| Protein sequence(s) | RDDWRCARSMHEFSAKDIDGHMVNLDKYRGFVCIVTNVASQCGKTEVNYTQLVDLHARYAECGLRILAFPCNQFGKQEPGSNEEIKEFAAGYNVKFDMFSKICVNGDDAHPLWKWMKIQPKGKGILGNAIKWNFTKFLIDKNGCVVKRYGPMEEPLVIEKDLPHYF input pdb |
| Peptide sequence | CKFHY |
| Simulation mc cycles | 50 |
| Peptide secondary structure psipred | CCCCC |
| 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) | 29.6949 | 6.49944 | 25.1977 | 193 |
| cluster_2.pdb ( medoid) | 19.8859 | 5.07898 | 36.5248 | 101 |
| cluster_3.pdb ( medoid) | 19.6341 | 4.3292 | 17.782 | 85 |
| cluster_4.pdb ( medoid) | 18.567 | 6.19379 | 19.0043 | 115 |
| cluster_5.pdb ( medoid) | 17.3228 | 5.42639 | 19.8028 | 94 |
| cluster_6.pdb ( medoid) | 16.5591 | 3.32144 | 16.9327 | 55 |
| cluster_7.pdb ( medoid) | 10.975 | 12.574 | 31.5103 | 138 |
| cluster_8.pdb ( medoid) | 10.5673 | 8.04369 | 31.2476 | 85 |
| cluster_9.pdb ( medoid) | 9.14456 | 10.17 | 31.4215 | 93 |
| cluster_10.pdb ( medoid) | 4.19955 | 9.76295 | 27.4549 | 41 |