| Protein sequence(s) | GSEHLVTTATFSIGSTGLVVYDYQQLLIAYIPAPGTCCYIMKIAPESIPSLEALTQKVHNFQMECSLQAKPAVPTSKLGQAEGRDAGSAPSGGDPAFLGMAVSTLCGEVPLYYI input pdb |
| Peptide sequence | YGQSSYSSYGQSQNTG |
| Simulation mc cycles | 25 |
| Peptide secondary structure psipred | CCCCCCCCCCCCCCCC |
| 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) | 23.8228 | 5.07917 | 22.2882 | 121 |
| cluster_2.pdb ( medoid) | 16.8263 | 6.35908 | 29.313 | 107 |
| cluster_3.pdb ( medoid) | 13.9371 | 9.9734 | 26.0684 | 139 |
| cluster_4.pdb ( medoid) | 13.7798 | 8.4181 | 32.4929 | 116 |
| cluster_5.pdb ( medoid) | 12.6442 | 7.6715 | 20.3024 | 97 |
| cluster_6.pdb ( medoid) | 10.6911 | 11.5984 | 26.8452 | 124 |
| cluster_7.pdb ( medoid) | 9.09925 | 12.3087 | 28.9568 | 112 |
| cluster_8.pdb ( medoid) | 8.36508 | 11.8349 | 40.9504 | 99 |
| cluster_9.pdb ( medoid) | 4.84167 | 9.50085 | 19.5762 | 46 |
| cluster_10.pdb ( medoid) | 3.36616 | 11.5859 | 26.4898 | 39 |