| Protein sequence(s) | TDVTSKVTVEIGSIEGHNNTNKVEPHAGQRAVLKYKLKFENGLHQQGDYFDFTLSNNVNTHGVSTARKVPEIKNGSVVMATGEVLEGGKIRYTFTNDIEDKVDVTAELEINLFIDPKTVQTNGNQTITSTLNEEQTSKELDVKYKDGIGNYYANLNGSIETFNKANNRFSHVAFIKPNNGKTTSVTVTGTLMKGSNQNGNQPKVRIFEYLGNNEDIAKSVYANTTDTSKFKEVTSNMGNLNLQNNGSYSLNIENLDKTYVVHYDGEYLNGTDEVDFRTQMVGHPEGYTLTWDNGLVLYSN input pdb |
| Peptide sequence | VVIPIELR |
| Simulation mc cycles | 50 |
| Peptide secondary structure psipred | CCCEEECC |
| 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) | 41.6223 | 4.5168 | 19.3226 | 188 |
| cluster_2.pdb ( medoid) | 37.9461 | 4.00568 | 10.4341 | 152 |
| cluster_3.pdb ( medoid) | 23.0673 | 5.20217 | 36.4394 | 120 |
| cluster_4.pdb ( medoid) | 17.0536 | 4.74974 | 11.9364 | 81 |
| cluster_5.pdb ( medoid) | 16.0626 | 10.0855 | 58.6141 | 162 |
| cluster_6.pdb ( medoid) | 14.3174 | 5.72731 | 30.2517 | 82 |
| cluster_7.pdb ( medoid) | 3.9407 | 11.1655 | 27.4808 | 44 |
| cluster_8.pdb ( medoid) | 3.5731 | 12.0344 | 22.9191 | 43 |
| cluster_9.pdb ( medoid) | 3.38138 | 19.8144 | 44.0806 | 67 |
| cluster_10.pdb ( medoid) | 3.30933 | 18.4327 | 43.2448 | 61 |