| Protein sequence(s) | GTFLAYAQFNDTEVPLIEYSFYSDESLQYPKTVRVPYPKAGAVNPTVKFFVVNTDSLSSVTNATSIQITAPASMLIGDHYLCDVTWATQERISLQWLRRIQNYSVMDICDYDESSGRWNCLVARQHIEMSTTGWVGRFRPS input pdb |
| Peptide sequence | AAAAAAAAAA |
| Simulation mc cycles | 50 |
| Peptide secondary structure psipred | CHHHHHHHHC |
| 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) | 30.9759 | 4.58421 | 10.7216 | 142 |
| cluster_2.pdb ( medoid) | 24.8331 | 5.19469 | 10.5388 | 129 |
| cluster_3.pdb ( medoid) | 22.8919 | 5.76623 | 13.6539 | 132 |
| cluster_4.pdb ( medoid) | 20.6924 | 4.05946 | 11.1595 | 84 |
| cluster_5.pdb ( medoid) | 20.4618 | 5.52249 | 20.138 | 113 |
| cluster_6.pdb ( medoid) | 20.2457 | 3.90207 | 10.3267 | 79 |
| cluster_7.pdb ( medoid) | 18.843 | 3.82105 | 8.31466 | 72 |
| cluster_8.pdb ( medoid) | 18.4299 | 3.25558 | 9.09395 | 60 |
| cluster_9.pdb ( medoid) | 17.3381 | 7.15186 | 18.4693 | 124 |
| cluster_10.pdb ( medoid) | 15.2962 | 4.24943 | 10.2089 | 65 |