| Protein sequence(s) | MSRIILFAAILAIIAVSANGASNLPALDMASIPDEYKDLVPPEVTTFYNELTEDDKKILKEVAEKHSEYATDEDALNALKEKSEKLYTKANELRNLVKDRISKLNPEAKTFVDTIIEKLKALRPKEDEKPNLTELRKEANEIVEKFKALSEEAKESLKTNFPKITGVIQNEKFQKLAQSLLKPEGAAAPA input pdb |
| Peptide sequence | MKKAVIVENKGCATCSIGAACLV |
| Simulation mc cycles | 50 |
| Peptide secondary structure psipred | CCEEEEECCCCCCEECCCCEEEC |
| 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) | 22.8443 | 4.42123 | 18.4405 | 101 |
| cluster_2.pdb ( medoid) | 16.9996 | 4.58835 | 21.3978 | 78 |
| cluster_3.pdb ( medoid) | 14.9345 | 8.16901 | 24.73 | 122 |
| cluster_4.pdb ( medoid) | 13.3224 | 2.70221 | 11.4656 | 36 |
| cluster_5.pdb ( medoid) | 12.9405 | 12.5961 | 36.0532 | 163 |
| cluster_6.pdb ( medoid) | 11.7832 | 10.6932 | 32.011 | 126 |
| cluster_7.pdb ( medoid) | 8.84168 | 13.9114 | 33.1205 | 123 |
| cluster_8.pdb ( medoid) | 6.90695 | 13.4647 | 34.1094 | 93 |
| cluster_9.pdb ( medoid) | 6.4829 | 11.5689 | 35.3586 | 75 |
| cluster_10.pdb ( medoid) | 5.59809 | 14.8265 | 29.3665 | 83 |