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 |
0.0 |
0.0 |
-0.019 |
-0.019 |
2 |
0 |
0 |
11 |
0 |
0 |
0 |
|
A-D |
-72.7154 |
-99.1672 |
-530.553 |
-702.4356 |
241 |
23 |
11 |
22679 |
6 |
59 |
73 |
|
A-E |
-100.3741 |
-9.6371 |
-461.017 |
-571.0282 |
208 |
24 |
10 |
20090 |
5 |
67 |
67 |
|
A-G |
0.0 |
-2.4089 |
-98.0836 |
-100.4925 |
73 |
2 |
1 |
4760 |
0 |
24 |
15 |
|
A-I |
0.0 |
0.0 |
-0.0018 |
-0.0018 |
3 |
0 |
0 |
2 |
0 |
0 |
0 |
|
B-E |
-67.2776 |
-48.4284 |
-458.807 |
-574.5131 |
196 |
26 |
12 |
18910 |
3 |
44 |
54 |
|
B-F |
-90.6244 |
-45.7965 |
-571.704 |
-708.1249 |
246 |
32 |
13 |
23898 |
9 |
78 |
70 |
|
B-G |
-4.3788 |
-31.0553 |
-31.3715 |
-66.8056 |
51 |
3 |
0 |
1970 |
1 |
13 |
4 |
|
B-N |
-20.3983 |
4.1138 |
-16.3063 |
-32.5908 |
24 |
5 |
0 |
836 |
0 |
15 |
11 |
|
C-D |
-79.005 |
18.9184 |
-468.404 |
-528.4906 |
243 |
17 |
11 |
20923 |
3 |
70 |
71 |
|
C-F |
-85.4894 |
-77.3339 |
-510.299 |
-673.1223 |
239 |
18 |
11 |
21964 |
7 |
58 |
73 |
|
C-G |
-22.793 |
41.6281 |
-44.9653 |
-26.1302 |
50 |
2 |
0 |
2272 |
1 |
13 |
12 |
|
C-I |
0.0 |
0.0 |
-0.0596 |
-0.0596 |
5 |
0 |
0 |
18 |
0 |
1 |
2 |
|
D-F |
0.0 |
0.0 |
-0.4202 |
-0.4202 |
7 |
0 |
0 |
103 |
0 |
0 |
1 |
|
D-G |
-6.9067 |
-28.4619 |
-79.2135 |
-114.5822 |
68 |
2 |
5 |
4245 |
3 |
24 |
18 |
|
D-I |
0.0 |
0.0 |
-0.0098 |
-0.0098 |
2 |
0 |
0 |
1 |
0 |
1 |
3 |
|
E-G |
-10.0958 |
-39.6567 |
-79.1897 |
-128.9422 |
53 |
3 |
2 |
3750 |
2 |
12 |
4 |
|
E-K |
0.0 |
2.5994 |
-10.614 |
-8.0146 |
18 |
1 |
0 |
666 |
0 |
12 |
18 |
|
E-N |
-3.025 |
-16.0297 |
-9.362 |
-28.4167 |
41 |
0 |
0 |
924 |
2 |
21 |
18 |
|
E-T |
0.0 |
-4.5429 |
2 |
GLU504T, LYS40E |
F-G |
-17.3474 |
-54.0713 |
-92.052 |
-163.4707 |
76 |
6 |
4 |
4525 |
3 |
28 |
15 |
|
G-H |
-11.9867 |
-2.3764 |
-240.607 |
-254.9701 |
92 |
6 |
9 |
9693 |
0 |
22 |
19 |
|
G-I |
-67.5459 |
5.8687 |
-254.885 |
-316.5622 |
94 |
21 |
16 |
10797 |
1 |
14 |
14 |
|
H-I |
-6.2094 |
-9.0637 |
-88.0924 |
-103.3654 |
66 |
7 |
12 |
4682 |
2 |
7 |
6 |
|
J-K |
0.0 |
0.0 |
-0.0041 |
-0.0041 |
3 |
0 |
0 |
8 |
0 |
0 |
0 |
|
J-M |
