| Protein sequence(s) | KAAAIGIDLGTTYSCIGVFQHGKVEIIANDQGNRTTPSYVAFTDTERLIGDAAKNQVALNPQNTVFDAKRLIGRKFGDPVVQSDMKHWPFQVINDGDKPKVQVSYKGETKAFYPEEISSMVLTKMKEIAEAYLGYPVTNAVITVPAYFNDSQRQATKDAGVIAGLNVLRIINEPTAAAIAYGLDRTGKGERNVLIFDLGGGTFDVSILTIDDGIFEVKATAGDTHLGGEDFDNRLVNHFVEEFKRKHKKDISQNKRAVRRLRTACERAKRTLSSSTQASLEIDSLFEGIDFYTSITRARFEELCSDLFRSTLEPVEKALRDAKLDKAQIHDLVLVGGSTRIPKVQKLLQDFFNGRDLNKSINPDEAVAYGAAVQAAILMG input pdb |
| Peptide sequence | KVLNGPEEEAAAPAE |
| Simulation mc cycles | 50 |
| Peptide secondary structure psipred | CCCCCHHHHHCCCCC |
| 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) | 39.0213 | 3.25463 | 16.0291 | 127 |
| cluster_2.pdb ( medoid) | 25.4266 | 4.09021 | 30.8252 | 104 |
| cluster_3.pdb ( medoid) | 22.0642 | 4.48691 | 9.72984 | 99 |
| cluster_4.pdb ( medoid) | 16.9236 | 6.32254 | 29.0503 | 107 |
| cluster_5.pdb ( medoid) | 15.721 | 7.56948 | 15.8715 | 119 |
| cluster_6.pdb ( medoid) | 13.4293 | 7.14854 | 38.588 | 96 |
| cluster_7.pdb ( medoid) | 12.9036 | 3.95239 | 9.76484 | 51 |
| cluster_8.pdb ( medoid) | 10.7654 | 6.6881 | 22.3237 | 72 |
| cluster_9.pdb ( medoid) | 8.97354 | 8.35791 | 30.4528 | 75 |
| cluster_10.pdb ( medoid) | 6.01703 | 10.1379 | 37.6263 | 61 |