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 |
-40.8947 |
-11.1147 |
-592.093 |
-644.1024 |
259 |
142 |
11 |
27225 |
8 |
130 |
133 |
|
A-C |
0.0 |
0.0 |
-3.6373 |
-3.6373 |
14 |
0 |
0 |
425 |
0 |
2 |
5 |
|
A-D |
0.0 |
0.0 |
-0.0265 |
-0.0265 |
3 |
0 |
0 |
21 |
0 |
1 |
1 |
|
A-E |
0.0 |
0.0 |
-0.0103 |
-0.0103 |
2 |
0 |
0 |
8 |
0 |
0 |
0 |
|
A-F |
0.0 |
0.0 |
-0.0102 |
-0.0102 |
3 |
0 |
0 |
10 |
0 |
0 |
1 |
|
A-G |
0.0 |
0.0 |
-3.6493 |
-3.6493 |
14 |
0 |
0 |
426 |
0 |
2 |
5 |
|
A-H |
-48.5651 |
-10.729 |
-590.768 |
-650.062 |
259 |
139 |
11 |
27208 |
8 |
130 |
133 |
|
A-M |
0.0 |
0.0 |
-0.0009 |
-0.0009 |
2 |
0 |
0 |
3 |
0 |
0 |
0 |
|
A-N |
-8.7147 |
9.8605 |
18 |
ARG105A, ARG105N, ASP112A, ASP112N, ASP19A, ASP19N, ASP451A, ASP451N, GLU102A, GLU102N, GLU109A, GLU109N, HIS116A, HIS116N, LYS106A, LYS106N, MET1A, MET1N |
A-O |
0.0 |
4.8128 |
2 |
ARG18A, ARG18O |
B-C |
-48.5124 |
-10.7565 |
-591.33 |
-650.5989 |
259 |
138 |
11 |
27203 |
8 |
130 |
133 |
|
B-D |
0.0 |
0.0 |
-3.3557 |
-3.3557 |
14 |
0 |
0 |
412 |
0 |
2 |
5 |
|
B-E |
0.0 |
0.0 |
-0.0102 |
-0.0102 |
3 |
0 |
0 |
10 |
0 |
0 |
1 |
|
B-F |
0.0 |
0.0 |
-0.0011 |
-0.0011 |
2 |
0 |
0 |
3 |
0 |
0 |
0 |
|
B-G |
0.0 |
0.0 |
-0.0266 |
-0.0266 |
3 |
0 |
0 |
21 |
0 |
1 |
1 |
|
B-H |
0.0 |
0.0 |
-3.3645 |
-3.3645 |
14 |
0 |
0 |
413 |
0 |
2 |
5 |
|
B-O |
-8.7128 |
9.8894 |
18 |
ARG105B, ARG105O, ASP112B, ASP112O, ASP19B, ASP19O, ASP451B, ASP451O, GLU102B, GLU102O, GLU109B, GLU109O, HIS116B, HIS116O, LYS106B, LYS106O, MET1B, MET1O |
B-P |
0.0 |
4.8092 |
2 |
ARG18B, ARG18P |
C-D |
-40.9855 |
-11.0726 |
-591.426 |
-643.4842 |
259 |
142 |
11 |
27232 |
8 |
130 |
133 |
|
C-E |
0.0 |
0.0 |
-3.6262 |
-3.6262 |
14 |
0 |
0 |
425 |
0 |
2 |
5 |
|
C-F |
0.0 |
0.0 |
-0.0264 |
-0.0264 |
3 |
0 |
0 |
21 |
0 |
1 |
1 |
|
C-G |
0.0 |
0.0 |
-0.0103 |
-0.0103 |
2 |
0 |
0 |
8 |
0 |
0 |
0 |
|
C-H |
0.0 |
0.0 |
-0.0103 |
-0.0103 |
3 |
0 |
0 |
10 |
0 |
0 |
1 |
|
C-I |
0.0 |
4.8093 |
-34.5564 |
-29.7471 |
28 |
1 |
0 |
1279 |
0 |
10 |
5 |
|
C-P |
-8.73 |
9.8758 |
18 |
ARG105C, ARG105P, ASP112C, ASP112P, ASP19C, ASP19P, ASP451C, ASP451P, GLU102C, GLU102P, GLU109C, GLU109P, HIS116C, HIS116P, LYS106C, LYS106P, MET1C, MET1P |
