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. 2006 Dec;15(12):2773–2784. doi: 10.1110/ps.062343206

Figure 5.

Figure 5.

Structures for the residues Ala40, Lys41, part of Arg39, and two discrete water molecules refined with QM (cyan) and EH (magenta) at w X-ray = 0.2, together with the forces (cyan and magenta cylinders with arrowheads) on the Cβ, Cγ, and Cδ atoms of Lys41 derived from the respective E chem. All the aliphatic hydrogen atoms are omitted.