Table 1. Dock scores of the mutant reference peptides.
Peptides | Global Energy | Attractive VdWa | Repulsive VdWa | ACEb | HBc |
---|---|---|---|---|---|
REFd | -198.35 | -48.82 | 1.42 | -48.82 | -4.4 |
3P | -200.5 | -47.98 | 5.08 | -47.38 | -5.82 |
4L | -206.63 | -45.96 | 5.21 | -49.11 | -8.86 |
5S | -203.66 | -46.12 | 3.22 | -49.45 | -8.27 |
7C | -200.28 | -47.68 | 19.98 | -53.29 | -7.49 |
9V | -214.01 | -52.83 | 9.05 | -51.39 | -4.08 |
aVanderwaals,
bAtomic Contact Energy,
cHydrogen Bond,
dReference peptide.
Peptide names represent the position of mutation followed by the single letter code of the substituted aminoacid