TABLE 1.

Summary of structures used to generate starting conformations for MD simulations

Mb variant	Protein Data Bank code
wt His-E7 (open conformation)	1SPE (6)a
wt His-E7 (closed conformation)	1VXF (6)
Ala-E7	102 m (16)
Trp-E7	3OGB (12)

^a References are in parentheses.