| Protein sequence(s) | MKYSTLVSIAAFISTSLAATVPDEHYSTLSPSAKIPSGASTDFSGTFGIQVVTVESASALSTDTATSTLTRNDNKKEATPVAQITDGQVQHQTTGGVSAIKQISDGQVQHQTNAAQPIAQISDGQIQHQTTAKATATPVQQINDGQIQHQTTVQPVAQISDGQIQHQTAKATATPVQQIGDGQIQHQTTVQPVAQISDGQIQHQTVKASATPVQQIGDGQIQHQTTAAAATTASAVKQINDGQIQHQTTTAENVAKAQSDGQAIATGSPSSNSTLSDDDDLSSTIPKACSSANNLEMTLHDSVLKDTHERWGAIVANHQFQFDGPIPQAGTIYSAGWSIKDGYLYLGDSNIFYQCLSGDFYNLYDENVAKQCSAVKLSVIEFVNC input pdb |
| Peptide sequence | CSWSVVVLVRHSYGGS |
| Simulation mc cycles | 50 |
| Peptide secondary structure psipred | CCEEEEEEEEECCCCC |
| Receptor residue | Peptide residue |
| Receptor residue | Peptide residue |
| Receptor residue | Peptide residue |
| cluster name | cluster density | average rmsd | max rmsd | number of elements |
| cluster_1.pdb ( medoid) | 67.4115 | 1.48343 | 2.86658 | 100 |
| cluster_2.pdb ( medoid) | 66.9458 | 1.49375 | 3.38532 | 100 |
| cluster_3.pdb ( medoid) | 36.7004 | 2.69751 | 5.10581 | 99 |
| cluster_4.pdb ( medoid) | 18.3545 | 5.44826 | 10.1543 | 100 |
| cluster_5.pdb ( medoid) | 14.0215 | 3.06673 | 6.45896 | 43 |
| cluster_6.pdb ( medoid) | 12.2975 | 8.13174 | 19.2974 | 100 |
| cluster_7.pdb ( medoid) | 11.0681 | 5.14993 | 8.90208 | 57 |
| cluster_8.pdb ( medoid) | 7.8105 | 5.50541 | 12.1978 | 43 |
| cluster_9.pdb ( medoid) | 5.24425 | 6.10192 | 21.815 | 32 |
| cluster_10.pdb ( medoid) | 4.06627 | 6.39406 | 11.1333 | 26 |