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Figure 5
Conformational distributions derived from ten independent MD trajectories. (a) Black circles denote domain centers of mass. Distance is defined between the a and a′ domain centers, and angle as that formed by the a–bb′–a′ centers. These parameters were used to compute conformational distributions for each trajectory. (b) 2D distributions of aa′ distance and angle for trajectories 1–10; the black circle marks the first data point from the MD production run.

Journal logoJOURNAL OF
APPLIED
CRYSTALLOGRAPHY
ISSN: 1600-5767
Volume 59| Part 4| August 2026| Pages 1270-1281
https://doi.org/10.1107/S1600576726005832
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