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 |
-263.4165 |
-260.1431 |
-2110.69 |
-2634.2496 |
639 |
167 |
45 |
90736 |
19 |
213 |
194 |
|
A-C |
-109.5048 |
-146.0192 |
-1017.17 |
-1272.694 |
334 |
102 |
47 |
49477 |
13 |
125 |
134 |
|
A-D |
0.0 |
16.0743 |
-1.3338 |
14.7404 |
18 |
0 |
0 |
113 |
0 |
9 |
7 |
|
A-E |
0.0 |
5.2624 |
-9.9864 |
-4.724 |
16 |
0 |
0 |
297 |
0 |
2 |
3 |
|
A-F |
0.0 |
0.0 |
-0.0091 |
-0.0091 |
2 |
0 |
0 |
7 |
0 |
0 |
0 |
|
A-G |
-52.1911 |
-43.2714 |
-332.036 |
-427.4985 |
121 |
25 |
8 |
14704 |
4 |
35 |
27 |
|
A-H |
-8.0383 |
-15.0228 |
-128.912 |
-151.9731 |
58 |
17 |
6 |
6178 |
0 |
13 |
10 |
|
A-K |
-4.0844 |
-15.1102 |
-236.436 |
-255.6306 |
121 |
17 |
7 |
11571 |
2 |
39 |
35 |
|
A-L |
-26.5178 |
-29.3001 |
-185.939 |
-241.7569 |
77 |
5 |
2 |
7664 |
3 |
25 |
21 |
|
A-Q |
0.0 |
3.6907 |
-34.7982 |
-31.1075 |
35 |
8 |
0 |
2189 |
0 |
22 |
20 |
|
A-V |
0.0 |
0.0 |
-3.9731 |
-3.9731 |
12 |
0 |
0 |
401 |
0 |
1 |
1 |
|
A-Y |
0.0 |
10.4714 |
-0.1681 |
10.3033 |
8 |
0 |
0 |
35 |
0 |
5 |
4 |
|
B-C |
-15.7639 |
7.7395 |
-170.498 |
-178.5224 |
119 |
8 |
15 |
9627 |
0 |
16 |
18 |
|
B-D |
-27.5558 |
-75.2682 |
-368.745 |
-471.569 |
148 |
27 |
5 |
15664 |
5 |
42 |
52 |
|
B-E |
-12.731 |
6.307 |
-18.9312 |
-25.3552 |
25 |
7 |
2 |
1237 |
0 |
9 |
8 |
|
B-F |
0.0 |
0.0 |
-2.7809 |
-2.7809 |
6 |
0 |
0 |
165 |
0 |
0 |
0 |
|
B-G |
0.0 |
0.0 |
-0.0009 |
-0.0009 |
2 |
0 |
0 |
2 |
0 |
1 |
2 |
|
B-K |
0.0 |
0.0 |
-7.4273 |
-7.4273 |
16 |
0 |
0 |
503 |
0 |
1 |
1 |
|
B-L |
0.0 |
3.0215 |
-45.8487 |
-42.8272 |
34 |
5 |
0 |
2058 |
1 |
9 |
9 |
|
B-N |
-27.5097 |
-44.5403 |
-416.375 |
-488.4251 |
141 |
28 |
9 |
18226 |
2 |
25 |
31 |
|
B-P |
-25.968 |
-53.1026 |
-214.779 |
-293.8495 |
103 |
23 |
6 |
9894 |
2 |
43 |
24 |
|
C-E |
-20.4916 |
-39.4629 |
-111.513 |
-171.4675 |
44 |
12 |
2 |
4664 |
1 |
7 |
8 |
|
C-H |
-33.3818 |
-24.844 |
-263.694 |
-321.9198 |
105 |
21 |
9 |
11985 |
3 |
42 |
31 |
|
C-I |
0.0 |
0.0 |
-0.0772 |
-0.0772 |
3 |
