| Protein sequence(s) | EASRQQQRRFNTSSIRDFEFWLSEAETLLAMKDQQARDLASSAGNLLKKHQLLERREMLAREDALKDLNTLAEDDLLSSSGTTFNVDQIVKKKDNNVNKRFLNVQELAAAHHEKLKEAYALFQFFQDLDDEESWIEEKLIRVSSQDYGRDLQGVQNLLKKHKRLEGELVAHEEPAIQNVLDMAEKLKDKAAVGQEEIQLRLAQFVEHWEEKLKELAKARGLKLEESLEYLQFMQ input pdb |
| Peptide sequence | ATFDKNDEDSPIVMHQEDGST |
| Simulation mc cycles | 50 |
| Peptide secondary structure psipred | CCCCCCCCCCCCEEECCCCCC |
| 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) | 18.0359 | 5.32272 | 24.09 | 96 |
| cluster_2.pdb ( medoid) | 15.8923 | 8.43176 | 45.9233 | 134 |
| cluster_3.pdb ( medoid) | 14.398 | 10.1403 | 40.0413 | 146 |
| cluster_4.pdb ( medoid) | 11.8165 | 6.17783 | 11.0887 | 73 |
| cluster_5.pdb ( medoid) | 7.28151 | 13.4587 | 39.1171 | 98 |
| cluster_6.pdb ( medoid) | 6.26258 | 12.934 | 38.4359 | 81 |
| cluster_7.pdb ( medoid) | 5.7008 | 12.9806 | 33.5834 | 74 |
| cluster_8.pdb ( medoid) | 5.01556 | 18.5423 | 35.4934 | 93 |
| cluster_9.pdb ( medoid) | 4.30367 | 15.8005 | 40.9423 | 68 |
| cluster_10.pdb ( medoid) | 3.15348 | 11.7331 | 35.3987 | 37 |