| Protein sequence(s) | VKDFLSQLRSSNRRFSIPESGQGGTEMDGFRRTIENQHSRNDVMVSEWLNKLNLEEPPSSVPKKCPSLTKRSRAQEEQVPQAWTAGTSSDSMAQPPQTPETSTFRNQMPSPTSTGTPSPGPRGNQGAERQGMNWSCRTPEPNPVTGRPLVNIYNCSGVQVGDNNYLTMQQTTALPTWGLAPSGKGRGLQHPPPVGSQEGPKDPEAWSRPQGWYNHSGK input pdb |
| Peptide sequence | RRRVQLFGSNDARRY |
| Simulation mc cycles | 50 |
| Peptide secondary structure psipred | CCCEEECCCCCCCCC |
| 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) | 29.4308 | 3.60167 | 26.3728 | 106 |
| cluster_2.pdb ( medoid) | 21.9141 | 5.5672 | 35.8233 | 122 |
| cluster_3.pdb ( medoid) | 17.2016 | 8.08063 | 27.9674 | 139 |
| cluster_4.pdb ( medoid) | 12.9107 | 13.3223 | 36.9888 | 172 |
| cluster_5.pdb ( medoid) | 11.472 | 10.7218 | 39.0988 | 123 |
| cluster_6.pdb ( medoid) | 8.27499 | 6.64653 | 27.187 | 55 |
| cluster_7.pdb ( medoid) | 7.91185 | 8.46831 | 32.862 | 67 |
| cluster_8.pdb ( medoid) | 6.65064 | 12.3296 | 26.3335 | 82 |
| cluster_9.pdb ( medoid) | 5.5028 | 14.9015 | 41.0026 | 82 |
| cluster_10.pdb ( medoid) | 3.59147 | 14.4788 | 29.9515 | 52 |