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Alignment of average Rev structure from ff14SB and ff14IDPSFF RRE-Rev simulations to chain B in the NMR solution structure (PDB: 1ETF). (A) The average structure from ff14SB simulations is superimposed to Rev protein from IETF, with an RMSD of 0.57 Å (Cα atoms). (B) The average structure from ff14IDPSFF simulations is superimposed to Rev protein from IETF, with an RMSD of 1.14 Å (Cα atoms).
