| Protein sequence(s) | VKDFLSQLRSSNRRFSIPESGQGGTEMDGFRRTIENQHSRNDVMVSEWLNKLNLEEPPSSVPKKCPSLTKRSRAQEEQVPQAWTAGTSSDSMAQPPQTPETSTFRNQMPSPTSTGTPSPGPRGNQGAERQGMNWSCRTPEPNPVTGRPLVNIYNCSGVQVGDNNYLTMQQTTALPTWGLAPSGKGRGLQHPPPVGSQEGPKDPEAWSRPQGWYNHSGK input pdb |
| Peptide sequence | VQVFGDNNY |
| Simulation mc cycles | 50 |
| Peptide secondary structure psipred | CCCCCCCCC |
| 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) | 27.3133 | 4.43008 | 23.3192 | 121 |
| cluster_2.pdb ( medoid) | 23.8455 | 3.7743 | 19.0125 | 90 |
| cluster_3.pdb ( medoid) | 22.3284 | 6.53877 | 28.3756 | 146 |
| cluster_4.pdb ( medoid) | 14.4181 | 9.29389 | 24.2787 | 134 |
| cluster_5.pdb ( medoid) | 13.082 | 7.18543 | 19.6713 | 94 |
| cluster_6.pdb ( medoid) | 9.41427 | 12.3217 | 26.6476 | 116 |
| cluster_7.pdb ( medoid) | 7.81 | 13.1882 | 28.8033 | 103 |
| cluster_8.pdb ( medoid) | 6.69987 | 13.8809 | 32.6059 | 93 |
| cluster_9.pdb ( medoid) | 5.2549 | 11.6082 | 24.254 | 61 |
| cluster_10.pdb ( medoid) | 4.70822 | 8.92056 | 20.2066 | 42 |