All Interactions
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Chains |
Hydro. Bond Ener. (kJ/mol) |
Elec. Ener. (kJ/mol) |
VDW. Ener. (kJ/mol) |
Tot. Stab. Ener. (kJ/mol) |
#int. res. |
# Short cont. |
#Hydr. int. |
#VDW pairs |
#salt bridges |
#Pot. fav. elec. int |
#Pot. unfav. elec. int |
int. res. |
A-B |
-119.183 |
-90.936 |
-404.426 |
-614.5449 |
193 |
45 |
17 |
19554 |
10 |
90 |
91 |
|
A-G |
-99.9226 |
-51.537 |
-418.957 |
-570.4167 |
202 |
51 |
17 |
20294 |
6 |
77 |
80 |
|
A-H |
-12.5626 |
-29.8909 |
-62.264 |
-104.7174 |
45 |
3 |
2 |
2836 |
1 |
24 |
16 |
|
A-N |
0.0 |
7.3234 |
2 |
GLU461A, GLU461N |
A-O |
-12.2628 |
-4.2643 |
7 |
ARG267A, ASN264A, GLU237A, GLY28O, LYS25O, LYS27O, VAL31O |
A-P |
0.0 |
2.4926 |
4 |
ASP34P, GLU309A, LYS307A, LYS37P |
B-C |
-89.8456 |
-38.2091 |
-411.62 |
-539.6747 |
202 |
45 |
17 |
19782 |
6 |
79 |
81 |
|
B-H |
0.0 |
8.2363 |
-30.6279 |
-22.3916 |
24 |
0 |
1 |
1423 |
0 |
4 |
6 |
|
B-I |
-11.2833 |
-29.8033 |
-61.8737 |
-102.9603 |
44 |
2 |
2 |
2873 |
1 |
24 |
16 |
|
B-P |
-17.2241 |
-45.9997 |
8 |
ARG230B, ARG267B, ASN264B, GLU237B, GLU38P, LYS25P, LYS27P, VAL31P |
B-Q |
0.0 |
1.9278 |
3 |
ASP34Q, GLU309B, LYS307B |
C-D |
-95.9939 |
-65.235 |
-388.193 |
-549.4218 |
205 |
41 |
17 |
19249 |
7 |
79 |
93 |
|
C-I |
-2.5006 |
8.6495 |
-34.6877 |
-28.5389 |
24 |
0 |
1 |
1524 |
0 |
4 |
7 |
|
C-J |
-14.2178 |
-31.1 |
-65.2792 |
-110.5969 |
46 |
2 |
2 |
3079 |
1 |
25 |
18 |
|
C-Q |
-18.3484 |
-5.0522 |
7 |
ARG267C, ASN264C, GLU237C, GLY28Q, LYS25Q, LYS27Q, VAL31Q |
C-R |
0.0 |
0.2571 |
3 |
ASP34R, GLU309C, LYS307C |
D-E |
-97.2127 |
-61.9784 |
-387.803 |
-546.9942 |
195 |
47 |
17 |
19364 |
7 |
81 |
92 |
|
D-J |
0.0 |
7.8372 |
-36.2735 |
-28.4363 |
27 |
0 |
1 |
1606 |
0 |
4 |
7 |
|
D-K |
-8.2481 |
-25.9652 |
-58.5466 |
-92.7599 |
44 |
2 |
2 |
2889 |
1 |
25 |
17 |
|
D-R |
-20.4217 |
-3.3385 |
9 |
ARG230D, ARG267D, ASN264D, GLU237D, GLU38R, GLY28R, LYS25R, LYS27R, VAL31R |
D-S |
-7.0104 |
-1.3677 |
4 |
ASP34S, GLU309D, GLY305D, LYS307D |
E-F |
-93.7622 |
-45.0651 |
-432.088 |
-570.9152 |
201 |
50 |
18 |
20518 |
8 |
78 |
88 |
|
E-K |
-6.1809 |
8.8168 |
-30.585 |
-27.949 |
22 |
0 |
1 |
1407 |
0 |
3 |
7 |
|
E-L |
0.0 |
-25.0324 |
-61.696 |
-86.7284 |
46 |
4 |
2 |
2942 |
1 |
29 |
18 |
|
E-S |
-11.1746 |
-6.052 |
6 |
ARG267E, ASN264E, GLU237E, LYS25S, LYS27S, VAL31S |
E-T |
0.0 |
-0.5458 |
3 |
ASP34T, GLU309E, LYS307E |
F-G |
-123.1001 |
-70.9825 |
-408.809 |
-602.8916 |
206 |
51 |
17 |
20193 |
8 |
86 |
95 |
|
F-L |
-6.4687 |
8.4312 |
-29.6405 |
-27.678 |
24 |
0 |
1 |
1377 |
0 |
3 |
7 |
|
F-M |
-10.4892 |
-29.5905 |
-60.7478 |
-100.8276 |
34 |
3 |
4 |
2551 |
0 |
13 |
12 |
|
F-T |
-21.1472 |
-4.0922 |
7 |
ARG267F, ASN264F, GLU237F, GLY28T, LYS25T, LYS27T, VAL31T |
