| Protein sequence(s) | NCTCPTNKMTVCSPDGPGGRCQCRALGSGMAVDCSTLTSKCLLLKARMSAPKNARTLVRPSEHALVDNDGLYDPDCDPEGRFKARQCNQTSVCWCVNSVGVRRTDKGDLSLRCDELVRTHHILIDLRHRPTAGAFNHSDLDAELRRLFRERYRLHPKFVAAVHYEQPTIQIELRQNTSQKAAGDVDIGDAAYYFERDIKGESLFQGRGGLDLRVRGEPLQVERTLIYYLDEIPPKFNCTCPTNKMTVCSPDGPGGRCQCRALGSGMAVDCSTLTSKCLLLKARMSAPKNARTLVRPSEHALVDNDGLYDPDCDPEGRFKARQCNQTSVCWCVNSVGVRRTDKGDLSLRCDELVRTHHILIDLRHRPTAGAFNHSDLDAELRRLFRERYRLHPKFVAAVHYEQPTIQIELRQNTSQKAAGDVDIGDAAYYFERDIKGESLFQGRGGLDLRVRGEPLQVERTLIYYLDEIPPKF input pdb |
| Peptide sequence | ADPLDKRFYL |
| Simulation mc cycles | 50 |
| Peptide secondary structure psipred | CCCCCCCCCC |
| 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) | 29.3969 | 5.1366 | 24.467 | 151 |
| cluster_2.pdb ( medoid) | 23.8665 | 8.58945 | 30.0752 | 205 |
| cluster_3.pdb ( medoid) | 21.1308 | 5.15836 | 25.7616 | 109 |
| cluster_4.pdb ( medoid) | 20.4824 | 5.61458 | 17.4227 | 115 |
| cluster_5.pdb ( medoid) | 20.2297 | 7.36542 | 33.3297 | 149 |
| cluster_6.pdb ( medoid) | 10.7606 | 13.4751 | 53.4644 | 145 |
| cluster_7.pdb ( medoid) | 5.0048 | 6.39387 | 32.6783 | 32 |
| cluster_8.pdb ( medoid) | 2.22665 | 17.5151 | 39.9086 | 39 |
| cluster_9.pdb ( medoid) | 2.21828 | 11.27 | 25.7706 | 25 |
| cluster_10.pdb ( medoid) | 1.78967 | 16.7628 | 43.1978 | 30 |