| Protein sequence(s) | QIIPSNTTSPPTNSTSPPTNATAPAPSPTNTITKAANITKPGCPKQCGNVTVPYPFGIGSGCALDPMFEIDCNVTTPFIGNIQIYDISDAEMRISNFINTKCYSQTGVLIQDIPSWITLGTKSPYTFSTLNRFIVVGCDDGAIVSGNNFANGCPSLCTSTNDIVKGKCMGFGCCQITIPKGLKFFNTTMVTTRNHSLIWSFNPCGHSFLGEASRFEFQGIEDLSDVNFANKIRNNVPIVLDWAIGNLSCVEARKSNDYACLNNSQCVDSDTSLGGYRCSCNSGYIGNPYIGSGCQDIDECADPNTNSCEKICTNIPGSYNCSCPEGYTGDGRKNGRGCIAPNSNSEFPWIK input pdb |
| Peptide sequence | NGGKQFDDMS |
| Simulation mc cycles | 50 |
| Peptide secondary structure psipred | CCCCCCCCCC |
| 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) | 36.1696 | 3.40065 | 12.8178 | 123 |
| cluster_2.pdb ( medoid) | 17.4483 | 6.18972 | 23.0037 | 108 |
| cluster_3.pdb ( medoid) | 16.777 | 5.3645 | 16.7829 | 90 |
| cluster_4.pdb ( medoid) | 8.46779 | 11.9276 | 40.7782 | 101 |
| cluster_5.pdb ( medoid) | 6.84903 | 9.78241 | 19.7436 | 67 |
| cluster_6.pdb ( medoid) | 5.65879 | 8.6591 | 29.3672 | 49 |
| cluster_7.pdb ( medoid) | 5.58766 | 7.33759 | 22.45 | 41 |
| cluster_8.pdb ( medoid) | 5.24816 | 11.8137 | 41.2914 | 62 |
| cluster_9.pdb ( medoid) | 2.21801 | 15.7799 | 55.2299 | 35 |
| cluster_10.pdb ( medoid) | 2.04022 | 11.7634 | 19.7893 | 24 |