-120.4469 |
-100.3897 |
-540.437 |
-761.2736 |
242 |
32 |
11 |
22489 |
8 |
57 |
74 |
|
J-N |
-87.579 |
-7.5965 |
-497.666 |
-592.8414 |
225 |
24 |
9 |
21445 |
5 |
74 |
70 |
|
J-P |
-3.0186 |
-17.4879 |
-81.5412 |
-102.0477 |
73 |
0 |
2 |
4182 |
4 |
22 |
15 |
|
K-N |
-57.3018 |
-48.2715 |
-432.89 |
-538.4633 |
191 |
16 |
11 |
18006 |
3 |
44 |
51 |
|
K-O |
-82.3458 |
-39.2376 |
-590.452 |
-712.0354 |
247 |
32 |
13 |
24461 |
10 |
80 |
72 |
|
K-P |
0.0 |
-24.4797 |
-36.4302 |
-60.9099 |
59 |
0 |
0 |
2338 |
2 |
14 |
8 |
|
K-T |
0.0 |
-5.0716 |
2 |
ASP124K, LYS493T |
K-X |
0.0 |
5.6322 |
4 |
ASP465X, GLU29K, GLU464X, LYS91K |
L-M |
-67.3163 |
-23.0911 |
-661.031 |
-751.4384 |
285 |
26 |
15 |
28603 |
7 |
92 |
77 |
|
L-O |
-94.1098 |
-98.7045 |
-505.623 |
-698.4374 |
231 |
29 |
12 |
21748 |
8 |
56 |
71 |
|
L-P |
-7.8696 |
22.0354 |
-30.1683 |
-16.0025 |
42 |
1 |
0 |
1682 |
0 |
10 |
6 |
|
M-O |
0.0 |
0.0 |
-11.054 |
-11.054 |
10 |
1 |
2 |
771 |
0 |
0 |
4 |
|
M-P |
-12.7863 |
-13.4092 |
-92.0406 |
-118.2361 |
75 |
8 |
5 |
4793 |
2 |
32 |
23 |
|
M-R |
0.0 |
0.0 |
-0.0345 |
-0.0345 |
2 |
0 |
0 |
5 |
0 |
1 |
2 |
|
N-P |
-21.1172 |
-60.8156 |
-113.399 |
-195.3318 |
65 |
12 |
2 |
5105 |
3 |
19 |
7 |
|
O-P |
-3.0383 |
-27.9811 |
-78.0039 |
-109.0233 |
76 |
5 |
4 |
3880 |
2 |
25 |
15 |
|
O-X |
0.0 |
0.7399 |
2 |
LYS176X, LYS40O |
P-Q |
-17.9279 |
0.0 |
-129.414 |
-147.3419 |
78 |
4 |
7 |
5344 |
0 |
16 |
16 |
|
P-R |
-10.9542 |
0.0 |
-82.3829 |
-93.3371 |
65 |
2 |
13 |
4405 |
0 |
4 |
7 |
|
Q-R |
0.0 |
0.0 |
-26.0123 |
-26.0123 |
46 |
0 |
10 |
1665 |
0 |
5 |
3 |
|
S-V |
-69.8988 |
-90.9553 |
33 |
ARG173S, ARG212S, ARG274V, ARG281S, ARG356V, ARG82S, ASN57V, ASP330V, ASP352V, ASP38S, ASP81S, GLN217S, GLN282S, GLU126V, GLU240S, GLU294V, GLU29V, GLU357S, GLU56V, GLU86S, GLU88S, HIS118V, HIS328V, HIS53V, LEU30V, LYS152V, LYS211S, LYS354V, LYS382V, LYS85S, SER277V, THR287V, VAL36S |
S-W |
-69.3335 |
-3.7627 |
32 |
