| Protein sequence(s) | input pdb |
| Peptide sequence | HQKLVFFAEDVGSNKGAIIGLMVGGVVIA |
| Simulation mc cycles | 50 |
| Peptide secondary structure psipred | CCEEEEEEEECCCCHHHEEEEEECCEEEC |
| Receptor residue | Peptide residue |
| Receptor residue | Peptide residue |
| Receptor residue | Peptide residue |