| Protein sequence(s) | VKSLKKEYSNENAVVKRMQSLQLDCVAVPSSRSNSATEQPGSLHSSQGLGMGPVEESWFAPSLEHPQEENEPSLQSKLQDEANYHLYGSRMDRQTKQQPRQNVAYNREEERRRRVSHDPFAQQRPYENFQNTEGKGTAYSSAASHGNAVHQPSGLTSQPQVLYQNNGLYSSHGFGTRPLDPGTAGPRVWYRPIPSHMPSLHNIPVPETNYLGNTPTMPFSSLPPTDESIKYTIYNSTGIQIGAYNYMEIGGTSSSLLDSTNTNFKEEPAAKYQAIFDNTTSLTDKHLDPIRENLGKHWKNCARKLGFTQSQIDEIDHDYERDGLKEKVYQMLQKWVMREGIKGATVGKLAQALHQCSRIDLLSSLIYVSQN input pdb |
| Peptide sequence | RRRRVQVFGSNTYRR |
| Simulation mc cycles | 50 |
| Peptide secondary structure psipred | CCCCEEECCCCCCCC |
| 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) | 27.5208 | 3.99698 | 33.8521 | 110 |
| cluster_2.pdb ( medoid) | 16.6774 | 9.41395 | 27.658 | 157 |
| cluster_3.pdb ( medoid) | 15.3475 | 8.6659 | 28.9255 | 133 |
| cluster_4.pdb ( medoid) | 14.1544 | 10.2441 | 56.8332 | 145 |
| cluster_5.pdb ( medoid) | 12.6565 | 13.4318 | 41.5111 | 170 |
| cluster_6.pdb ( medoid) | 10.9009 | 9.72393 | 44.0358 | 106 |
| cluster_7.pdb ( medoid) | 7.68853 | 10.6652 | 26.9324 | 82 |
| cluster_8.pdb ( medoid) | 4.13185 | 11.6171 | 39.0558 | 48 |
| cluster_9.pdb ( medoid) | 2.09191 | 13.8629 | 32.5999 | 29 |
| cluster_10.pdb ( medoid) | 1.10214 | 18.1466 | 29.8336 | 20 |