FIG. 5.

The sparse ensemble closely approximates the full ensemble. Figures shown for YciI protein from H. influenzae (PDB id: 1mwq) with energy cutoff of 0.1 kcal/mol and energy window of 1 kcal/mol. For each sequence, the x-axis plots the full energy of each conformation of the ensemble, and the y-axis plots the percent contribution of each conformation to the partition function Z (called q in Georgiev et al., 2008b). Conformations in both the full and sparse ensembles are colored green. Conformations in the full ensemble that are not in the sparse ensemble are in red. Conformations in the sparse ensemble that are not in the full ensemble are in blue. GMEC is circled in green.