| Protein sequence(s) | MAQAPADPGREGHLEQRILQVLTEAGSPVKLAQLVKECQAPKRELNQVLYRMKKELKVSLTSPATWCLGGTDPEGEGPAELALSSPAERPQQHAATIPETPGPQFSQQREEDIYRFLKDNGPQRALVIAQALGMRTAKDVNRDLYRMKSRHLLDMDEQSKAWTIYRPEDSGRRAKSASIIYQHNPINMICQNGPNSWISIANSEAIQIGHGNIITRQTVSREDGSAGPRHLPSMAPGDSSTWGTLVDPWGPQDIHMEQSILRRVQLGHSNEMRLHGVPSEGPAHIPPGSPPVSATAAGPEASFEARIPSPGTHPEGEAAQRIHMKSCFLEDATIGNSNKMSISPGVAGPGGVAGSGEGEPGEDAGRRPADTQSRSHFPRDIGQPITPSHSKLTPKLETMTLGNRSHKAAEGSHYVDEASHEGSWWGGGI input pdb |
| Peptide sequence | VQVFGSNCY |
| Simulation mc cycles | 50 |
| Peptide secondary structure psipred | CCCCCCCCC |
| 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) | 21.461 | 6.01091 | 39.1425 | 129 |
| cluster_2.pdb ( medoid) | 20.4649 | 3.8114 | 13.7306 | 78 |
| cluster_3.pdb ( medoid) | 15.6495 | 4.92029 | 14.3531 | 77 |
| cluster_4.pdb ( medoid) | 13.2728 | 8.06158 | 28.9937 | 107 |
| cluster_5.pdb ( medoid) | 8.77656 | 15.0401 | 34.5789 | 132 |
| cluster_6.pdb ( medoid) | 5.82509 | 7.21019 | 14.7176 | 42 |
| cluster_7.pdb ( medoid) | 5.69493 | 5.61903 | 15.9568 | 32 |
| cluster_8.pdb ( medoid) | 4.06907 | 9.33875 | 19.1197 | 38 |
| cluster_9.pdb ( medoid) | 3.29487 | 9.71206 | 20.0661 | 32 |
| cluster_10.pdb ( medoid) | 3.21818 | 10.2543 | 18.0869 | 33 |