TABLE 4.
The mmpbsa analysis of designed peptides’ binding.
| Energy | P23 | P28 | P31 |
|---|---|---|---|
| Van der Waal energy | −247.343 ± 25.496 | −158.811 ± 7.259 | −192.897 ± 22.558 |
| Electrostatic energy | −935.105 ± 27.011 | −295.134 ± 23.813 | −796.565 ± 71.079 |
| Polar solvation energy | 1098.955 ± 25.680 | 377.392 ± 33.661 | 912.369 ± 103.254 |
| SASA energy | −38.414 ± 1.765 | −27.640 ± 2.036 | −37.145 ± 1.942 |
| Binding energy | −121.907 ± 22.987 | −104.193 ± 18.092 | −114.238 ± 57.578 |