Table 2 ΔΔG (kcal/mol) and ΔΔS ENCoM and ΔΔG DynaMut of Model 2
Serial no | AA from | AA to | Position | ΔΔG ENCoM (kcal/mol) | ΔΔS ENCoM (kcal/mol) | ΔΔG DynaMut (kcal/mol) |
|---|---|---|---|---|---|---|
1 | L | R | 452 | 0.142 |  − 0.178 | 0.511 |
2 | Q | H | 1071 | 0.003 |  − 0.004 | 0.138 |
3 | E | Q | 484 | 0.07 |  − 0.088 | 0.439 |
4 | D | G | 614 |  − 0.106 | 0.133 | 0.548 |
5 | P | R | 681 | 0.373 |  − 0.467 | 0.467 |