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Representative structures of VX-787 or our active compounds with the largest population in the MD simulation. Shown are representative structures of (A) VX-787 with PB2; (B) Str1614 with PB2; (C) Str1916 with PB2; (D) Str3107 with PB2; (E) Str5776with PB2; (F) Str6318 with PB2; and (G) Str7374 with PB2.
