Table 3.
Residue | EvdW | Eele | Esum |
---|---|---|---|
IleB24 | −2.40 | −0.60 | −3.00 |
HisB28 | −5.91 | −3.13 | −9.04 |
GlnB43 | −1.51 | −5.60 | −7.11 |
ThrB234 | −4.98 | −3.95 | −8.93 |
MetB235 | −5.72 | −4.35 | −10.07 |
SerB236 | −7.84 | −1.14 | −8.98 |
GlyB237 | −5.51 | −0.65 | −6.16 |
ThrB239 | −3.23 | −1.99 | −5.22 |
ThrB240 | −6.64 | −6.11 | −12.75 |
PheB244 | −3.79 | 0.53 | −3.26 |
AlaB273 | −2.52 | −1.27 | −3.79 |
ArgB320 | −4.84 | −19.36 | −24.20 |
GlyB321 | −1.63 | −0.65 | −2.28 |
ProB360 | −5.54 | −8.17 | −13.71 |
ArgB369 | −3.00 | −0.23 | −3.23 |
GlyB370 | −3.77 | 0.62 | −3.15 |
LeuB371 | −3.11 | −0.33 | −3.44 |
SerB374 | −8.22 | −1.07 | −9.29 |
AlaB375 | −3.35 | −0.04 | −3.39 |
a Energy units in kcal mol−1.