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. 2013 Aug 9;8(8):e71422. doi: 10.1371/journal.pone.0071422

Table 5. Molecular docking results of HSA-HA interaction.

Binding site Amino acid Forces involved ΔG (kcal mol−1) K b (M−1)
Site I Lys199 H-bonding and Hydrophobic −5.6 1.28×104
Arg222 H-bonding and Hydrophobic
Tyr150 Hydrophobic
Glu153 Hydrophobic
Ser192 Hydrophobic
Lys195 Hydrophobic
Gln196 Hydrophobic
Trp214 Hydrophobic
His242 Hydrophobic
Arg257 Hydrophobic
Ala291 Hydrophobic
Glu292 Hydrophobic
Site II Leu387 Hydrophobic −5.9 2.12×104
Ile388 Hydrophobic
Asn391 Hydrophobic
Cys392 Hydrophobic
Leu407 Hydrophobic
Arg410 Hydrophobic
Tyr411 Hydrophobic
Leu430 Hydrophobic
Val433 Hydrophobic
Cys438 Hydrophobic
Ala449 Hydrophobic
Leu453 Hydrophobic