ALA51S, ARG130S, ARG141S, ARG142S, ARG166S, ARG190W, ARG192W, ARG199W, ARG375S, ARG72W, ASN195W, ASP196W, ASP22W, ASP299S, ASP349S, ASP65W, GLU193W, GLU224W, GLU267W, GLU309S, GLU52S, GLU68W, GLU69S, GLY45S, GLY69W, ILE138S, LEU46S, LEU68S, LEU70W, LYS134S, SER346S, VAL16W |
S-Y |
0.0 |
-0.6598 |
10 |
ARG259Y, ARG293S, ARG30Y, ASP136Y, ASP335S, ASP411S, GLU266Y, GLU294S, GLU7Y, LYS33Y |
T-W |
-51.2518 |
-42.9572 |
24 |
ARG173T, ARG212T, ARG274W, ARG82T, ASN57W, ASP330W, ASP38T, ASP81T, GLN282T, GLN52W, GLU126W, GLU240T, GLU294W, GLU56W, GLU86T, HIS118W, HIS328W, HIS53W, LYS152W, LYS211T, LYS85T, PHE326W, THR287W, VAL36T |
T-X |
-88.3931 |
-42.7381 |
39 |
ALA51T, ARG130T, ARG141T, ARG142T, ARG166T, ARG190X, ARG192X, ARG199X, ARG289T, ARG293T, ARG375T, ARG72X, ASN195X, ASP196X, ASP22X, ASP299T, ASP315X, ASP316X, ASP319X, ASP335T, ASP349T, ASP65X, GLU105X, GLU193X, GLU224X, GLU267X, GLU309T, GLU52T, GLU68X, GLU69T, ILE345T, ILE347T, LEU68T, LEU70X, LYS134T, LYS317T, SER337T, THR191X, VAL16X |
T-Y |
0.0 |
-34.666 |
5 |
ARG257Y, ASP335T, ASP411T, GLU294T, LYS93Y |
U-V |
-74.1763 |
-0.8568 |
33 |
ALA51U, ARG130U, ARG141U, ARG142U, ARG166U, ARG190V, ARG192V, ARG199V, ARG375U, ARG400U, ARG72V, ASP196V, ASP22V, ASP299U, ASP349U, ASP65V, GLN72U, GLU193V, GLU224V, GLU267V, GLU309U, GLU341V, GLU401U, GLU52U, GLU68V, GLU69U, GLY45U, GLY69V, LEU68U, LEU70V, LYS134U, SER346U, VAL16V |
U-X |
-77.94 |
-81.7927 |
39 |
ARG173U, ARG212U, ARG274X, ARG288U, ARG356X, ARG364U, ARG82U, ASN57X, ASP120X, ASP172U, ASP288X, ASP330X, ASP352X, ASP38U, ASP81U, GLN217U, GLN282U, GLU126X, GLU240U, GLU294X, GLU29X, GLU357U, GLU56X, GLU86U, GLU88U, GLY273X, HIS118X, HIS328X, HIS53X, LEU351X, LYS152X, LYS211U, LYS354X, LYS382X, LYS85U, THR287X, TYR360U, TYR368X, VAL36U |
U-Y |
-20.9886 |
11.4177 |
10 |
ARG293U, ASP112Y, ASP269Y, ASP335U, ASP411U, GLU266Y, GLU294U, GLU5Y, LYS113Y, LYS4Y |
V-Y |
0.0 |
-31.1715 |
8 |
ASP315V, ASP316V, ASP386V, ASP394V, LYS11Y, LYS135Y, LYS4Y, LYS81Y |
W-Y |
-8.7951 |
-31.1933 |
8 |
ARG257Y, ARG259Y, ASP238Y, ASP316W, ASP319W, ASP386W, THR264Y, VAL279W |
X-Y |
0.0 |
-45.428 |
4 |
ARG120Y, ARG9Y, ASP386X, GLU398X |
Y-1 |
-9.8554 |
0.0 |
2 |
ASP148Y, SER91 |
|