Fig. 11

RMSF from molecular dynamics simulations. The RMSF of the a TreCel7A, b ThaCel7A, and c TatCel7A backbones and d the ligand and microfibril over 100-ns simulations at 300 K. Error bars shown in d were obtained through 2.5 ns block averaging. The molecular simulation data for TreCel7A was reported previously and is shown here for comparison [3]