Fig. 10. Hydrogen bonding interactions involved waters at different snapshots: (A) the 8NS-BD1 complex at 200 ns, (B) the 8NS-BD1 complex at 300 ns, (C) the 8NS-BD1 complex at 500 ns, (D) the 8NS-BD2 complex at 200 ns, (E) the 8NS-BD2 complex at 300 ns, and (F) the 8NS-BD2 complex at 500 ns. Inhibitor 8NS and residues are shown in stick modes, and waters are displayed with ball styles.