Figure 9. Distribution of torsion is localized to the termini of the molecule.
A) 4th order polynomial fit plot showing relationship between angle of rotation and distance from applied torque. Shown here is the torque applied to the dimer conformation at Terminus B (clockwise rotation in green, counterclockwise rotation in purple) and Terminus A (clockwise rotation in blue, counterclockwise rotation in red). Fixation constraints are placed at one terminus (the origin) and torsional constraints are placed at the other terminus (25 nm). Most of the rotation occurs locally near the terminus with the applied torque. B) Same plot as A for the rotation of the α-actinin dimer monomer. Clockwise rotation at Terminus B, shown in blue, clockwise rotation at Terminus A shown in green, counterclockwise rotation at Terminus B shown in red, and counterclockwise rotation at Terminus A shown in purple.