| Protein sequence(s) | APYGARMPFGGQVPLGAPPPFPTWPGCPQPPPLHAWQAGTPPPPSPQPAAFPQSLPFPQSPAFPTASPAPPQSPGLQPLIIHHAQMVQLGLNNHMWNQRGSQAPEDKTQEAE input pdb |
| Peptide sequence | KRLVQVFGSNTYRLK |
| Simulation mc cycles | 50 |
| Peptide secondary structure psipred | CCCEEECCCCCEECC |
| 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) | 23.796 | 5.4631 | 23.2913 | 130 |
| cluster_2.pdb ( medoid) | 20.4075 | 6.71321 | 32.7735 | 137 |
| cluster_3.pdb ( medoid) | 19.6249 | 7.89814 | 46.8081 | 155 |
| cluster_4.pdb ( medoid) | 16.5216 | 9.44217 | 37.6854 | 156 |
| cluster_5.pdb ( medoid) | 7.05523 | 10.6304 | 21.4486 | 75 |
| cluster_6.pdb ( medoid) | 6.79552 | 10.4481 | 30.5383 | 71 |
| cluster_7.pdb ( medoid) | 5.76611 | 14.5679 | 40.2642 | 84 |
| cluster_8.pdb ( medoid) | 5.71785 | 14.5159 | 34.2147 | 83 |
| cluster_9.pdb ( medoid) | 3.7308 | 15.2782 | 40.0328 | 57 |
| cluster_10.pdb ( medoid) | 3.33667 | 15.5844 | 35.0358 | 52 |