| Protein sequence(s) | MSRIILFAAILAIIAVSANGASNLPALDMASIPDEYKDLVPPEVTTFYNELTEDDKKILKEVAEKHSEYATDEDALNALKEKSEKLYTKANELRNLVKDRISKLNPEAKTFVDTIIEKLKALRPKEDEKPNLTELRKEANEIVEKFKALSEEAKESLKTNFPKITGVIQNEKFQKLAQSLLKPEGAAAPA input pdb |
| Peptide sequence | MKKAVIVENKGCATCSIGAACLVDT |
| Simulation mc cycles | 50 |
| Peptide secondary structure psipred | CCEEEEEECCCCCCCCCCCEEEECC |
| 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) | 24.9502 | 4.52901 | 33.3079 | 113 |
| cluster_2.pdb ( medoid) | 20.3114 | 6.00648 | 35.0514 | 122 |
| cluster_3.pdb ( medoid) | 16.2232 | 5.42435 | 14.5655 | 88 |
| cluster_4.pdb ( medoid) | 15.6125 | 8.45476 | 31.5733 | 132 |
| cluster_5.pdb ( medoid) | 12.6787 | 8.43935 | 32.426 | 107 |
| cluster_6.pdb ( medoid) | 7.40152 | 9.45752 | 29.8041 | 70 |
| cluster_7.pdb ( medoid) | 7.07077 | 18.9513 | 39.3009 | 134 |
| cluster_8.pdb ( medoid) | 6.28394 | 6.52456 | 14.8278 | 41 |
| cluster_9.pdb ( medoid) | 5.91233 | 15.3916 | 33.6217 | 91 |
| cluster_10.pdb ( medoid) | 5.54076 | 18.409 | 38.1186 | 102 |