| Protein sequence(s) | GVQVETISPGDGRTFPKRGQTCVVHYTGMLEDGKKFDSSRDRNKPFKFMLGKQEVIRGWQEGVAQMSVGQRAKLTISPDYAYGATGHPGIIPPHATLVFDVELLKLE input pdb |
| Peptide sequence | IQETYSEESCSTVTRGYKSV |
| Simulation mc cycles | 50 |
| Peptide secondary structure psipred | CCCCCCHHHCCCCCCCCCCC |
| 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) | 30.2474 | 4.1987 | 16.7633 | 127 |
| cluster_2.pdb ( medoid) | 26.5364 | 3.69304 | 17.7909 | 98 |
| cluster_3.pdb ( medoid) | 17.8251 | 11.5568 | 36.2814 | 206 |
| cluster_4.pdb ( medoid) | 14.4934 | 8.62461 | 35.2424 | 125 |
| cluster_5.pdb ( medoid) | 10.1013 | 10.6917 | 38.4588 | 108 |
| cluster_6.pdb ( medoid) | 8.59633 | 10.3532 | 28.6167 | 89 |
| cluster_7.pdb ( medoid) | 6.3293 | 13.5876 | 34.4273 | 86 |
| cluster_8.pdb ( medoid) | 4.8196 | 18.2588 | 33.7683 | 88 |
| cluster_9.pdb ( medoid) | 3.17493 | 16.0633 | 32.259 | 51 |
| cluster_10.pdb ( medoid) | 2.30006 | 9.56499 | 22.3065 | 22 |