @@ def relax_inference_results(
                     for ligand_filepath in ligand_filepaths
                 )
             ]
-        elif cfg.method == "chai-lab" or cfg.method == "alphafold3":
+        elif cfg.method in ["chai-lab", "boltz", "alphafold3"]:
             raise NotImplementedError(
-                "Cannot subset `chai-lab` or `alphafold3` protein predictions at this time."
+                "Cannot subset `chai-lab`, `boltz`, or `alphafold3` protein predictions at this time."
             )
         else:
             protein_filepaths = [
@@ -342,6 +354,17 @@ def relax_single_filepair(
                 protein_filepath.parent.stem,
                 f"{protein_filepath.stem}_relaxed.pdb",
             )
+        elif cfg.method == "boltz":
+            output_filepath = Path(
+                output_file_dir,
+                ligand_filepath.parent.stem,
+                f"{ligand_filepath.stem}_relaxed.sdf",
+            )
+            protein_output_filepath = Path(
+                output_file_dir,
+                protein_filepath.parent.stem,
+                f"{protein_filepath.stem}_relaxed.pdb",
+            )
         elif cfg.method == "alphafold3":
             output_filepath = Path(
                 output_file_dir,
diff --git a/posebench/utils/data_utils.py b/posebench/utils/data_utils.py
index 0f1cfe54..e6f27fb6 100644
--- a/posebench/utils/data_utils.py
+++ b/posebench/utils/data_utils.py
@@ -1590,6 +1590,7 @@ def process_ligand_with_prody(
     chain,
     resnum,
     sanitize: bool = True,
+    generify_resnames: bool = False,
     sub_smiles: Optional[str] = None,
     ligand_expo_mapping: Optional[Dict[str, Any]] = None,
 ) -> Chem.Mol:
@@ -1607,6 +1608,7 @@ def process_ligand_with_prody(
     :param chain: chain of ligand to extract
     :param resnum: residue number of ligand to extract
     :param sanitize: whether to sanitize the molecule
+    :param generify_resnames: whether to generify the residue names
     :param sub_smiles: optional SMILES string of the ligand molecule
     :param ligand_expo_mapping: optional Ligand Expo mapping
     :return: molecule with bond orders assigned
@@ -1627,6 +1629,9 @@ def process_ligand_with_prody(
     else:
         template = None
 
+    if generify_resnames:
+        sub_mol.setResnames("LIG")
+
     output = StringIO()
     writePDBStream(output, sub_mol)
     pdb_string = output.getvalue()
@@ -1678,6 +1683,8 @@ def extract_protein_and_ligands_with_prody(
     ligands_output_sdf_file: Optional[str],
     sanitize: bool = True,
     add_element_types: bool = False,
+    generify_resnames: bool = False,
+    clear_ligand_segnames: bool = False,
     write_output_files: bool = True,
     load_hetatms_as_ligands: bool = False,
     ligand_smiles: Optional[str] = None,
@@ -1695,6 +1702,10 @@ def extract_protein_and_ligands_with_prody(
     :param sanitize: Whether to sanitize the ligand molecules.
     :param add_element_types: Whether to add element types to the
         protein atoms.
+    :param generify_resnames: Whether to generify the residue names of
+        the ligand molecules (e.g., for Boltz).
+    :param clear_ligand_segnames: Whether to clear the segment names of
+        the ligand atoms (e.g., for Boltz).
     :param write_output_files: Whether to write the output files.
     :param load_hetatms_as_ligands: Whether to load HETATM records as
         ligands if no ligands are initially found.
@@ -1712,6 +1723,9 @@ def extract_protein_and_ligands_with_prody(
         logger.info(f"No ligand found in {input_pdb_file}. Returning None.")
         return None
 
+    if clear_ligand_segnames:
+        ligand.setSegnames("")
+
     if write_output_files:
         assert protein_output_pdb_file is not None, "Protein output PDB file must be provided."
