Table 2.

Thermodynamic calculations of G1 and G2 variants upon APIND binding.

Energy Component	G1_APIND	G2_APIND
∆EvdW (kcal/mol)	−10.23	−19.084
∆Eele (kcal/mol)	20.78	−40.092
∆GGB (kcal/mol)	4.65	65.1435
ESURF (kcal/mol)	−3.89	−5.086
∆Ggas (kcal/mol)	6.44	−99.98
∆Gsol (kcal/mol)	4.41	60.846
∆Gbind (kcal/mol)	−10.65	−20.876