| Protein sequence(s) | DWEIPDGQITVGQRIGSGSFGTVYKGKWHGDVAVKMLNVTAPTPQQQLQAFKNEVGVLRKTRHVNILLFMGYSTKPQLAIVTQWCEGSSLYKHLHASETKFEMKKLIDIARQTARGMDYLHAKSIIHRRDLKSNNIFLHEDNNTVKIGDFGLATVKSRWSGSHQFEQLSGSILWMAPEVIRMQDSNPYSFQSDVYAFGIVLYELMTGQLPYSNINNNRDQIIEMVGRGSLSPDLSKVRSNCPKRMKRLMAEECLKKKRDERPSFPRILAEIEELARE input pdb |
| Peptide sequence | KTRHVNILLFM |
| Simulation mc cycles | 50 |
| Peptide secondary structure psipred | CCCEEEEEEEC |
| 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) | 56.9717 | 2.33449 | 6.11632 | 133 |
| cluster_2.pdb ( medoid) | 37.9846 | 2.81693 | 12.9199 | 107 |
| cluster_3.pdb ( medoid) | 28.2014 | 5.31888 | 11.0373 | 150 |
| cluster_4.pdb ( medoid) | 20.0812 | 5.27857 | 17.6948 | 106 |
| cluster_5.pdb ( medoid) | 15.3258 | 9.39589 | 26.5484 | 144 |
| cluster_6.pdb ( medoid) | 13.7841 | 7.39982 | 27.766 | 102 |
| cluster_7.pdb ( medoid) | 12.6783 | 8.9129 | 31.2316 | 113 |
| cluster_8.pdb ( medoid) | 6.65056 | 9.0218 | 31.4258 | 60 |
| cluster_9.pdb ( medoid) | 3.42347 | 12.8524 | 31.8663 | 44 |
| cluster_10.pdb ( medoid) | 2.7805 | 14.7456 | 34.3107 | 41 |