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 |
-101.2115 |
-48.7501 |
-439.454 |
-589.4155 |
203 |
61 |
17 |
20603 |
7 |
82 |
75 |
|
a-g |
-91.1277 |
-45.4832 |
-427.69 |
-564.3009 |
199 |
39 |
18 |
20188 |
7 |
76 |
79 |
|
a-h |
-14.6621 |
-31.3305 |
-61.1651 |
-107.1576 |
45 |
2 |
2 |
2939 |
1 |
25 |
17 |
|
a-n |
0.0 |
7.564 |
2 |
GLU461a, GLU461n |
a-o |
-37.6431 |
-4.4513 |
8 |
ARG267a, ASN264a, GLU237a, GLY28o, LYS25o, LYS27o, THR26o, VAL31o |
a-p |
0.0 |
1.491 |
3 |
ASP34p, GLU309a, LYS307a |
b-c |
-95.5391 |
-65.34 |
-411.967 |
-572.846 |
202 |
44 |
18 |
19938 |
7 |
86 |
92 |
|
b-h |
0.0 |
7.4011 |
-35.5138 |
-28.1127 |
27 |
2 |
1 |
1572 |
0 |
4 |
7 |
|
b-i |
-10.3468 |
-28.7979 |
-61.9803 |
-101.125 |
44 |
2 |
2 |
2930 |
1 |
24 |
16 |
|
b-p |
-8.3404 |
-4.5128 |
6 |
ARG267b, GLU237b, GLY28p, LYS25p, LYS27p, THR26p |
b-q |
-3.0678 |
-0.9469 |
5 |
ASP34q, LYS307b, LYS37q, PHE306b, THR35q |
c-d |
-99.5226 |
-47.4981 |
-417.695 |
-564.7157 |
197 |
35 |
16 |
19751 |
7 |
82 |
78 |
|
c-i |
0.0 |
8.5708 |
-31.1954 |
-22.6246 |
24 |
0 |
1 |
1431 |
0 |
4 |
6 |
|
c-j |
-10.6469 |
-28.8364 |
-65.4262 |
-104.9095 |
44 |
3 |
2 |
2950 |
1 |
25 |
16 |
|
c-q |
-9.2573 |
-17.3659 |
7 |
ARG230c, ASN264c, GLU237c, GLU38q, LYS27q, THR26q, VAL31q |
c-r |
-8.7765 |
1.102 |
4 |
ASN310c, ASP34-8.7765303.123296, ASP34r, GLU309c |
d-e |
-112.1863 |
-72.8213 |
-373.05 |
-558.0577 |
202 |
39 |
16 |
18897 |
8 |
89 |
93 |
|
d-j |
0.0 |
8.5028 |
-27.8246 |
-19.3218 |
23 |
0 |
1 |
1356 |
0 |
3 |
6 |
|
d-k |
0.0 |
-25.1416 |
-58.5118 |
-83.6534 |
44 |
2 |
2 |
2786 |
1 |
26 |
18 |
|
d-r |
-5.8552 |
-5.2629 |
3 |
GLU237d, GLY28-5.8552122.779058, LYS27r |
d-s |
0.0 |
1.3 |
3 |
ASP34s, GLU309d, LYS307d |
e-f |
-90.0095 |
-37.9196 |
-418.13 |
-546.0591 |
202 |
57 |
17 |
20212 |
7 |
74 |
81 |
|
e-k |
0.0 |
7.8488 |
-30.1625 |
-22.3137 |
24 |
0 |
1 |
1426 |
0 |
4 |
7 |
|
e-l |
-7.6239 |
-26.1819 |
-70.4062 |
-104.212 |
45 |
3 |
3 |
3112 |
1 |
28 |
18 |
|
e-s |
-54.2892 |
-48.6958 |
10 |
ARG230e, ARG267e, ASN264e, ASP34s, GLU237e, GLU256e, GLU38s, LYS25s, LYS27s, VAL31s |
e-t |
-9.9102 |
2.9005 |
3 |
ASP34t, GLU309e, LYS307e |
f-g |
-96.5426 |
-69.0265 |
-399.422 |
-564.9911 |
202 |
40 |
18 |
19437 |
6 |
88 |
90 |
|
f-l |
0.0 |
8.0139 |
-28.6712 |
-20.6573 |
23 |
0 |
1 |
1343 |
0 |
4 |
7 |
|
f-m |
-12.276 |
-31.1399 |
-60.6335 |
-104.0494 |
34 |
4 |
4 |
2452 |
0 |
12 |
10 |
|
f-t |
-23.9824 |
-4.4881 |
8 |
ARG267f, ASN264f, GLU237f, GLY28t, LYS25t, LYS27t, THR26t, VAL31t |
f-u |
0.0 |
1.7862 |
4 |
ASP34u, GLU309f, LYS307f, LYS37u |
g-m |
0.0 |
7.39 |
0.0 |
7.39 |
2 |
0 |
0 |
0 |
0 |
0 |
0 |
|
g-n |
-14.5474 |
-31.5822 |
7 |
ASP435n, ASP9g, GLU10g, GLU433n, LYS105g, LYS105n, LYS441g |
g-o |
