Per-residue free energy values for risperidone coupled to DRD2_WT, DRD2_L94A, DRD2_W100A and DRD2_W100L (values kcal mol⁻¹).

Residue	DRD2WT	DRD2L94A	DRD2W100L	DRD2W100A
V83		−0.67 ± 0.27		−0.456 ± 0.25
V91				−0.464 ± 0.15
W100	−0.564 ± 0.20	−1.202 ± 0.40	−0.383 ± 0.14
F110			−0.587 ± 0.25	−1.055 ± 0.50
V111		−0.458 ± 0.12	−0.531 ± 0.30	−0.523 ± 0.22
V115	−1.774 ± 0.30	−0.596 ± 0.15
M117		−0.592 ± 0.33		−0.498 ± 0.13
C118	−2.281 ± 0.40	−2.21 ± 0.37	−0.941 ± 0.50	−1.781 ± 0.40
T119	−0.879 ± 0.15
S121		−0.417 ± 0.20		−0.476 ± 0.20
I122	−0.521 ± 0.20			−0.614 ± 0.33
I184	−1.86 ± 0.40	−1.264 ± 0.25	−1.486 ± 0.57	−1.354 ± 0.80
F189	−0.962 ± 0.30	−0.549 ± 0.26	−0.582 ± 0.28
V190	−0.839 ± 0.20
S193	−0.478 ± 0.15
S197	−0.991 ± 0.40
F198	−1.894 ± 0.60	−0.603 ± 0.19	−0.48 ± 0.17	−0.445 ± 0.24
F382			−0.704 ± 0.29
C385			−0.436 ± 0.15
W386			−1.827 ± 0.70
F389			−1.249 ± 0.57
P405	−0.828 ± 0.25	−0.792 ± 0.29
Y408	−3.041 ± 0.50	−1.939 ± 0.58
S409	−0.47 ± 0.15	−0.531 ± 0.30
F411			−0.451 ± 0.25
T412	−0.983 ± 0.40	−2.358 ± 0.56	−1.078 ± 0.77	−0.787 ± 0.30
L414			−0.768 ± 0.31
G415			−0.97 ± 0.40
Y416				−1.359 ± 0.70