| Protein sequence(s) | PEITLIIFGVIAGVIGTILLISYGIRRL input pdb |
| Peptide sequence | NGSGKPIDGGPRILP |
| Simulation mc cycles | 50 |
| Peptide secondary structure psipred | CCCCCCCCCCCCCCC |
| 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) | 21.0656 | 8.02257 | 23.388 | 169 |
| cluster_2.pdb ( medoid) | 16.0998 | 8.07464 | 16.9603 | 130 |
| cluster_3.pdb ( medoid) | 10.9654 | 8.29881 | 21.6459 | 91 |
| cluster_4.pdb ( medoid) | 10.2113 | 9.79303 | 21.1655 | 100 |
| cluster_5.pdb ( medoid) | 9.52719 | 9.44665 | 20.7395 | 90 |
| cluster_6.pdb ( medoid) | 9.22521 | 8.78029 | 18.4597 | 81 |
| cluster_7.pdb ( medoid) | 8.74229 | 10.8667 | 21.0519 | 95 |
| cluster_8.pdb ( medoid) | 8.65361 | 11.9025 | 25.9914 | 103 |
| cluster_9.pdb ( medoid) | 5.61424 | 11.9339 | 26.3419 | 67 |
| cluster_10.pdb ( medoid) | 5.54225 | 13.352 | 29.1733 | 74 |