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Amino acids contributing in the DENV2, YFV, and WNV NS2B/NS3pro–HST interaction. Decomposition energy of the amino acids that participated in the interaction with HST is based on the MD simulations. Coordination of HST in the protease binding region and overlay of the HST replicas 1 and 2: (A) DENV2 NS2B/NS3pro–HST interaction; (B) YFV NS2B/NS3pro–HST interaction; (C) WNV NS2B/NS3pro–HST interaction. Amino acid residues with an energy decomposition < −1 kcal/mol are considered.
