| Protein sequence(s) | ETGDQRFGDLVFRQLAPNVWQHTSYLDMPGFGAVASNGLIVRDGGRVLVVDTAWTDDQTAQILNWIKQEINLPVALAVVTHAHQQDKMGGMDALHAAGIATYANALSNQLAPQEGMVAAQHSLTFAANGWVEPATAPNFGPLKVFYPGPGHTSDNITVGIDGTDIAFGGCLIKDSKAKSLGNLGDADTEHYAASARAFGAAFPKASMIVMSHSAPDSRAAITHTARMADKLR input pdb |
| Peptide sequence | YAYATFGF |
| Simulation mc cycles | 50 |
| Peptide secondary structure psipred | CCCCCCCC |
| 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) | 48.8029 | 1.88513 | 13.8443 | 92 |
| cluster_2.pdb ( medoid) | 32.9972 | 4.36401 | 12.1665 | 144 |
| cluster_3.pdb ( medoid) | 32.6098 | 2.29993 | 9.5472 | 75 |
| cluster_4.pdb ( medoid) | 26.9206 | 3.30602 | 8.56348 | 89 |
| cluster_5.pdb ( medoid) | 24.1672 | 5.50333 | 17.7371 | 133 |
| cluster_6.pdb ( medoid) | 24.1056 | 4.52178 | 13.5623 | 109 |
| cluster_7.pdb ( medoid) | 17.2548 | 5.91141 | 13.0846 | 102 |
| cluster_8.pdb ( medoid) | 8.77775 | 15.1519 | 44.0705 | 133 |
| cluster_9.pdb ( medoid) | 8.09323 | 10.379 | 37.4211 | 84 |
| cluster_10.pdb ( medoid) | 3.21702 | 12.123 | 42.4708 | 39 |