| Protein sequence(s) | GTFLAYAQFNDTEVPLIEYSFYSDESLQYPKTVRVPYPKAGAVNPTVKFFVVNTDSLSSVTNATSIQITAPASMLIGDHYLCDVTWATQERISLQWLRRIQNYSVMDICDYDESSGRWNCLVARQHIEMSTTGWVGRFRPS input pdb |
| Peptide sequence | SYTNSQHQSS |
| Simulation mc cycles | 100 |
| Peptide secondary structure psipred | CCCCCCCCCC |
| 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) | 40.7695 | 3.1396 | 16.3702 | 128 |
| cluster_2.pdb ( medoid) | 29.0224 | 5.92645 | 25.7722 | 172 |
| cluster_3.pdb ( medoid) | 28.6612 | 7.15253 | 22.4771 | 205 |
| cluster_4.pdb ( medoid) | 15.8638 | 6.11454 | 19.0175 | 97 |
| cluster_5.pdb ( medoid) | 14.9856 | 7.54055 | 18.392 | 113 |
| cluster_6.pdb ( medoid) | 10.7254 | 9.04398 | 37.9276 | 97 |
| cluster_7.pdb ( medoid) | 10.2858 | 6.12492 | 13.4707 | 63 |
| cluster_8.pdb ( medoid) | 9.08452 | 6.38449 | 16.8121 | 58 |
| cluster_9.pdb ( medoid) | 5.2833 | 5.48899 | 10.7333 | 29 |
| cluster_10.pdb ( medoid) | 2.29548 | 16.5543 | 34.396 | 38 |