0.0 |
0.282 |
3 |
ASP34o, GLU309g, LYS307g |
g-u |
-33.5114 |
-1.7689 |
10 |
ARG267g, ASN264g, GLU237g, GLU256g, GLY28u, LYS25u, LYS27u, LYS37u, THR26u, VAL31u |
h-i |
-84.1315 |
-71.6008 |
-286.201 |
-441.9333 |
160 |
17 |
12 |
13919 |
4 |
62 |
67 |
|
h-n |
-71.1329 |
-78.5428 |
23 |
ALA521h, ARG267n, ARG284h, ARG36n, ASP282h, GLU256h, GLU385n, GLU41n, GLU520h, GLU525h, GLU59n, GLU61n, GLU63n, HIS65h, LYS180n, LYS276h, LYS28n, LYS42n, LYS43n, LYS4h, LYS526h, VAL39n, VAL523h |
i-j |
-64.2649 |
-75.1871 |
-322.072 |
-461.5239 |
165 |
16 |
14 |
14414 |
5 |
67 |
70 |
|
j-k |
-83.8536 |
-73.5627 |
-326.329 |
-483.7453 |
168 |
18 |
13 |
14730 |
4 |
69 |
69 |
|
k-l |
-86.4905 |
-68.6959 |
-306.576 |
-461.7625 |
165 |
23 |
12 |
14498 |
4 |
62 |
64 |
|
l-m |
-102.3202 |
-66.8943 |
-138.82 |
-308.0346 |
108 |
17 |
4 |
6724 |
3 |
21 |
24 |
|
m-n |
-88.7056 |
-74.2417 |
24 |
ALA521n, ARG267m, ARG284n, ARG36m, ASN37m, ASP282n, GLU256n, GLU385m, GLU41m, GLU520n, GLU525n, GLU59m, GLU61m, GLU63m, HIS65n, LYS180m, LYS276n, LYS42m, LYS43m, LYS4n, LYS526n, THR518n, VAL39m, VAL523n |
o-p |
-77.8399 |
-1.6108 |
18 |
ARG14p, ARG52o, ARG59p, ARG93o, ASP68o, GLN100o, GLU55o, GLU55p, GLU63o, GLU81p, GLU85p, GLY12p, LEU95o, LYS27o, LYS9p, VAL53p, VAL7p, VAL98o |
o-q |
0.0 |
7.7643 |
2 |
GLU55o, GLU55q |
o-t |
0.0 |
11.6387 |
2 |
GLU55o, GLU55t |
o-u |
-47.5285 |
-21.1952 |
15 |
ARG14o, ARG59o, ARG93u, ASP68u, ASP83o, GLN100u, GLU55o, GLU55u, GLU63u, GLU81o, GLU85o, LYS27u, LYS9o, VAL7o, VAL98u |
p-q |
-74.8004 |
2.8356 |
19 |
ARG14q, ARG52p, ARG93p, ASN56p, ASN56q, ASP68p, GLN100p, GLU55p, GLU55q, GLU81q, GLU85q, LEU11q, LEU95p, LEU96p, LYS27p, LYS9q, VAL53q, VAL7q, VAL98p |
p-r |
0.0 |
7.5761 |
2 |
GLU55p, GLU55r |
p-u |
0.0 |
1.0692 |
2 |
GLU55p, GLU55u |
q-r |
-28.9519 |
15.0672 |
17 |
7-7.4401972.843753VAL, 9-8.3973842.743159LYS, ARG14-8.8762892.459637, ARG93q, ASP68q, ASP83r, GLN100q, GLU23q, GLU38q, GLU55q, GLU55r, GLU81r, LEU11-4.2379903.205774, LEU96q, LYS27q, LYS9r, VAL98q |
r-s |
-76.7059 |
-8.7489 |
15 |
ARG59s, ARG93-2.8372232.816580, ASN56-27.6425622.225133, ASP68r, GLN100-11.0944902.821527, GLN100-13.0509422.858841, GLU55r, GLU55s, GLU63r, GLU81s, GLU85s, LYS27r, LYS9s, VAL98-13.5638112.685909, VAL98-8.5168912.680161 |
r-t |
0.0 |
10.021 |
2 |
GLU55r, GLU55t |
r-u |
0.0 |
4.8239 |
2 |
GLU55r, GLU55u |
s-t |
-51.1534 |
44.1804 |
19 |
ARG14t, ARG93s, ASN56s, ASP68s, ASP83t, GLN100s, GLU22s, GLU23s, GLU55s, GLU55t, GLU81t, GLU85t, LEU11t, LEU95s, LEU96s, LYS27s, LYS9t, VAL7t, VAL98s |
s-u |
0.0 |
8.2181 |
2 |
GLU55s, GLU55u |
t-u |
-40.8993 |
-13.1109 |
15 |
ARG14u, ARG52t, ARG59u, ARG93t, ASN56t, ASN56u, ASP68t, GLU55t, GLU55u, GLU63t, GLU81u, LEU95t, LYS27t, LYS9u, VAL98t |
|