Sub-pocket-wise global backbone B-factors for holo simulations (Global Cα) and dihedral entropy values Sφ and Sψ.

Sub-pocket average global backbone B-factors, Sφ and Sψ show S1 and S2 sub-pockets as the most rigid sub-pockets. Sub-pockets S3-S6 show varying flexibilities.

各子口袋（sub-pocket）的全局主链平均B因子（B-factors）以及Sφ、Sψ的数值结果显示，S1与S2子口袋为刚性最强的子口袋；S3至S6子口袋则呈现出各不相同的柔性。