| 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) | 33.2042 | 3.73446 | 13.8668 | 124 |
| cluster_2.pdb ( medoid) | 32.0078 | 3.87405 | 27.5032 | 124 |
| cluster_3.pdb ( medoid) | 31.9918 | 7.59571 | 27.7761 | 243 |
| cluster_4.pdb ( medoid) | 27.9171 | 4.01188 | 29.5366 | 112 |
| cluster_5.pdb ( medoid) | 11.996 | 5.25176 | 19.2336 | 63 |
| cluster_6.pdb ( medoid) | 11.6889 | 5.81747 | 21.969 | 68 |
| cluster_7.pdb ( medoid) | 7.92345 | 7.19384 | 26.4755 | 57 |
| cluster_8.pdb ( medoid) | 6.6277 | 13.1267 | 29.7379 | 87 |
| cluster_9.pdb ( medoid) | 5.74716 | 11.4839 | 30.3732 | 66 |
| cluster_10.pdb ( medoid) | 4.25444 | 13.1627 | 31.4316 | 56 |