| Protein sequence(s) | VKSLKKEYSNENAVVKRMQSLQLDCVAVPSSRSNSATEQPGSLHSSQGLGMGPVEESWFAPSLEHPQEENEPSLQSKLQDEANYHLYGSRMDRQTKQQPRQNVAYNREEERRRRVSHDPFAQQRPYENFQNTEGKGTAYSSAASHGNAVHQPSGLTSQPQVLYQNNGLYSSHGFGTRPLDPGTAGPRVWYRPIPSHMPSLHNIPVPETNYLGNTPTMPFSSLPPTDESIKYTIYNSTGIQIGAYNYMEIGGTSSSLLDSTNTNFKEEPAAKYQAIFDNTTSLTDKHLDPIRENLGKHWKNCARKLGFTQSQIDEIDHDYERDGLKEKVYQMLQKWVMREGIKGATVGKLAQALHQCSRIDLLSSLIYVSQN input pdb |
| Peptide sequence | RVIFVQCGSNCR |
| Simulation mc cycles | 50 |
| Peptide secondary structure psipred | CEEEEECCCCCC |
| 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) | 20.7618 | 5.92433 | 42.0798 | 123 |
| cluster_2.pdb ( medoid) | 20.3154 | 6.25142 | 19.8761 | 127 |
| cluster_3.pdb ( medoid) | 15.3111 | 8.49059 | 47.1363 | 130 |
| cluster_4.pdb ( medoid) | 14.1272 | 10.0515 | 34.7539 | 142 |
| cluster_5.pdb ( medoid) | 9.09146 | 11.3293 | 29.6776 | 103 |
| cluster_6.pdb ( medoid) | 8.73211 | 11.7955 | 31.3236 | 103 |
| cluster_7.pdb ( medoid) | 7.71488 | 12.962 | 32.2878 | 100 |
| cluster_8.pdb ( medoid) | 3.11653 | 21.1774 | 43.7613 | 66 |
| cluster_9.pdb ( medoid) | 2.98285 | 22.1265 | 50.5773 | 66 |
| cluster_10.pdb ( medoid) | 2.14387 | 18.6578 | 52.9917 | 40 |