| Protein sequence(s) | TDVTSKVTVEIGSIEGHNNTNKVEPHAGQRAVLKYKLKFENGLHQQGDYFDFTLSNNVNTHGVSTARKVPEIKNGSVVMATGEVLEGGKIRYTFTNDIEDKVDVTAELEINLFIDPKTVQTNGNQTITSTLNEEQTSKELDVKYKDGIGNYYANLNGSIETFNKANNRFSHVAFIKPNNGKTTSVTVTGTLMKGSNQNGNQPKVRIFEYLGNNEDIAKSVYANTTDTSKFKEVTSNMGNLNLQNNGSYSLNIENLDKTYVVHYDGEYLNGTDEVDFRTQMVGHPEGYTLTWDNGLVLYSN input pdb |
| Peptide sequence | DALEIYVDDEK |
| Simulation mc cycles | 50 |
| Peptide secondary structure psipred | CCEEEEECCCC |
| 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) | 32.2211 | 5.74158 | 30.9103 | 185 |
| cluster_2.pdb ( medoid) | 31.8274 | 3.48756 | 9.89489 | 111 |
| cluster_3.pdb ( medoid) | 29.4145 | 4.3176 | 15.2611 | 127 |
| cluster_4.pdb ( medoid) | 25.5626 | 4.81172 | 17.5681 | 123 |
| cluster_5.pdb ( medoid) | 14.2174 | 9.4251 | 33.5449 | 134 |
| cluster_6.pdb ( medoid) | 14.2089 | 8.1639 | 36.2273 | 116 |
| cluster_7.pdb ( medoid) | 7.21635 | 10.3931 | 33.8496 | 75 |
| cluster_8.pdb ( medoid) | 6.1695 | 9.88735 | 22.1277 | 61 |
| cluster_9.pdb ( medoid) | 4.36037 | 8.02683 | 18.8887 | 35 |
| cluster_10.pdb ( medoid) | 2.74605 | 12.0173 | 23.0345 | 33 |