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. Author manuscript; available in PMC: 2014 Aug 4.
Published in final edited form as: J Am Chem Soc. 2011 Mar 31;133(16):6223–6234. doi: 10.1021/ja1097594

Figure 5.

Figure 5

Spatial occupancy plots of the CEC for the hydrated excess proton in H64A HCA II. The squares indicate 4MI binding sites determined from x-ray data39,40 and the circle indicates the binding site determined from NMR data.43