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. Author manuscript; available in PMC: 2013 Oct 28.
Published in final edited form as: J Mol Model. 2012 Mar 6;18(8):10.1007/s00894-012-1379-2. doi: 10.1007/s00894-012-1379-2

Fig. 8.

Fig. 8

The conformations of the three residues in the SF region. The snapshots are taken from the last 10 ns of MD simulation. The three residues and the water molecules are shown in ball-and-stick representation and each element is shown in a different color. The distances between the hydrogen-bond donor and acceptor and the dihedral angles <Cβ–Cγ–Cδ–Nε of Arg189 are also marked