| Protein sequence(s) | GEAPNQALLRILKETEFKKIKVLGSGAFGTVYKGLWIPEGEKVKIPVAIKELREATSPKANKEILDEAYVMASVDNPHVCRLLGICLTSTVQLITQLMPFGCLLDYVREHKDNIGSQYLLNWCVQIAKGMNYLEDRRLVHRDLAARNVLVKTPQHVKITDFGLAKLLGAEEKEYHAEGGKVPIKWMALESILHRIYTHQSDVWSYGVTVWELMTFGSKPYDGIPASEISSILEKGERLPQPPICTIDVYMIMVKCWMIDADSRPKFRELIIEFSKMARDPQRYLVIQGDERMHLMDEEDMDDVVDADEYLIP input pdb |
| Peptide sequence | EGIFGGFMLGVKSISGMAFS |
| Simulation mc cycles | 50 |
| Peptide secondary structure psipred | CCCCCCEECCCEEEECCCCC |
| 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) | 47.2866 | 2.2205 | 32.0784 | 105 |
| cluster_2.pdb ( medoid) | 18.4782 | 4.49179 | 23.229 | 83 |
| cluster_3.pdb ( medoid) | 14.1283 | 7.92735 | 28.9433 | 112 |
| cluster_4.pdb ( medoid) | 13.6638 | 10.5388 | 54.3449 | 144 |
| cluster_5.pdb ( medoid) | 10.7666 | 8.82362 | 28.4667 | 95 |
| cluster_6.pdb ( medoid) | 10.2474 | 9.85612 | 34.282 | 101 |
| cluster_7.pdb ( medoid) | 10.1468 | 5.61751 | 26.8891 | 57 |
| cluster_8.pdb ( medoid) | 8.99446 | 12.2297 | 37.0124 | 110 |
| cluster_9.pdb ( medoid) | 8.9801 | 14.9219 | 43.7016 | 134 |
| cluster_10.pdb ( medoid) | 2.25281 | 26.1895 | 57.4587 | 59 |