| Protein sequence(s) | MVLSDKTPGSASYRISDNNFVQCGSNCTMIIDGDVVRGRPQDPGAAASPAMVLSDKTPGSASYRISDNNFVQCGSNCTMIIDGDVVRGRPQDPGAAASPA 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) | 89.5566 | 0.725798 | 1.69515 | 65 |
| cluster_2.pdb ( medoid) | 72.6337 | 1.39054 | 11.973 | 101 |
| cluster_3.pdb ( medoid) | 23.7266 | 7.12282 | 22.7038 | 169 |
| cluster_4.pdb ( medoid) | 23.5078 | 1.5314 | 14.3602 | 36 |
| cluster_5.pdb ( medoid) | 19.2405 | 5.87303 | 22.0449 | 113 |
| cluster_6.pdb ( medoid) | 18.2234 | 7.13367 | 32.4603 | 130 |
| cluster_7.pdb ( medoid) | 13.857 | 13.062 | 31.1082 | 181 |
| cluster_8.pdb ( medoid) | 8.89485 | 12.3667 | 29.8422 | 110 |
| cluster_9.pdb ( medoid) | 4.70488 | 12.9653 | 30.6978 | 61 |
| cluster_10.pdb ( medoid) | 2.83863 | 11.9776 | 27.4238 | 34 |