D-E |
-48.6211 |
-10.7408 |
-591.069 |
-650.4308 |
259 |
139 |
11 |
27196 |
8 |
130 |
133 |
|
D-F |
0.0 |
0.0 |
-3.3479 |
-3.3479 |
14 |
0 |
0 |
412 |
0 |
2 |
5 |
|
D-G |
0.0 |
0.0 |
-0.0102 |
-0.0102 |
3 |
0 |
0 |
10 |
0 |
0 |
1 |
|
D-H |
0.0 |
0.0 |
-0.0011 |
-0.0011 |
2 |
0 |
0 |
3 |
0 |
0 |
0 |
|
D-I |
-8.7322 |
9.8988 |
-140.012 |
-138.8455 |
106 |
2 |
0 |
6592 |
2 |
50 |
52 |
|
D-J |
0.0 |
4.8093 |
-34.5579 |
-29.7486 |
28 |
1 |
0 |
1279 |
0 |
10 |
5 |
|
E-F |
-40.9639 |
-11.0793 |
-591.386 |
-643.4292 |
259 |
142 |
11 |
27232 |
8 |
130 |
133 |
|
E-G |
0.0 |
0.0 |
-3.6403 |
-3.6403 |
14 |
0 |
0 |
426 |
0 |
2 |
5 |
|
E-H |
0.0 |
0.0 |
-0.0264 |
-0.0264 |
3 |
0 |
0 |
21 |
0 |
1 |
1 |
|
E-I |
0.0 |
0.0 |
-14.9593 |
-14.9593 |
12 |
11 |
1 |
846 |
0 |
0 |
3 |
|
E-J |
-8.73 |
9.8754 |
-140.121 |
-138.9756 |
106 |
2 |
0 |
6582 |
2 |
50 |
52 |
|
E-K |
0.0 |
4.8093 |
-34.5564 |
-29.7471 |
28 |
1 |
0 |
1279 |
0 |
10 |
5 |
|
F-G |
-48.631 |
-10.7229 |
-591.18 |
-650.5339 |
259 |
138 |
11 |
27197 |
8 |
130 |
133 |
|
F-H |
0.0 |
0.0 |
-3.3532 |
-3.3532 |
14 |
0 |
0 |
412 |
0 |
2 |
5 |
|
F-J |
0.0 |
0.0 |
-14.9593 |
-14.9593 |
12 |
11 |
1 |
846 |
0 |
0 |
3 |
|
F-K |
-8.7322 |
9.8988 |
-140.012 |
-138.8455 |
106 |
2 |
0 |
6592 |
2 |
50 |
52 |
|
F-L |
0.0 |
4.8093 |
-34.5579 |
-29.7486 |
28 |
1 |
0 |
1279 |
0 |
10 |
5 |
|
G-H |
-40.9469 |
-11.0714 |
-591.547 |
-643.5653 |
259 |
142 |
11 |
27231 |
8 |
130 |
133 |
|
G-K |
0.0 |
0.0 |
-14.9593 |
-14.9593 |
12 |
11 |
1 |
846 |
0 |
0 |
3 |
|
G-L |
-8.73 |
9.8754 |
-140.121 |
-138.9756 |
106 |
2 |
0 |
6582 |
2 |
50 |
52 |
|
G-M |
0.0 |
4.8093 |
-23.6354 |
-18.8261 |
23 |
0 |
0 |
916 |
0 |
8 |
4 |
|
H-L |
0.0 |
0.0 |
-14.9593 |
-14.9593 |
12 |
11 |
1 |
846 |
0 |
0 |
3 |
|
H-M |
-8.7322 |
9.8978 |
-100.811 |
-99.6454 |
81 |
1 |
0 |
4817 |
2 |
34 |
37 |
|
H-N |
0.0 |
4.8102 |
2 |
ARG18H, ARG18N |
I-J |
-40.9698 |
-11.0871 |
-590.427 |
-642.4839 |
260 |
145 |
11 |
27209 |
8 |
130 |
133 |
|
I-K |
0.0 |
0.0 |
-3.2929 |
-3.2929 |
14 |
0 |
0 |
407 |
0 |
2 |
5 |
|
I-L |
0.0 |
0.0 |
-0.0229 |
-0.0229 |
3 |
0 |
0 |
17 |
0 |
1 |
1 |
|
I-P |
-48.6318 |
-10.7368 |
52 |
