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-I |
-28.1677 |
-18.5122 |
-373.108 |
-419.7879 |
212 |
51 |
32 |
23861 |
4 |
54 |
42 |
|
A-J |
-10.6575 |
-27.9195 |
-202.778 |
-241.355 |
105 |
13 |
7 |
10926 |
2 |
35 |
38 |
|
B-C |
-9.1531 |
-5.9376 |
-433.669 |
-448.7596 |
215 |
80 |
27 |
25932 |
2 |
51 |
42 |
|
B-G |
0.0 |
-27.1242 |
-22.7273 |
-49.8515 |
44 |
3 |
0 |
1434 |
2 |
24 |
23 |
|
B-O |
0.0 |
-28.1734 |
16 |
ARG493B, ARG493O, ASP482B, ASP482O, GLU378B, GLU378O, GLU390B, GLU390O, GLU454B, GLU454O, HIS483B, HIS483O, LYS367B, LYS367O, LYS484B, LYS484O |
C-E |
-8.0887 |
-70.19 |
-61.3463 |
-139.625 |
67 |
11 |
0 |
2973 |
6 |
36 |
39 |
|
C-G |
0.0 |
7.7281 |
-1.845 |
5.8831 |
16 |
0 |
0 |
373 |
0 |
2 |
9 |
|
C-I |
0.0 |
0.0 |
-2.073 |
-2.073 |
17 |
0 |
0 |
310 |
0 |
7 |
1 |
|
C-N |
-10.5003 |
-20.9618 |
-0.0705 |
-31.5326 |
12 |
0 |
0 |
19 |
0 |
1 |
0 |
|
C-P |
0.0 |
-24.6394 |
16 |
ARG493C, ARG493P, ASP482C, ASP482P, GLU378C, GLU378P, GLU390C, GLU390P, GLU454C, GLU454P, HIS483C, HIS483P, LYS367C, LYS367P, LYS484C, LYS484P |
C-V |
0.0 |
-5.4933 |
5 |
ASP196V, GLU498C, GLU58V, HIS57V, LYS192V |
D-E |
-16.5175 |
-33.4075 |
-259.378 |
-309.303 |
105 |
30 |
8 |
11963 |
2 |
36 |
40 |
|
D-F |
-11.1338 |
-13.5659 |
-442.971 |
-467.6706 |
208 |
30 |
24 |
24351 |
2 |
52 |
42 |
|
E-G |
-6.0492 |
-8.9477 |
-440.352 |
-455.3489 |
210 |
49 |
27 |
25285 |
2 |
51 |
40 |
|
F-G |
-17.526 |
-30.909 |
-130.864 |
-179.299 |
102 |
52 |
6 |
11267 |
2 |
36 |
41 |
|
H-I |
-8.3226 |
-24.0685 |
-167.666 |
-200.0571 |
101 |
40 |
5 |
10322 |
1 |
34 |
39 |
|
H-J |
-24.553 |
-1.0257 |
-242.178 |
-267.7567 |
219 |
150 |
27 |
27277 |
2 |
53 |
42 |
|
H-M |
0.0 |
-4.2701 |
-8.8475 |
-13.1175 |
23 |
16 |
1 |
1767 |
1 |
9 |
11 |
|
I-L |
0.0 |
0.0 |
-0.0015 |
-0.0015 |
2 |
0 |
0 |
1 |
0 |
2 |
0 |
|
I-M |
-4.054 |
26.118 |
-31.1915 |
-9.1275 |
64 |
27 |
0 |
4149 |
0 |
38 |
42 |
|
I-N |
0.0 |
-5.6588 |
0.0 |
-5.6588 |
5 |
0 |
0 |
0 |
0 |
0 |
0 |
|
J-M |
0.0 |
0.0 |
-0.0014 |
-0.0014 |
2 |
0 |
0 |
1 |
0 |
2 |
0 |
|
K-L |
-9.1807 |
-27.9866 |
-212.646 |
-249.8133 |
103 |
32 |
6 |
10919 |
2 |
34 |
40 |
|
K-M |
-14.5028 |
-9.1846 |
-409.079 |
-432.7663 |
220 |
75 |
30 |
26661 |
2 |
52 |
43 |
|
K-S |
0.0 |
-5.2639 |
5 |
ASP196S, GLU498K, GLU58S, HIS57S, LYS192S |
L-N |
-32.2153 |
-9.8688 |
9.2621 |
-32.8219 |
89 |
53 |
10 |
7132 |
0 |
4 |
4 |
|
L-O |
0.0 |
-23.0465 |
8 |
ARG103O, ASP157O, ASP98L, GLU156O, GLU158O, HIS155O, LYS335L, LYS337L |
L-S |
-10.2624 |
25.6818 |
14 |
ARG231L, ARG231S, ASP445L, ASP445S, GLN198L, GLN198S, GLU202L, GLU202S, LYS229L, LYS229S, LYS484L, LYS484S, LYS486L, LYS486S |
L-T |
0.0 |
-5.312 |
4 |
ASP196L, GLU498T, HIS57L, LYS192L |
M-N |
-18.8308 |
