| Protein sequence(s) | TNACSINGNAPAEIDLRQMRTVTPIRMQGGCGSCWAFSGVAATESAYLAYRQQSLDLAEQELVDCASQHGCHGDTIPRGIEYIQHNGVVQESYYRYVAREQSCRRPNAQRFGISNYCQIYPPNANKIREALAQTHSAIAVIIGIKDLDAFRHYDGRTIIQRDNGYQPNYHAVNIVGYSNAQGVDYWIVRNSWDTNWGDNGYGYFAANIDLMMIEEYPYVVILTNACSINGNAPAEIDLRQMRTVTPIRMQGGCGSCWAFSGVAATESAYLAYRQQSLDLAEQELVDCASQHGCHGDTIPRGIEYIQHNGVVQESYYRYVAREQSCRRPNAQRFGISNYCQIYPPNANKIREALAQTHSAIAVIIGIKDLDAFRHYDGRTIIQRDNGYQPNYHAVNIVGYSNAQGVDYWIVRNSWDTNWGDNGYGYFAANIDLMMIEEYPYVVIL input pdb |
| Peptide sequence | WFKDYYRLEKVRGNCFWKYIPGGGG |
| Simulation mc cycles | 50 |
| Peptide secondary structure psipred | CCCCCEEHHHHCCCEECCCCCCCCC |
| 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) | 83.5218 | 1.20927 | 9.20961 | 101 |
| cluster_2.pdb ( medoid) | 36.5238 | 1.88918 | 4.86295 | 69 |
| cluster_3.pdb ( medoid) | 26.7678 | 4.25885 | 19.6568 | 114 |
| cluster_4.pdb ( medoid) | 26.0493 | 4.14599 | 17.9315 | 108 |
| cluster_5.pdb ( medoid) | 21.3467 | 5.66831 | 15.5123 | 121 |
| cluster_6.pdb ( medoid) | 21.225 | 8.76324 | 15.3437 | 186 |
| cluster_7.pdb ( medoid) | 20.9057 | 5.35739 | 19.5755 | 112 |
| cluster_8.pdb ( medoid) | 10.7087 | 3.54851 | 11.2608 | 38 |
| cluster_9.pdb ( medoid) | 7.8819 | 6.47052 | 13.0151 | 51 |
| cluster_10.pdb ( medoid) | 5.50111 | 18.1782 | 46.1006 | 100 |