| Protein sequence(s) | FIFHKVLGKGSFGKVLLGELKGRGEYFAIKALKKDVVLIDDDVECTMVEKRVLTLAAENPFLTHLICTFQTKDHLFFVMEFLNGGDLMYHIQDKGRFELYRATFYAAEIMCGLQFLHSKGIIYRDLKLDNVLLDRDGHIKIADFGMCKENIFGESRASTFCGTPDYIAPEILQGLKYTFSVDWWSFGVLLYEMLIGQSPFHGDDEDELFESIRVDTPHYPRWITKESKDILEKLFEREPTKRLGVTGNIKIHPFFKTINWTLLEKRRLEPPFRPKVKSPRDYSNFDQEFLNEKARLSYSDKNLIDSMDQSAFAGFSFVNPKFEHLLED input pdb |
| Peptide sequence | RQLSSGVAEIRHTAD |
| 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) | 37.7922 | 1.34948 | 13.7567 | 51 |
| cluster_2.pdb ( medoid) | 29.6706 | 10.0773 | 38.1531 | 299 |
| cluster_3.pdb ( medoid) | 24.1168 | 5.01725 | 17.2383 | 121 |
| cluster_4.pdb ( medoid) | 18.8321 | 6.7969 | 15.7493 | 128 |
| cluster_5.pdb ( medoid) | 18.3441 | 5.6694 | 33.3224 | 104 |
| cluster_6.pdb ( medoid) | 14.3599 | 5.2925 | 11.9676 | 76 |
| cluster_7.pdb ( medoid) | 11.7063 | 6.06513 | 20.6878 | 71 |
| cluster_8.pdb ( medoid) | 8.03108 | 7.72001 | 32.7037 | 62 |
| cluster_9.pdb ( medoid) | 6.49545 | 8.15956 | 17.9744 | 53 |
| cluster_10.pdb ( medoid) | 4.8498 | 7.21679 | 14.3372 | 35 |