0 |
0 |
25 |
0 |
1 |
0 |
|
C-K |
-27.8643 |
-41.8125 |
-239.249 |
-308.9258 |
83 |
25 |
10 |
10789 |
1 |
16 |
11 |
|
C-W |
0.0 |
8.344 |
-0.2314 |
8.1126 |
8 |
0 |
0 |
42 |
0 |
5 |
4 |
|
C-Y |
0.0 |
0.7873 |
-6.6619 |
-5.8746 |
19 |
0 |
0 |
600 |
0 |
8 |
9 |
|
C-Z |
0.0 |
-8.6099 |
2 |
GLU129C, LYS19Z |
D-G |
0.0 |
0.0 |
-0.1764 |
-0.1764 |
6 |
0 |
0 |
59 |
0 |
3 |
2 |
|
D-L |
-41.6585 |
-118.3319 |
-348.755 |
-508.7455 |
119 |
20 |
18 |
16840 |
12 |
43 |
40 |
|
D-N |
0.0 |
2.8983 |
-231.478 |
-228.5797 |
102 |
12 |
7 |
10967 |
1 |
19 |
17 |
|
D-P |
-41.6668 |
-12.0031 |
-146.342 |
-200.012 |
52 |
13 |
12 |
5456 |
3 |
17 |
11 |
|
E-F |
-41.6152 |
-28.9731 |
-404.507 |
-475.0952 |
142 |
49 |
24 |
18620 |
2 |
33 |
24 |
|
E-K |
-2.3217 |
-5.7227 |
-108.48 |
-116.5243 |
44 |
11 |
2 |
4116 |
0 |
6 |
1 |
|
G-V |
-5.741 |
0.0 |
-14.1398 |
-19.8808 |
19 |
0 |
0 |
779 |
0 |
10 |
9 |
|
G-W |
0.0 |
0.0 |
-3.9551 |
-3.9551 |
12 |
0 |
0 |
405 |
0 |
1 |
1 |
|
H-K |
0.0 |
-7.7474 |
-63.9268 |
-71.6743 |
36 |
3 |
0 |
2796 |
1 |
15 |
11 |
|
H-Q |
-9.9989 |
-19.5734 |
-80.622 |
-110.1942 |
52 |
15 |
2 |
4573 |
2 |
23 |
22 |
|
H-Y |
0.0 |
-7.4032 |
0.0 |
-7.4032 |
2 |
0 |
0 |
0 |
0 |
0 |
0 |
|
I-R |
0.0 |
0.0 |
-7.0119 |
-7.0119 |
16 |
0 |
0 |
478 |
0 |
0 |
1 |
|
I-T |
0.0 |
-5.4962 |
-105.585 |
-111.0812 |
44 |
11 |
2 |
4062 |
0 |
5 |
1 |
|
I-W |
-4.0811 |
-15.6376 |
-242.815 |
-262.5337 |
121 |
20 |
7 |
11743 |
2 |
39 |
35 |
|
I-Y |
-29.0818 |
-41.2715 |
-21.2768 |
-91.6301 |
33 |
5 |
2 |
1634 |
0 |
6 |
5 |
|
I-Z |
0.0 |
-8.6964 |
8 |
ARG64Z, ASP12I, GLU17I, GLU27Z, GLU34Z, GLU74Z, HIS14I, LYS30Z |
J-W |
0.0 |
3.5732 |
-33.4376 |
-29.8644 |
34 |
8 |
0 |
2198 |
0 |
21 |
20 |
|
J-Z |
-10.2003 |
-17.113 |
7 |
ARG38Z, ARG66J, ASP62J, ASP70J, GLU40Z, GLU63J, LYS33Z |
M-R |
0.0 |
3.3268 |
-46.5731 |
-43.2463 |
34 |
3 |
0 |
2111 |
1 |
9 |
9 |
|
M-S |
-39.3229 |
-105.6476 |
-348.436 |
-493.4065 |
119 |
18 |
16 |
16767 |
12 |
43 |
39 |
|
M-W |
-27.6441 |
-30.6381 |
