| Protein sequence(s) | SLSTIICIGMAGSGKTTFMQRLNSHLRAEKTPPYVINLDPAVLRVPYGANIDIRDSIKYKKVGPNGAIVTSLNLFSTKIDQVIRLVEQKKDKFQNCIIDTPGQIECFVWSASGAIITESFASSFPTVIAYIVDTPRASSPTTFMSNMLYACSILYKTKLPMIVVFNKTDVCKADFAKEWMTDFESFQAAIKEDQDGYMSSLVNSMSLMLEEFYSQLDVVGVSSFTGDGFDEFMQCVDKKVDEYDQYYKKHHHH input pdb |
| Peptide sequence | KNTMQYLTNFSRFRD |
| Simulation mc cycles | 50 |
| Peptide secondary structure psipred | CCCHHHHHCHHHHCC |
| 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) | 43.8493 | 1.73321 | 12.6611 | 76 |
| cluster_2.pdb ( medoid) | 41.3392 | 4.59612 | 17.5445 | 190 |
| cluster_3.pdb ( medoid) | 30.8042 | 4.31759 | 7.85108 | 133 |
| cluster_4.pdb ( medoid) | 29.7562 | 5.54506 | 15.4906 | 165 |
| cluster_5.pdb ( medoid) | 22.5148 | 2.08751 | 6.56047 | 47 |
| cluster_6.pdb ( medoid) | 19.4996 | 2.56415 | 24.6236 | 50 |
| cluster_7.pdb ( medoid) | 19.2112 | 2.91497 | 6.63968 | 56 |
| cluster_8.pdb ( medoid) | 18.9739 | 4.90148 | 11.0758 | 93 |
| cluster_9.pdb ( medoid) | 15.2437 | 5.64168 | 17.3912 | 86 |
| cluster_10.pdb ( medoid) | 8.34407 | 12.4639 | 38.4375 | 104 |