| Protein sequence(s) | MDNDQPPVVTATLLVPLQNSSCAEAAEALLPHGLMGLHEEHSWMSNRTELQYELNPGEVATASIFFGALWLFSIFGNSLVCLVIHRSRRTQSTTNYFVVSMACADLLISVASTPFVVLQFTTGRWTLGSAMCKVVRYFQYLTPGVQIYVLLSICIDRFYTIVYPLSFKVSREKAKKMIAASWILDAAFVTPVFFFYGSNWDSHCNYFLPPSWEGTAYTVIHFLVGFVIPSILIILFYQKVIKYIWRIGTDGRTLRRTMNIVPRTKVKTVKMFLLLNLVFLFSWLPFHVAQLWHPHEQDYKKSSLVFTAVTWVSFSSSASKPTLYSIYNANFRRGMKETFCMSSMKCYRSNAYTITTSSRMAKRNYVGISEIPPVSRTITKDSIYDSFDREAREKKLAWPINSNPPNTFV input pdb |
| Peptide sequence | CHSRSADVDSLSESSPNSSPGPCPEKAPPP |
| Simulation mc cycles | 50 |
| Peptide secondary structure psipred | CCCCCCCHHHCCCCCCCCCCCCCCCCCCCC |
| 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) | 40.6351 | 0.787496 | 1.57339 | 32 |
| cluster_2.pdb ( medoid) | 39.4363 | 1.03965 | 1.70958 | 41 |
| cluster_3.pdb ( medoid) | 15.6599 | 1.27715 | 2.00461 | 20 |
| cluster_4.pdb ( medoid) | 12.3149 | 2.19246 | 3.42074 | 27 |
| cluster_5.pdb ( medoid) | 6.06264 | 3.62878 | 5.10884 | 22 |
| cluster_6.pdb ( medoid) | 6.02029 | 3.156 | 5.9159 | 19 |
| cluster_7.pdb ( medoid) | 5.11262 | 3.71629 | 6.5711 | 19 |
| cluster_8.pdb ( medoid) | 3.68107 | 1.90162 | 3.5113 | 7 |
| cluster_9.pdb ( medoid) | 2.89035 | 2.42185 | 3.27423 | 7 |
| cluster_10.pdb ( medoid) | 2.15235 | 2.78766 | 3.39627 | 6 |