Coordinate Files Used in Simulations

Equilibration Systems:

    R3Q apo form:

        acBK-R3Qapo.pdb

        acBK-R3Qapo.psf

    WT apo form:

        acBK-WTapo-5tji.pdb

        acBK-WTapo-5tji.psf

Production Run Snapshots:

    Initial Frame:

        acBK-WTapo-5tji-frame_0.pdb

        acBK-R3Qapo-frame_0.pdb

    Final Frame:

        acBK-WTapo-5tji-frame_last.pdb

        acBK-R3Qapo-frame_last.pdb