Table 3. Most Important Residues Provided by the Permutation Importance and SHAP Algorithms in the LightGBM Model.

	permutation importance	SHAP
1	Val18	Leu83
2	Leu134	His84
3	Lys33	Ala31
4	Leu83	Leu134
5	His84	Asp86
6	Ala31	Lys33