ARG251I, ARG251P, ARG346P, ARG511I, ARG522I, ARG66P, ASP191I, ASP247I, ASP247P, ASP254I, ASP254P, ASP45P, ASP50P, ASP513I, ASP514I, ASP51P, ASP526I, ASP54P, GLU164P, GLU185I, GLU243P, GLU245I, GLU249I, GLU249P, GLU263P, GLU265P, GLU266P, GLU374P, GLU446P, GLU504I, GLU507I, GLU519I, GLU67P, GLU71P, GLU80I, HIS116I, HIS375P, ILE250I, ILE252I, LYS13I, LYS187I, LYS225P, LYS330I, LYS347P, LYS46P, LYS520I, LYS76I, LYS83I, MET47P, THR253I, THR253P, VAL49P |
J-K |
-48.6318 |
-10.7368 |
-590.358 |
-649.7266 |
260 |
141 |
11 |
27174 |
8 |
130 |
133 |
|
J-L |
0.0 |
0.0 |
-3.5404 |
-3.5404 |
14 |
0 |
0 |
420 |
0 |
2 |
5 |
|
K-L |
-40.9698 |
-11.0871 |
-590.427 |
-642.4839 |
260 |
145 |
11 |
27209 |
8 |
130 |
133 |
|
L-M |
-48.6318 |
-10.7368 |
-86.9919 |
-146.3605 |
134 |
16 |
1 |
5422 |
5 |
37 |
34 |
|
M-N |
-40.9503 |
-11.0865 |
51 |
ARG251M, ARG251N, ARG346M, ARG511N, ARG522N, ARG66M, ASP191N, ASP247M, ASP247N, ASP254M, ASP254N, ASP45M, ASP50M, ASP513N, ASP514N, ASP51M, ASP526N, ASP54M, GLU164M, GLU185N, GLU243M, GLU245N, GLU249M, GLU249N, GLU263M, GLU265M, GLU266M, GLU374M, GLU446M, GLU504N, GLU507N, GLU519N, GLU67M, GLU71M, GLU80N, HIS116N, HIS375M, ILE250N, ILE252N, LYS13N, LYS187N, LYS225M, LYS330N, LYS347M, LYS46M, LYS520N, LYS76N, LYS83N, MET47M, THR253M, VAL49M |
N-O |
-48.6314 |
-10.7364 |
52 |
ARG251N, ARG251O, ARG346N, ARG511O, ARG522O, ARG66N, ASP191O, ASP247N, ASP247O, ASP254N, ASP254O, ASP45N, ASP50N, ASP513O, ASP514O, ASP51N, ASP526O, ASP54N, GLU164N, GLU185O, GLU243N, GLU245O, GLU249N, GLU249O, GLU263N, GLU265N, GLU266N, GLU374N, GLU446N, GLU504O, GLU507O, GLU519O, GLU67N, GLU71N, GLU80O, HIS116O, HIS375N, ILE250O, ILE252O, LYS13O, LYS187O, LYS225N, LYS330O, LYS347N, LYS46N, LYS520O, LYS76O, LYS83O, MET47N, THR253N, THR253O, VAL49N |
O-P |
-40.9698 |
-11.0871 |
51 |
ARG251O, ARG251P, ARG346O, ARG511P, ARG522P, ARG66O, ASP191P, ASP247O, ASP247P, ASP254O, ASP254P, ASP45O, ASP50O, ASP513P, ASP514P, ASP51O, ASP526P, ASP54O, GLU164O, GLU185P, GLU243O, GLU245P, GLU249O, GLU249P, GLU263O, GLU265O, GLU266O, GLU374O, GLU446O, GLU504P, GLU507P, GLU519P, GLU67O, GLU71O, GLU80P, HIS116P, HIS375O, ILE250P, ILE252P, LYS13P, LYS187P, LYS225O, LYS330P, LYS347O, LYS46O, LYS520P, LYS76P, LYS83P, MET47O, THR253O, VAL49O |
|