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Comparison of the simulated structures (magenta) and the NMR structure of BdpA (yellow, PDB code 1Q2N, first model). (a) The best folded structure with 0.8 Å Cα RMSD from the CMD of the truncated BdpA. (b) The best folded structure with 1.3 Å Cα RMSD from the REMD of the full-length BdpA.
