Figure 5.

Backbone angular displacement (〈τ_disp | χ1〉) is correlated between PDB structures and predicted populations from 3-residue backrub simulations. Points are colored by χ1 bin: −60° (red), 60° (green), and 180° (blue). Points from the same simulation are connected by thin lines. Any connecting lines with positive slopes represent simulations which show the correct bias between side chain conformation and backbone conformation. Disconnected points are from simulations where only one of the χ1 bins seen in the PDB was visited during the simulation. The thick black line shows a least squares linear fit.