| Protein sequence(s) | ECGWRIGEAGTDPNLNHQQFRAKILSIWEECECGWRIGEAGTDPNLNHQQFRAKILSIWEECPSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQLVVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIKSPCQAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESGQVYFGIIALSDKPVAHVVANPQAEGQLQWLNRRANALLANGVELRDNQLVVPSEGLYLIYSQVLFKGQGCPSTHVLLTHTISRIAVSYQTKVNLLSAIKSPCQRETPEGAEAKPWYEPIYLGGVFQLEKGDRLSAEINRPDYLDFAESGQVYFGIIAL input pdb |
| Peptide sequence | GPAGPAGPAGARGPAGPQ |
| Simulation mc cycles | 50 |
| Peptide secondary structure psipred | CCCCCCCCCCCCCCCCCC |
| 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) | 43.6498 | 2.31387 | 18.8266 | 101 |
| cluster_2.pdb ( medoid) | 30.5505 | 8.70689 | 19.4565 | 266 |
| cluster_3.pdb ( medoid) | 28.4272 | 2.14583 | 19.4789 | 61 |
| cluster_4.pdb ( medoid) | 26.664 | 1.65016 | 17.8376 | 44 |
| cluster_5.pdb ( medoid) | 17.6629 | 9.34161 | 29.0165 | 165 |
| cluster_6.pdb ( medoid) | 13.9729 | 6.94203 | 18.521 | 97 |
| cluster_7.pdb ( medoid) | 10.7841 | 7.9747 | 25.0845 | 86 |
| cluster_8.pdb ( medoid) | 7.87587 | 12.824 | 29.2802 | 101 |
| cluster_9.pdb ( medoid) | 6.0888 | 9.36145 | 32.0501 | 57 |
| cluster_10.pdb ( medoid) | 4.18103 | 5.26187 | 21.9336 | 22 |