| Protein sequence(s) | VKSLKKEYSNENAVVKRMQSLQLDCVAVPSSRSNSATEQPGSLHSSQGLGMGPVEESWFAPSLEHPQEENEPSLQSKLQDEANYHLYGSRMDRQTKQQPRQNVAYNREEERRRRVSHDPFAQQRPYENFQNTEGKGTAYSSAASHGNAVHQPSGLTSQPQVLYQNNGLYSSHGFGTRPLDPGTAGPRVWYRPIPSHMPSLHNIPVPETNYLGNTPTMPFSSLPPTDESIKYTIYNSTGIQIGAYNYMEIGGTSSSLLDSTNTNFKEEPAAKYQAIFDNTTSLTDKHLDPIRENLGKHWKNCARKLGFTQSQIDEIDHDYERDGLKEKVYQMLQKWVMREGIKGATVGKLAQALHQCSRIDLLSSLIYVSQN input pdb |
| Peptide sequence | RRRRRRHGGVQLFGSNDA |
| Simulation mc cycles | 50 |
| Peptide secondary structure psipred | CCCCCCCCCCCCCCCCCC |
| 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) | 18.2585 | 6.3532 | 37.5549 | 116 |
| cluster_2.pdb ( medoid) | 18.1286 | 6.45389 | 32.1873 | 117 |
| cluster_3.pdb ( medoid) | 13.5746 | 8.61901 | 39.0184 | 117 |
| cluster_4.pdb ( medoid) | 13.1721 | 11.0081 | 54.1504 | 145 |
| cluster_5.pdb ( medoid) | 8.35886 | 12.5615 | 26.2864 | 105 |
| cluster_6.pdb ( medoid) | 6.89617 | 16.9659 | 51.5422 | 117 |
| cluster_7.pdb ( medoid) | 5.2663 | 11.2033 | 45.6816 | 59 |
| cluster_8.pdb ( medoid) | 4.70423 | 19.5569 | 44.5909 | 92 |
| cluster_9.pdb ( medoid) | 4.0211 | 19.149 | 54.3065 | 77 |
| cluster_10.pdb ( medoid) | 3.5771 | 15.3756 | 34.3011 | 55 |