1
|
− 7.5
|
THR298, SER229
|
Conventional Hydrogen Bond
|
2.17, 3.60
|
| |
SER297
|
Carbon Hydrogen Bond
|
3.69
|
| |
GLU291
|
Pi-Anion
|
3.51
|
| |
SER294, TRP501
|
Pi-Donor Hydrogen Bond
|
3.78, 3.54
|
| |
ALA497, PRO230, HIS293
|
Pi-Alkyl
|
4.48, 4.79, 5.48
|
7
|
− 10.7
|
THR416, THR416, SER294, THR295, GLY484
|
Conventional Hydrogen Bond
|
2.91, 2.79, 3.02, 2.85, 3.10
|
| |
TYR391, HIS293
|
Carbon Hydrogen Bond
|
3.70, 3.10
|
| |
ASP454
|
Pi-Anion
|
3.43
|
| |
SER457, THR295, SER483
|
Pi-Donor Hydrogen Bond
|
3.75, 4.05, 3.56
|
| |
ARG393, VAL456
|
Pi-Alkyl
|
4.69, 4.64
|
14
|
− 9.5
|
ARG481, MET485, GLY484, THR295, THR295, HIS369
|
Conventional Hydrogen Bond
|
3.18, 1.95, 3.11, 3.31, 3.10, 2.32
|
| |
VAL490, VAL490, PRO523, VAL456
|
Alkyl
|
4.99, 4.71, 4.34, 4.61
|
| |
VAL432
|
Pi-Alkyl
|
5.01
|
15
|
− 10.0
|
ALA413, GLN434
|
Conventional Hydrogen Bond
|
2.80, 3.21
|
| |
ASN556, SER489, GLU493
|
Carbon Hydrogen Bond
|
3.58, 3.14, 3.63
|
| |
ASP454
|
Pi-Anion
|
4.09
|
| |
THR295, THR433
|
Pi-Donor Hydrogen Bond
|
3.71, 3.88
|
| |
VAL456, VAL490
|
Alkyl
|
3.96, 3.57
|
| |
VAL456
|
Pi-Alkyl
|
4.93
|
16
|
− 10.5
|
GLU493, TRP501, TYR502, GLY253
|
Conventional Hydrogen Bond
|
2.39, 3.16, 2.50, 3.17
|
| |
THR269
|
Carbon Hydrogen Bond
|
3.47
|
| |
ASP412, ASP412
|
Halogen (Fluorine)
|
3.31, 3.40
|
| |
GLY271
|
Amide-Pi Stacked
|
4.59
|
| |
ALA413, PRO558
|
Alkyl
|
4.19, 4.50
|
| |
ALA497, TRP501
|
Pi-Alkyl
|
4.86, 5.06
|