| Protein sequence(s) | GSHSLRYFYTAVSRPGLGEPRFIIVGYVDDTQFVRFDSDAGDPRVEPRARWVEQEGPEYWDQETRKAKDHAQFFRLGLNTLRGYYNQSEAGSHTLQWMYGCDVGPDGRLLRGFWQFGYEGRDYIALNEDLRSWTAADTAAQISKRKWEAADVAERQRNYLEGTCVEWLPRYLENGKDTLLRADPPKAHVTHHPISGREVTLRCWALGFYPEEISLTWQRNGEDQTQDMELVETRPSGDGTFQKWVALVVPSGEEQRYTCSVQHEGLQEPLTLRWEP input pdb |
| Peptide sequence | IAVTHTGKL |
| Simulation mc cycles | 50 |
| Peptide secondary structure psipred | CCCCCCCCC |
| 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) | 67.9869 | 1.95626 | 5.80638 | 133 |
| cluster_2.pdb ( medoid) | 51.698 | 2.3792 | 25.6856 | 123 |
| cluster_3.pdb ( medoid) | 37.7677 | 3.65391 | 29.6689 | 138 |
| cluster_4.pdb ( medoid) | 34.0926 | 2.84519 | 5.73787 | 97 |
| cluster_5.pdb ( medoid) | 33.0418 | 3.38964 | 14.379 | 112 |
| cluster_6.pdb ( medoid) | 30.2093 | 2.08545 | 4.96617 | 63 |
| cluster_7.pdb ( medoid) | 13.5001 | 3.9259 | 14.2512 | 53 |
| cluster_8.pdb ( medoid) | 11.7406 | 8.85812 | 28.7643 | 104 |
| cluster_9.pdb ( medoid) | 9.28296 | 10.9879 | 39.2071 | 102 |
| cluster_10.pdb ( medoid) | 4.78072 | 15.688 | 37.672 | 75 |