| Protein sequence(s) | MDGSGEQPRGGGPTSSEQIMKTGALLLQGFIQDRAGRMGGEAPELALDPVPQDASTKKLSECLKRIGDELDSNMELQRMIAAVDTDSPREVFFRVAADMFSDGNFNWGRVVALFYFASKLVLKALCTKVPELIRTIMGWTLDFLRERLLGWIQDQGGWDGLLSYFGTPTWQTVTIFVAGVLTASLTIWKKMG input pdb |
| Peptide sequence | AKAAHLHWLS |
| 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) | 30.0324 | 3.52952 | 24.4117 | 106 |
| cluster_2.pdb ( medoid) | 26.4311 | 4.91845 | 23.2514 | 130 |
| cluster_3.pdb ( medoid) | 21.891 | 6.34964 | 18.5928 | 139 |
| cluster_4.pdb ( medoid) | 14.2231 | 9.91343 | 27.912 | 141 |
| cluster_5.pdb ( medoid) | 12.6076 | 6.66264 | 21.6096 | 84 |
| cluster_6.pdb ( medoid) | 10.9697 | 9.02485 | 18.4293 | 99 |
| cluster_7.pdb ( medoid) | 10.4366 | 12.4562 | 25.946 | 130 |
| cluster_8.pdb ( medoid) | 9.0019 | 6.332 | 13.6849 | 57 |
| cluster_9.pdb ( medoid) | 8.20758 | 9.13789 | 18.8659 | 75 |
| cluster_10.pdb ( medoid) | 5.12131 | 7.61523 | 27.4581 | 39 |