Peptide
Energy
(kcal/mol)
Hydrogen bonds
Site of amino acid
Score
Alleles
IVRQRVIPV
-31.45
2
34-42
50.00
DRB1_1301
FLLMLCLHH
-26.85
2
72-80
80.85
DRB1_0405
FRLMRTNFL
-29.04
2
200-208
65.17
DRB1_1321
Table 2:
The conformational properties of the peptides with efficient binding energy and present on the variable regions of predicted peptide as investigated by molecular dynamics simulation using Autodock tool v3.0.