| Protein sequence(s) | GEVASVPLTNYLDSQYFGKIYLGTPPQEFTVLFDTGSSDFWVPSIYCKSNACKNHQRFDPRKSSTFQNLGKPLSIHYGTGSMQGILGYDTVTVSNIVDIQQTVGLSTQEPGDVFTYAEFDGILGMAYPSLASEYSIPVFDNMMNRHLVAQDLFSVYMDRNGQESMLTLGAINPSYYTGSLHWVPVTVQQYWQFTVDSVTISGVVVACEGGCQAILDTGTSKLVGPSSDILNIQQAIGATQNQYGEFDIDCDNLSYMPTVVFEINGKMYPLTPSAYTSQDQGFCTSGFQSENHSQKWILGDVFIREYYSVFDRANNLVGLAKAI input pdb |
| Peptide sequence | RHPRPRLSFMAIPPKK |
| Simulation mc cycles | 50 |
| Peptide secondary structure psipred | CCCCCCCEEEECCCCC |
| 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) | 41.8892 | 2.69759 | 12.393 | 113 |
| cluster_2.pdb ( medoid) | 25.7073 | 4.97914 | 22.303 | 128 |
| cluster_3.pdb ( medoid) | 25.3531 | 5.28536 | 19.6074 | 134 |
| cluster_4.pdb ( medoid) | 24.5585 | 7.37016 | 22.3813 | 181 |
| cluster_5.pdb ( medoid) | 13.797 | 10.1471 | 29.5356 | 140 |
| cluster_6.pdb ( medoid) | 6.46667 | 19.4845 | 43.5927 | 126 |
| cluster_7.pdb ( medoid) | 3.07814 | 12.0202 | 25.6707 | 37 |
| cluster_8.pdb ( medoid) | 2.9507 | 20.6731 | 42.1407 | 61 |
| cluster_9.pdb ( medoid) | 2.49119 | 18.8665 | 36.4916 | 47 |
| cluster_10.pdb ( medoid) | 2.47174 | 13.3509 | 30.2785 | 33 |