F-U |
0.0 |
1.5119 |
3 |
ASP34U, GLU309F, LYS307F |
G-M |
0.0 |
7.2409 |
0.0 |
7.2409 |
2 |
0 |
0 |
0 |
0 |
0 |
0 |
|
G-N |
-11.8234 |
-29.4905 |
7 |
ASP435N, ASP9G, GLU10G, GLU433N, LYS105G, LYS105N, LYS441G |
G-O |
-9.1122 |
1.6597 |
4 |
ASN310G, ASP34O, GLU309G, LYS307G |
G-U |
-19.9058 |
-1.2573 |
8 |
ARG230G, ARG267G, ASN264G, GLU237G, GLU38U, LYS25U, LYS27U, VAL31U |
H-I |
-93.1384 |
-72.2356 |
-312.47 |
-477.844 |
157 |
16 |
13 |
14096 |
4 |
64 |
68 |
|
H-N |
-86.7527 |
-90.1212 |
25 |
ALA3H, ALA521H, ARG267N, ARG284H, ARG36N, ASP282H, GLU183N, GLU256H, GLU385N, GLU41N, GLU520H, GLU525H, GLU528H, GLU59N, GLU61N, GLU63N, HIS65H, LYS180N, LYS276H, LYS42N, LYS43N, LYS4H, LYS526H, VAL39N, VAL523H |
I-J |
-71.2086 |
-82.6709 |
-321.492 |
-475.3715 |
165 |
17 |
14 |
14563 |
5 |
64 |
66 |
|
J-K |
-76.3634 |
-81.201 |
-294.472 |
-452.0364 |
163 |
18 |
12 |
13935 |
4 |
66 |
69 |
|
K-L |
-78.1796 |
-83.4261 |
-296.952 |
-458.5578 |
169 |
19 |
12 |
14350 |
5 |
65 |
67 |
|
L-M |
-103.532 |
-59.8022 |
-146.378 |
-309.7122 |
113 |
35 |
6 |
7316 |
3 |
22 |
25 |
|
M-N |
-92.2689 |
-91.5319 |
29 |
ALA3N, ALA521N, ARG267M, ARG284N, ARG36M, ASN37M, ASP282N, GLU256N, GLU385M, GLU41M, GLU520N, GLU525N, GLU528N, GLU59M, GLU61M, GLU63M, GLY268M, HIS65N, LYS180M, LYS276N, LYS28M, LYS42M, LYS43M, LYS4N, LYS526N, SER227N, THR518N, VAL39M, VAL523N |
O-P |
-94.0165 |
-7.33 |
19 |
ARG14P, ARG52O, ARG59P, ARG93O, ASP68O, GLN100O, GLU55O, GLU55P, GLU63O, GLU81P, GLU85P, LEU11P, LEU96O, LYS27O, LYS9P, THR50P, VAL53P, VAL7P, VAL98O |
O-Q |
0.0 |
11.7212 |
2 |
GLU55O, GLU55Q |
O-T |
0.0 |
9.067 |
2 |
GLU55O, GLU55T |
O-U |
-39.7292 |
12.8423 |
17 |
ARG14O, ARG93U, ASP68U, ASP83O, GLN100U, GLU22U, GLU23U, GLU55O, GLU55U, GLU81O, GLU85O, LEU11O, LEU96U, LYS27U, LYS9O, VAL7O, VAL98U |
P-Q |
-45.6898 |
14.6241 |
18 |
ARG14Q, ARG93P, ASP68P, ASP83Q, GLN100P, GLU22P, GLU23P, GLU55P, GLU55Q, GLU63P, GLU81Q, GLU85Q, GLY12Q, LEU95P, LYS27P, LYS9Q, VAL7Q, VAL98P |
P-R |
0.0 |
8.9491 |
2 |
GLU55P, GLU55R |
Q-R |
-72.5696 |
11.402 |
15 |
ARG14R, ARG52Q, ARG93Q, ASP68Q, GLN100Q, GLU55Q, GLU55R, GLU63Q, GLU81R, LYS27Q, LYS9R, THR50R, VAL53R, VAL7R, VAL98Q |
Q-S |
0.0 |
7.2635 |
2 |
GLU55Q, GLU55S |
R-S |
-69.3781 |
11.3382 |
14 |
ARG14S, ARG93R, ASP68R, GLN100R, GLU55R, GLU55S, GLU63R, GLU81S, GLU85S, LYS27R, LYS9S, THR50S, VAL7S, VAL98R |
S-T |
-62.2745 |
10.2196 |
15 |
ARG14T, ASP68S, GLN100S, GLN58S, GLU22S, GLU55S, GLU55T, GLU63S, GLU81T, GLU85T, LEU95S, LYS27S, LYS9T, VAL7T, VAL98S |
S-U |
0.0 |
14.6831 |
2 |
GLU55S, GLU55U |
T-U |
-46.0264 |
27.475 |
15 |
ARG14U, ARG52T, GLN100T, GLU55T, GLU55U, GLU81U, GLU85U, LEU11U, LEU95T, LEU96T, LYS27T, LYS9U, VAL53U, VAL7U, VAL98T |
|