Schematic representations of the interaction profiles between the EGFR kinase/MIG-6_s1 interfaces. (A) The key residues of the EGFR kinase surface. (B) The key residues of MIG-6_s1. (C) Hydrogen bond formation between interfaces presented in the starting structure and the 3 ns last of simulations. Interfacial hydrogen bonds presented in green line with the occupancies higher than 50% (D). The involving of hydrogen bond and key residues between two interfaces presented in the starting structure and the last 3 ns of simulations. The “hot spot residues”, “warm spot”, null spot and not studied residues are shown in red, orange, white and gray respectively. Interfacial hydrogen bonds of the starting structure and MD structure presented in dark green and blue bars, respectively.