| Protein sequence(s) | TAVADYQKAKAEFPQKQEQYNKDFEKYQSDVKEYEAQKAAYEQYKKEVAQGLASGRVEKAQGLVFINEPEAKLSIEGVNQYLTKEARQKHATEDILQQYNTDNYTASDFTQANPYDPKEDTWFKMKVGDQISVTYDNIVNSKYNDKKISKVKINYTLNSSTNNEGSALVNLFHDPTKTIFIGAQTSNAGRNDKISVTMQIIFYDENGNEIDLSGNNAIMSLSSLNHWTTKYGDHVEKVNLGDNEFVKIPGSSVDLHGNEIYSAKDNQYKANGATFNGDGADGWDAVNADGTPRAATAYYGAGAMTYKGEPFTFTVGGNDQNLPTTIWFATNSAVAVPKDPGAKPTPPEKPE input pdb |
| Peptide sequence | TQANFNTLRSLGVKGAVVKA |
| Simulation mc cycles | 50 |
| Peptide secondary structure psipred | CCCCHHHHHHCCCCCEEEEC |
| 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) | 37.968 | 4.18774 | 11.9707 | 159 |
| cluster_2.pdb ( medoid) | 28.4413 | 4.00825 | 16.1067 | 114 |
| cluster_3.pdb ( medoid) | 26.068 | 4.33482 | 9.78545 | 113 |
| cluster_4.pdb ( medoid) | 24.8133 | 4.51372 | 11.5976 | 112 |
| cluster_5.pdb ( medoid) | 20.8784 | 4.0712 | 9.45866 | 85 |
| cluster_6.pdb ( medoid) | 12.1564 | 9.0487 | 35.6097 | 110 |
| cluster_7.pdb ( medoid) | 11.7394 | 2.38512 | 6.40493 | 28 |
| cluster_8.pdb ( medoid) | 8.9344 | 10.5211 | 26.5548 | 94 |
| cluster_9.pdb ( medoid) | 8.61579 | 12.6512 | 32.7407 | 109 |
| cluster_10.pdb ( medoid) | 6.79523 | 11.1843 | 24.017 | 76 |