| Protein sequence(s) | SLSTIICIGMAGSGKTTFMQRLNSHLRAEKTPPYVINLDPAVLRVPYGANIDIRDSIKYKKVGPNGAIVTSLNLFSTKIDQVIRLVEQKKDKFQNCIIDTPGQIECFVWSASGAIITESFASSFPTVIAYIVDTPRNSSPTTAMSNMLYACSILYKTKLPMIVVFNKTDVCKADFAKEWMTDFESFQAAIKEDQDGYMSSLVNSMSLMLEEFYSQLDVVGVSSFTGDGFDEFMQCVDKKVDEYDQYYKKHHHH 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) | 80.817 | 1.27448 | 17.4068 | 103 |
| cluster_2.pdb ( medoid) | 35.4919 | 2.78937 | 9.66519 | 99 |
| cluster_3.pdb ( medoid) | 28.5367 | 2.66324 | 10.919 | 76 |
| cluster_4.pdb ( medoid) | 27.0318 | 7.13973 | 31.3072 | 193 |
| cluster_5.pdb ( medoid) | 26.0322 | 3.99505 | 16.7678 | 104 |
| cluster_6.pdb ( medoid) | 18.0415 | 10.8084 | 38.4049 | 195 |
| cluster_7.pdb ( medoid) | 13.5327 | 8.57186 | 26.2418 | 116 |
| cluster_8.pdb ( medoid) | 10.703 | 3.36356 | 10.6856 | 36 |
| cluster_9.pdb ( medoid) | 10.5462 | 4.5514 | 24.3102 | 48 |
| cluster_10.pdb ( medoid) | 1.82272 | 16.4589 | 34.4099 | 30 |