| Protein sequence(s) | VKDFLSQLRSSNRRFSIPESGQGGTEMDGFRRTIENQHSRNDVMVSEWLNKLNLEEPPSSVPKKCPSLTKRSRAQEEQVPQAWTAGTSSDSMAQPPQTPETSTFRNQMPSPTSTGTPSPGPRGNQGAERQGMNWSCRTPEPNPVTGRPLVNIYNCSGVQVGDNNYLTMQQTTALPTWGLAPSGKGRGLQHPPPVGSQEGPKDPEAWSRPQGWYNHSGK input pdb |
| Peptide sequence | KRLVQVFGSNTYRLH |
| Simulation mc cycles | 50 |
| Peptide secondary structure psipred | CCCEEECCCCCEECC |
| 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) | 39.6124 | 2.80215 | 23.2175 | 111 |
| cluster_2.pdb ( medoid) | 23.3089 | 5.31986 | 29.5013 | 124 |
| cluster_3.pdb ( medoid) | 15.3225 | 8.81057 | 35.5823 | 135 |
| cluster_4.pdb ( medoid) | 12.5355 | 7.02008 | 20.6945 | 88 |
| cluster_5.pdb ( medoid) | 11.6167 | 10.2438 | 35.032 | 119 |
| cluster_6.pdb ( medoid) | 11.1933 | 14.0262 | 34.4765 | 157 |
| cluster_7.pdb ( medoid) | 5.49891 | 13.6391 | 32.5289 | 75 |
| cluster_8.pdb ( medoid) | 5.12658 | 14.4346 | 29.4256 | 74 |
| cluster_9.pdb ( medoid) | 3.94209 | 14.4594 | 29.4019 | 57 |
| cluster_10.pdb ( medoid) | 3.79802 | 15.7977 | 29.9275 | 60 |