         write_pdb_with_prody(protein, protein_output_pdb_file, add_element_types=add_element_types)
@@ -1762,6 +1776,7 @@ def extract_protein_and_ligands_with_prody(
             chain,
             resnum,
             sanitize=sanitize,
+            generify_resnames=generify_resnames,
             sub_smiles=sub_smiles,
             ligand_expo_mapping=ligand_expo_mapping,
         )
diff --git a/scripts/benchmark_baseline_compute_resources.py b/scripts/benchmark_baseline_compute_resources.py
index c3a121b0..dfcb38f9 100644
--- a/scripts/benchmark_baseline_compute_resources.py
+++ b/scripts/benchmark_baseline_compute_resources.py
@@ -34,9 +34,10 @@ def assemble_baseline_command(cfg: DictConfig) -> List[str]:
         "flowdock",
         "rfaa",
         "chai-lab",
+        "boltz",
         "vina",
     ]:
-        # NOTE: When running RoseTTAFold-All-Atom (or Chai-1), the `RFAA` (`chai-lab`) Conda environment must be activated instead of the `PoseBench` environment
+        # NOTE: When running RoseTTAFold-All-Atom (or Chai-1/Boltz), the `RFAA` (`chai-lab`/`boltz`) Conda environment must be activated instead of the `PoseBench` environment
         vina_suffix = f" method={cfg.vina_binding_site_method}" if cfg.method == "vina" else ""
         cuda_device_suffix = (
             "" if cfg.method == "vina" else f" cuda_device_index={cfg.cuda_device_index}"
diff --git a/scripts/build_inference_script.py b/scripts/build_inference_script.py
index 8343747f..c723c304 100644
--- a/scripts/build_inference_script.py
+++ b/scripts/build_inference_script.py
@@ -191,6 +191,37 @@
             "python3 posebench/analysis/inference_analysis_casp.py method=chai-lab dataset=casp15 repeat_index={repeat_index} relax_protein={relax_protein}",
         ],
     },
+    "boltz": {
+        "prepare_input": [
+            "python3 posebench/data/boltz_input_preparation.py dataset={dataset} pocket_only_baseline={pocket_only_baseline}",
+        ],
+        "run_inference": [
+            "conda activate forks/boltz/boltz/",
+            "python3 posebench/models/boltz_inference.py dataset={dataset} cuda_device_index={cuda_device_index} pocket_only_baseline={pocket_only_baseline} repeat_index={repeat_index}",
+            "conda deactivate",
+        ],
+        "extract_outputs": [
+            "python3 posebench/data/boltz_output_extraction.py dataset={dataset} pocket_only_baseline={pocket_only_baseline} repeat_index={repeat_index}",
+        ],
+        "relax": [
+            "python3 posebench/models/inference_relaxation.py method=boltz dataset={dataset} cuda_device_index={cuda_device_index} pocket_only_baseline={pocket_only_baseline} relax_protein={relax_protein} remove_initial_protein_hydrogens=true repeat_index={repeat_index}",
+        ],
+        "align_complexes": [
+            "conda activate PyMOL-PoseBench",
+            "python3 posebench/analysis/complex_alignment.py method=boltz dataset={dataset} pocket_only_baseline={pocket_only_baseline} repeat_index={repeat_index}",
+            "conda deactivate",
+        ],
+        "analyze_results": [
+            "python3 posebench/analysis/inference_analysis.py method=boltz dataset={dataset} pocket_only_baseline={pocket_only_baseline} relax_protein={relax_protein} repeat_index={repeat_index}",
+        ],
+        "assemble_casp15": [
+            "python3 posebench/models/ensemble_generation.py ensemble_methods=[boltz] ensemble_ranking_method={ensemble_ranking_method} input_csv_filepath=data/test_cases/casp15/ensemble_inputs.csv output_dir=data/test_cases/casp15/top_boltz_ensemble_predictions_{repeat_index} skip_existing=true relax_method_ligands_post_ranking=false relax_protein={relax_protein} export_file_format=casp15 export_top_n=5 combine_casp_output_files=true max_method_predictions=5 method_top_n_to_select=5 resume=true ensemble_benchmarking=true ensemble_benchmarking_dataset=casp15 cuda_device_index={cuda_device_index} ensemble_benchmarking_repeat_index={repeat_index}",
+            "python3 posebench/models/ensemble_generation.py ensemble_methods=[boltz] ensemble_ranking_method={ensemble_ranking_method} input_csv_filepath=data/test_cases/casp15/ensemble_inputs.csv output_dir=data/test_cases/casp15/top_boltz_ensemble_predictions_{repeat_index} skip_existing=true relax_method_ligands_post_ranking=true relax_protein={relax_protein} export_file_format=casp15 export_top_n=5 combine_casp_output_files=true max_method_predictions=5 method_top_n_to_select=5 resume=true ensemble_benchmarking=true ensemble_benchmarking_dataset=casp15 cuda_device_index={cuda_device_index} ensemble_benchmarking_repeat_index={repeat_index}",
+        ],
+        "analyze_casp15": [
+            "python3 posebench/analysis/inference_analysis_casp.py method=boltz dataset=casp15 repeat_index={repeat_index} relax_protein={relax_protein}",
+        ],
+    },
     "alphafold3": {
         "extract_outputs": [
             "python3 posebench/data/af3_output_extraction.py dataset={dataset} pocket_only_baseline={pocket_only_baseline} repeat_index={repeat_index}",
@@ -278,6 +309,7 @@
     "flowdock",
     "rfaa",
     "chai-lab",
+    "boltz",
     "alphafold3",
     "vina",
     "tulip",
@@ -296,6 +328,7 @@
     "flowdock",
     "rfaa",
     "chai-lab",
+    "boltz",
     "alphafold3",
     "vina",
     "ensemble",
@@ -469,6 +502,11 @@ def build_inference_script(
                 if method == "chai-lab" and dataset == "casp15"
                 else ""
             )
+            boltz_casp15_input_suffix = (
+                " input_data_dir=data/casp15_set/targets"
+                if method == "boltz" and dataset == "casp15"
+                else ""
+            )
             alphafold3_casp15_input_suffix = (
                 " input_data_dir=data/casp15_set/targets"
                 if method == "alphafold3" and dataset == "casp15"
@@ -483,6 +521,7 @@ def build_inference_script(
                     + neuralplexer_and_flowdock_casp15_input_suffix
                     + rfaa_casp15_input_suffix
                     + chai_casp15_input_suffix
+                    + boltz_casp15_input_suffix
                     + alphafold3_casp15_input_suffix
                     + "\n"
                 )