| Protein sequence(s) | KRQWALEDFEIGRPLGKGKFGNVYLAREKQSKFILALKVLFKAQLEKAGVEHQLRREVEIQSHLRHPNILRLYGYFHDATRVYLILEYAPLGTVYRELQKLSKFDEQRTATYITELANALSYCHSKRVIHRDIKPENLLLGSAGELKIADFGWSVHAPSSRRTTLCGTLDYLPPEMIEGRMHDEKVDLWSLGVLCYEFLVGKPPFEANTYQETYKRISRVEFTFPDFVTEGARDLISRLLKHNPSQRPMLREVLEHPWITANSSK input pdb |
| Peptide sequence | SYSYDAPSDFINFSS |
| Simulation mc cycles | 50 |
| Peptide secondary structure | 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) | 90.9303 | 0.835805 | 3.45044 | 76 |
| cluster_2.pdb ( medoid) | 42.2776 | 2.43628 | 21.1031 | 103 |
| cluster_3.pdb ( medoid) | 33.4325 | 5.17461 | 12.9085 | 173 |
| cluster_4.pdb ( medoid) | 25.4031 | 7.32193 | 29.7871 | 186 |
| cluster_5.pdb ( medoid) | 24.6776 | 3.84964 | 19.7923 | 95 |
| cluster_6.pdb ( medoid) | 24.3979 | 3.64786 | 6.68317 | 89 |
| cluster_7.pdb ( medoid) | 15.5939 | 7.24643 | 24.7322 | 113 |
| cluster_8.pdb ( medoid) | 12.5472 | 6.93382 | 36.545 | 87 |
| cluster_9.pdb ( medoid) | 11.1868 | 5.18467 | 24.7583 | 58 |
| cluster_10.pdb ( medoid) | 1.3896 | 14.3926 | 26.8832 | 20 |