FIG. 2.

Comparison between co-information values derived from MetaD and HTMD simulations. (a) Normalized co-information values from MetaD and HTMD simulations plotted for each MOR transmembrane residue. [(b) and (c)] Normalized co-information values depicted on the inactive crystal structure of MOR using a color scheme ranging from white to yellow to red, where red represents the highest contributing residues to the information transfer between the ligand binding pocket and the intracellular region of MOR, as derived from MetaD and HTMD simulations, respectively. Co-information values for the loop regions were not calculated.