| Protein sequence(s) | GFGNQGGFGNSRGGGAGLGNNQGSNMGGGMNFGAFSINPAMMAAAQAALQSSWGMMGMLASQQNQSGPSGNNQNQGNMQGFGNQGGFGNSRGGGAGLGNNQGSNMGGGMNFGAFSINPAMMAAAQAALQSSWGMMGMLASQQNQSGPSGNNQNQGNMQGFGNQGGFGNSRGGGAGLGNNQGSNMGGGMNFGAFSINPAMMAAAQAALQSSWGMMGMLASQQNQSGPSGNNQNQGNMQGFGNQGGFGNSRGGGAGLGNNQGSNMGGGMNFGAFSINPAMMAAAQAALQSSWGMMGMLASQQNQSGPSGNNQNQGNMQ input pdb |
| Peptide sequence | MNFGYFYINP |
| Simulation mc cycles | 50 |
| Peptide secondary structure psipred | CCCCEEEECC |
| 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) | 62.5852 | 1.64576 | 29.6649 | 103 |
| cluster_2.pdb ( medoid) | 33.2167 | 3.04064 | 15.5035 | 101 |
| cluster_3.pdb ( medoid) | 25.4118 | 3.38426 | 15.75 | 86 |
| cluster_4.pdb ( medoid) | 24.8853 | 6.67061 | 35.3527 | 166 |
| cluster_5.pdb ( medoid) | 15.5837 | 6.5453 | 28.8326 | 102 |
| cluster_6.pdb ( medoid) | 14.2244 | 10.6858 | 37.9805 | 152 |
| cluster_7.pdb ( medoid) | 10.9493 | 11.0509 | 30.2133 | 121 |
| cluster_8.pdb ( medoid) | 8.5539 | 3.62408 | 24.5585 | 31 |
| cluster_9.pdb ( medoid) | 6.20126 | 12.9006 | 35.2664 | 80 |
| cluster_10.pdb ( medoid) | 3.74878 | 15.4717 | 45.2921 | 58 |