-189.468 |
-247.7502 |
79 |
9 |
2 |
7766 |
3 |
26 |
22 |
|
N-P |
0.0 |
13.1784 |
-14.4243 |
-1.2459 |
15 |
1 |
0 |
1008 |
0 |
2 |
5 |
|
O-R |
-64.9663 |
-46.1817 |
-410.967 |
-522.115 |
145 |
34 |
9 |
18396 |
2 |
25 |
30 |
|
O-S |
-5.4358 |
2.9427 |
-230.772 |
-233.2651 |
103 |
13 |
7 |
10970 |
1 |
19 |
16 |
|
O-X |
0.0 |
13.384 |
-15.2197 |
-1.8357 |
14 |
1 |
0 |
1032 |
0 |
2 |
5 |
|
R-S |
-18.4862 |
-75.16 |
-365.284 |
-458.9302 |
150 |
31 |
5 |
15626 |
5 |
42 |
52 |
|
R-T |
-11.6354 |
6.2444 |
-20.1606 |
-25.5517 |
25 |
7 |
2 |
1175 |
0 |
9 |
7 |
|
R-U |
0.0 |
0.0 |
-2.1382 |
-2.1382 |
6 |
0 |
0 |
139 |
0 |
0 |
0 |
|
R-V |
0.0 |
0.0 |
-0.0012 |
-0.0012 |
2 |
0 |
0 |
3 |
0 |
1 |
2 |
|
R-W |
-279.4614 |
-251.549 |
-2121.54 |
-2652.5504 |
638 |
158 |
43 |
91097 |
19 |
211 |
195 |
|
R-X |
-26.2709 |
-54.8804 |
-213.214 |
-294.3653 |
103 |
29 |
6 |
10158 |
2 |
43 |
23 |
|
R-Y |
0.0 |
7.8182 |
0.0 |
7.8182 |
2 |
0 |
0 |
0 |
0 |
0 |
0 |
|
S-V |
0.0 |
0.0 |
-0.1894 |
-0.1894 |
6 |
0 |
0 |
62 |
0 |
3 |
2 |
|
S-W |
0.0 |
16.0838 |
-1.3021 |
14.7817 |
17 |
0 |
0 |
110 |
0 |
9 |
7 |
|
S-X |
-42.465 |
-43.3331 |
-150.212 |
-236.0101 |
53 |
16 |
12 |
5531 |
3 |
18 |
11 |
|
T-U |
-37.8641 |
-22.5136 |
-385.99 |
-446.3676 |
141 |
49 |
24 |
18325 |
2 |
33 |
24 |
|
T-W |
0.0 |
5.2735 |
-9.4807 |
-4.2072 |
15 |
0 |
0 |
287 |
0 |
2 |
3 |
|
T-Y |
-22.2415 |
-41.0024 |
0.0 |
-63.2438 |
6 |
0 |
0 |
0 |
0 |
0 |
0 |
|
U-W |
0.0 |
0.0 |
-0.011 |
-0.011 |
2 |
0 |
0 |
8 |
0 |
0 |
0 |
|
V-W |
-68.1365 |
-41.1123 |
-331.973 |
-441.2219 |
121 |
24 |
8 |
14819 |
4 |
35 |
27 |
|
W-Y |
-100.4673 |
-142.1737 |
-125.429 |
-368.07 |
113 |
21 |
1 |
7254 |
0 |
33 |
41 |
|
W-Z |
-8.2685 |
-14.8569 |
8 |
ARG67Z, ASP835W, ASP852W, GLN41Z, GLU34Z, GLU40Z, LYS122W, VAL845W |
Y-Z |
-33.0236 |
-30.3034 |
20 |
ARG290Y, ARG322Y, ARG46Z, ARG67Z, ARG79Z, ASP268Y, ASP49Z, GLU281Y, GLU287Y, GLU291Y, GLU30Y, GLU74Z, HIS14Z, HIS20Z, LEU42Z, LYS271Y, LYS68Z, PRO43Z, THR321Y, THR323Y |
|