| Protein sequence(s) | AHGVYNAELSNKDPNILQQERAEVERYCKHNAQIRQSAIADKTVPPKVKLSSVKPAGGRHPAVLMCSAYRFYPHGIKVSWMRNGEVVKTDVTSTEEMPNGD input pdb |
| Peptide sequence | KLTSVDLSYAPRKKVTTVSNTNY |
| Simulation mc cycles | 50 |
| Peptide secondary structure psipred | CCCCCCCCCCCCCCEEEEECCCC |
| 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) | 41.2443 | 2.47307 | 26.8474 | 102 |
| cluster_2.pdb ( medoid) | 26.7987 | 4.142 | 17.6388 | 111 |
| cluster_3.pdb ( medoid) | 16.4005 | 9.87773 | 33.2632 | 162 |
| cluster_4.pdb ( medoid) | 10.4781 | 6.4897 | 21.6064 | 68 |
| cluster_5.pdb ( medoid) | 9.58287 | 17.74 | 45.9383 | 170 |
| cluster_6.pdb ( medoid) | 6.93777 | 13.549 | 32.236 | 94 |
| cluster_7.pdb ( medoid) | 6.67208 | 9.29245 | 22.0278 | 62 |
| cluster_8.pdb ( medoid) | 6.613 | 17.39 | 33.4166 | 115 |
| cluster_9.pdb ( medoid) | 5.45358 | 11.7354 | 26.2561 | 64 |
| cluster_10.pdb ( medoid) | 4.00509 | 12.9835 | 30.2617 | 52 |