| Protein sequence(s) | QKQYWVCNSSDASISYTYCDKMQYPISINVNPCIELKGSKGLLHIFYIPRRDLKQLYFNLYITVNTMNLPKRKEVICRGSDDDYSFCRALKGETVNTTISFSFKGIKFSKGKYKCVVEAISGSPEEMLFCLEFVILHQPN input pdb |
| Peptide sequence | YLSW |
| Simulation mc cycles | 50 |
| Peptide secondary structure psipred | CCCC |
| 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) | 70.7924 | 1.52559 | 4.82616 | 108 |
| cluster_2.pdb ( medoid) | 66.0109 | 2.27235 | 19.4007 | 150 |
| cluster_3.pdb ( medoid) | 50.6099 | 2.76626 | 23.0489 | 140 |
| cluster_4.pdb ( medoid) | 41.1049 | 3.2113 | 29.0872 | 132 |
| cluster_5.pdb ( medoid) | 33.079 | 3.8393 | 25.8036 | 127 |
| cluster_6.pdb ( medoid) | 20.9312 | 4.68202 | 33.48 | 98 |
| cluster_7.pdb ( medoid) | 18.0305 | 2.38484 | 4.68722 | 43 |
| cluster_8.pdb ( medoid) | 11.5066 | 6.60493 | 36.5551 | 76 |
| cluster_9.pdb ( medoid) | 9.88887 | 7.88765 | 41.93 | 78 |
| cluster_10.pdb ( medoid) | 2.41564 | 19.8705 | 39.7762 | 48 |