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. Author manuscript; available in PMC: 2010 Oct 29.
Published in final edited form as: J Phys Chem B. 2009 Oct 29;113(43):14381–14392. doi: 10.1021/jp903302k

Figure 8.

Figure 8

A. Trajectory of Tyr-Trp distances from MD simulation of YGGWL. The distances were averaged over 500 ps. (See text for details of the simulation.) B. Distribution of Tyr-Trp distances from the MD simulation in 500-ps blocked averages. The solid line shows the total distribution (0.2 Å bins). The dashed line is the distance distribution for the t rotamer of Tyr (0.5 Å bins) and the dotted line is the distance distribution for the g− rotamer of Tyr (0.5 Å bins).