| Protein sequence(s) | GSHHHHHHGSGTDITNQLTNVTVGIDSGTTVYPHQAGYVKLNYGFSVPNSAVKGDTFKITVPKELNLNGVTSTAKVPPIMQVLANGVIDSDGNVIYTFTDYVNTKCDVKATLTMPAYIDPENVKKTGNVTLATGIGSTTANKTVLVDYEKYGKFYNLSIKGTIDQIDKTNNTYRQTIYVNPSGDNVIAPVLTGNLKPNTDSNALIDQQNTSIKVYKVDNAADLSESYFVNPENFEDVTNSVNITFPNPNQYKVEFNTPDDQITTPYIVVVNGHIDPNSKGDLALRSTLYGYNSNIIWRSMSWDNEVAFNNGSGSGDGIDC input pdb |
| Peptide sequence | VVIPIELR |
| Simulation mc cycles | 50 |
| Peptide secondary structure psipred | CCCEEECC |
| 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) | 49.7018 | 1.99188 | 11.1239 | 99 |
| cluster_2.pdb ( medoid) | 25.5431 | 4.38475 | 15.0814 | 112 |
| cluster_3.pdb ( medoid) | 21.6278 | 3.74518 | 10.7855 | 81 |
| cluster_4.pdb ( medoid) | 19.1306 | 3.76361 | 14.4362 | 72 |
| cluster_5.pdb ( medoid) | 18.9546 | 9.28536 | 44.776 | 176 |
| cluster_6.pdb ( medoid) | 17.1818 | 4.19049 | 10.417 | 72 |
| cluster_7.pdb ( medoid) | 15.7252 | 5.65972 | 14.0621 | 89 |
| cluster_8.pdb ( medoid) | 8.51961 | 11.7376 | 51.1296 | 100 |
| cluster_9.pdb ( medoid) | 8.21621 | 7.18092 | 14.2598 | 59 |
| cluster_10.pdb ( medoid) | 6.67831 | 8.83457 | 23.8356 | 59 |