| Protein sequence(s) | MDVFMKGLSKAKEGVVAAAEKTKQGVAEAAGKTKEGVLYVGSKTKEGVVHGVATVAEKTKEQVTNVGGAVVTGVTAVAQKTVEGAGSIAAATGFVKKDQLGKNEEGAPQEGILEDMPVDPDNEAYEMPSEEGYQDYEPEA input pdb |
| Peptide sequence | IGASWPDHATT |
| Simulation mc cycles | 50 |
| Peptide secondary structure psipred | CCCCCCCCCCC |
| 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) | 23.9637 | 5.29967 | 25.7075 | 127 |
| cluster_2.pdb ( medoid) | 21.8267 | 5.81856 | 18.5135 | 127 |
| cluster_3.pdb ( medoid) | 12.3476 | 8.09876 | 18.0828 | 100 |
| cluster_4.pdb ( medoid) | 10.5767 | 12.0075 | 24.748 | 127 |
| cluster_5.pdb ( medoid) | 10.2957 | 12.0438 | 27.2971 | 124 |
| cluster_6.pdb ( medoid) | 8.46702 | 12.2829 | 25.3179 | 104 |
| cluster_7.pdb ( medoid) | 7.89147 | 14.446 | 28.679 | 114 |
| cluster_8.pdb ( medoid) | 7.69524 | 8.83663 | 19.9169 | 68 |
| cluster_9.pdb ( medoid) | 5.13734 | 9.92731 | 21.2024 | 51 |
| cluster_10.pdb ( medoid) | 4.37339 | 13.262 | 28.4719 | 58 |