Scoring function term Raw score Z-score C_beta interaction energy 218.73 -6.55 All-atom pairwise energy 3843.10 -5.54 Solvation energy 20.80 -5.51 Torsion angle energy 39.42 -6.27 QMEAN4 score 0.188 -9.56

Table 1 : Parameters of the selected template for MTr modeling [24].