| Protein sequence(s) | VKSLKKEYSNENAVVKRMQSLQLDCVAVPSSRSNSATEQPGSLHSSQGLGMGPVEESWFAPSLEHPQEENEPSLQSKLQDEANYHLYGSRMDRQTKQQPRQNVAYNREEERRRRVSHDPFAQQRPYENFQNTEGKGTAYSSAASHGNAVHQPSGLTSQPQVLYQNNGLYSSHGFGTRPLDPGTAGPRVWYRPIPSHMPSLHNIPVPETNYLGNTPTMPFSSLPPTDESIKYTIYNSTGIQIGAYNYMEIGGTSSSLLDSTNTNFKEEPAAKYQAIFDNTTSLTDKHLDPIRENLGKHWKNCARKLGFTQSQIDEIDHDYERDGLKEKVYQMLQKWVMREGIKGATVGKLAQALHQCSRIDLLSSLIYVSQN input pdb |
| Peptide sequence | VQLFGSNDA |
| Simulation mc cycles | 50 |
| Peptide secondary structure psipred | CCCCCCCCC |
| 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) | 43.8934 | 2.36937 | 27.9734 | 104 |
| cluster_2.pdb ( medoid) | 30.3201 | 3.66094 | 19.354 | 111 |
| cluster_3.pdb ( medoid) | 26.7095 | 3.89375 | 15.9578 | 104 |
| cluster_4.pdb ( medoid) | 24.5407 | 4.72684 | 32.409 | 116 |
| cluster_5.pdb ( medoid) | 9.236 | 9.09485 | 22.9688 | 84 |
| cluster_6.pdb ( medoid) | 5.82337 | 13.2226 | 30.1828 | 77 |
| cluster_7.pdb ( medoid) | 5.41686 | 10.7073 | 32.9347 | 58 |
| cluster_8.pdb ( medoid) | 4.90633 | 13.452 | 28.0306 | 66 |
| cluster_9.pdb ( medoid) | 3.42642 | 11.674 | 23.7305 | 40 |
| cluster_10.pdb ( medoid) | 3.16246 | 12.6484 | 29.7474 | 40 |