| Protein sequence(s) | MVLSDKTPGSASYRISDNNFVQCGSNCTMIIDGDVVRGRPQDPGAAASPAMVLSDKTPGSASYRISDNNFVQCGSNCTMIIDGDVVRGRPQDPGAAASPA input pdb |
| Peptide sequence | RRRRVQLFGSNTYRR |
| Simulation mc cycles | 50 |
| Peptide secondary structure psipred | CCCCEECCCCCCCCC |
| 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) | 25.2624 | 5.77935 | 26.559 | 146 |
| cluster_2.pdb ( medoid) | 24.5769 | 6.63224 | 28.1934 | 163 |
| cluster_3.pdb ( medoid) | 23.3537 | 3.8966 | 8.99536 | 91 |
| cluster_4.pdb ( medoid) | 20.0366 | 7.5362 | 38.1404 | 151 |
| cluster_5.pdb ( medoid) | 15.7581 | 4.44216 | 10.5327 | 70 |
| cluster_6.pdb ( medoid) | 8.1779 | 11.0053 | 35.3039 | 90 |
| cluster_7.pdb ( medoid) | 8.05051 | 6.21079 | 18.9411 | 50 |
| cluster_8.pdb ( medoid) | 5.1727 | 16.4324 | 31.319 | 85 |
| cluster_9.pdb ( medoid) | 4.94924 | 16.9723 | 33.0157 | 84 |
| cluster_10.pdb ( medoid) | 3.9301 | 17.8112 | 36.4057 | 70 |