Official websites use .gov
A
.gov website belongs to an official
government organization in the United States.
Secure .gov websites use HTTPS
A lock (
) or https:// means you've safely
connected to the .gov website. Share sensitive
information only on official, secure websites.
Interaction fraction (occupancy) plot of main protease with theaflavin digallate. Y-axis represents the total number of contact fractions per residue per simulation time, i.e., if the residue (presented on X-axis) has one contact during the whole simulation of 200 ns, it will have an interaction fraction score of 1. Glu166 has a score of ∼3, representing Glu 166 retains at least three total contacts during the whole simulation.