-30.0069 |
0.0 |
-48.8377 |
16 |
0 |
0 |
0 |
0 |
0 |
0 |
|
N-O |
-6.4836 |
2.5544 |
6 |
ARG136O, ASN305N, ASP183O, ASP249O, GLU58N, LYS335N |
N-P |
0.0 |
3.434 |
2 |
ASP13P, GLU35N |
O-P |
-12.4484 |
-8.7793 |
30 |
ARG262O, ARG262P, ARG307O, ARG307P, ARG310O, ARG310P, ARG348O, ARG348P, ASP13O, ASP13P, ASP145O, ASP145P, ASP315O, ASP315P, GLN297O, GLN297P, GLU272O, GLU272P, GLU300O, GLU300P, GLU312O, GLU312P, GLU352O, GLU352P, HIS5O, HIS5P, LYS273O, LYS273P, LYS279O, LYS279P |
P-U |
0.0 |
-5.4933 |
5 |
ASP196P, GLU498U, GLU58P, HIS57P, LYS192P |
P-V |
-7.8641 |
9.5706 |
15 |
ARG231P, ARG231V, ARG404P, ASP232V, ASP445P, ASP445V, GLN198P, GLU202P, GLU202V, LYS229P, LYS229V, LYS484P, LYS484V, LYS486P, LYS486V |
Q-R |
-15.3773 |
-30.3685 |
17 |
ARG493Q, ARG493R, ASP482Q, ASP482R, GLU378Q, GLU378R, GLU390Q, GLU390R, GLU454Q, GLU454R, HIS483Q, HIS483R, LYS367Q, LYS367R, LYS484Q, LYS484R, MET374Q |
Q-S |
-11.9693 |
-12.2716 |
31 |
ARG262Q, ARG262S, ARG307Q, ARG307S, ARG310Q, ARG310S, ARG348Q, ARG348S, ASN6Q, ASP13Q, ASP13S, ASP145Q, ASP145S, ASP315Q, ASP315S, GLN297S, GLU272Q, GLU272S, GLU300Q, GLU300S, GLU312Q, GLU312S, GLU352Q, GLU352S, HIS5Q, HIS5S, LYS273Q, LYS273S, LYS279Q, LYS279S, SER283S |
R-T |
-11.0652 |
-9.8169 |
29 |
ARG262R, ARG262T, ARG307T, ARG310R, ARG310T, ARG348R, ARG348T, ASN6R, ASP13R, ASP13T, ASP145R, ASP315R, ASP315T, GLU272R, GLU272T, GLU300R, GLU300T, GLU312R, GLU312T, GLU352R, GLU352T, HIS5R, HIS5T, ILE11T, LYS273R, LYS273T, LYS279R, LYS279T, SER283T |
S-T |
-30.5661 |
-31.1882 |
18 |
ARG493S, ARG493T, ASP482S, ASP482T, GLN491S, GLN491T, GLU378S, GLU378T, GLU390S, GLU390T, GLU454S, GLU454T, HIS480S, HIS483S, HIS483T, LYS367S, LYS484S, LYS484T |
U-V |
-15.717 |
-25.4797 |
17 |
ARG493U, ARG493V, ASP482U, ASP482V, GLU378U, GLU378V, GLU390U, GLU390V, GLU454U, GLU454V, HIS483U, HIS483V, LYS367U, LYS367V, LYS484U, LYS484V, MET374V |
U-W |
-39.1177 |
-1.4373 |
32 |
ALA311W, ARG262U, ARG262W, ARG307U, ARG307W, ARG310U, ARG310W, ARG348U, ARG348W, ASP13U, ASP13W, ASP145U, ASP145W, ASP315U, ASP315W, GLN297U, GLN297W, GLU272U, GLU272W, GLU300U, GLU300W, GLU312U, GLU312W, GLU352U, GLU352W, GLY263U, HIS5U, HIS5W, LYS273U, LYS273W, LYS279U, LYS279W |
V-X |
-24.4741 |
-19.064 |
32 |
ARG262V, ARG262X, ARG307V, ARG307X, ARG310V, ARG310X, ARG348V, ARG348X, ASN6V, ASN6X, ASP13V, ASP13X, ASP145V, ASP145X, ASP315V, ASP315X, GLN297V, GLU272V, GLU272X, GLU300V, GLU300X, GLU312V, GLU312X, GLU352V, GLU352X, HIS5V, HIS5X, LYS273V, LYS273X, LYS279V, LYS279X, SER283X |
W-X |
-20.3612 |
-28.1787 |
17 |
ARG493W, ARG493X, ASP482W, ASP482X, GLU378W, GLU378X, GLU390W, GLU390X, GLU454W, GLU454X, HIS483W, HIS483X, LYS367W, LYS367X, LYS484W, LYS484X, MET374X |
|