| Protein sequence(s) | GSHSMRYFSTSVSRPGRGEPRFIAVGYVDDTQFVRFDSDAASQRMEPRAPWIEQEGPEYWDEETGKVKAHSQTDRENLRIALRYYNQSEAGSHTLQMMFGCDVGSDGRFLRGYHQYAYDGKDYIALKEDLRSWTAADMAAQITKRKWEAAHVAEQQRAYLEGTCVDGLRRYLENGKETLQRTDPPKTHMTHHPISDHEATLRCWALGFYPAEITLTWQRDGEDQTQDTELVETRPAGDGTFQKWAAVVVPSGEEQRYTCHVQHEGLPKPLTLRWEPGSGGGLNDIF input pdb | |
| Peptide sequence | CEEASVTVVEGQVDYYGLYYVHEGIR | |
| Simulation mc cycles | 200 | |
| Peptide secondary structure psipred | CCCCEEEEEEEEEEEEEEEEEECCCC | |
Contact information |
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| 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) | 33.2068 | 2.80063 | 24.0618 | 93 |
| cluster_2.pdb ( medoid) | 31.5498 | 4.02538 | 25.7122 | 127 |
| cluster_3.pdb ( medoid) | 22.8296 | 3.24141 | 16.5728 | 74 |
| cluster_4.pdb ( medoid) | 17.1553 | 8.33562 | 36.415 | 143 |
| cluster_5.pdb ( medoid) | 16.7682 | 8.11059 | 22.6975 | 136 |
| cluster_6.pdb ( medoid) | 8.86667 | 12.6316 | 33.1089 | 112 |
| cluster_7.pdb ( medoid) | 6.53222 | 19.5952 | 49.9996 | 128 |
| cluster_8.pdb ( medoid) | 5.08983 | 13.5565 | 34.4552 | 69 |
| cluster_9.pdb ( medoid) | 3.28768 | 26.7666 | 67.2428 | 88 |
| cluster_10.pdb ( medoid) | 3.17169 | 9.45867 | 25.3991 | 30 |