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 |
-89.1727 |
-35.9322 |
-601.8 |
-726.905 |
200 |
18 |
12 |
23645 |
9 |
47 |
46 |
|
A-C |
0.0 |
0.0 |
-0.1689 |
-0.1689 |
4 |
0 |
0 |
37 |
0 |
1 |
2 |
|
A-D |
0.0 |
0.0 |
-0.2178 |
-0.2178 |
5 |
0 |
0 |
47 |
0 |
1 |
2 |
|
A-E |
-140.9873 |
-32.5838 |
-631.371 |
-804.9421 |
201 |
32 |
12 |
24505 |
9 |
49 |
48 |
|
B-C |
-92.2597 |
-37.1009 |
-566.996 |
-696.3565 |
195 |
25 |
11 |
23480 |
9 |
47 |
49 |
|
B-D |
0.0 |
0.0 |
-0.2571 |
-0.2571 |
5 |
0 |
0 |
51 |
0 |
1 |
2 |
|
B-E |
0.0 |
0.0 |
-0.2876 |
-0.2876 |
5 |
0 |
0 |
56 |
0 |
1 |
2 |
|
C-D |
-132.3801 |
-32.4159 |
-614.09 |
-778.886 |
200 |
33 |
12 |
24414 |
9 |
48 |
48 |
|
C-E |
0.0 |
0.0 |
-0.2721 |
-0.2721 |
5 |
0 |
0 |
53 |
0 |
1 |
2 |
|
C-S |
0.0 |
5.5096 |
4 |
GLU38C, GLU38S, LYS33C, LYS33S |
C-T |
-14.9687 |
-17.6649 |
8 |
ALA143C, ALA316T, ARG55C, ASN59C, GLU274T, LYS267T, LYS33C, PHE244T |
D-E |
-138.4032 |
-31.5708 |
-640.944 |
-810.9181 |
201 |
28 |
13 |
24641 |
9 |
48 |
49 |
|
D-M |
0.0 |
5.2665 |
-59.784 |
-54.5175 |
23 |
2 |
1 |
2209 |
0 |
10 |
9 |
|
D-N |
-22.9659 |
-16.4872 |
10 |
ALA143D, ALA316N, ALA58D, ARG55D, ASN59D, GLU274N, LYS267N, LYS33D, PHE244N, SER246N |
D-S |
-24.551 |
-17.1777 |
11 |
ALA143S, ALA316D, ARG55S, ASN59S, GLU151S, GLU274D, LYS267D, LYS33S, PHE244D, THR103S, TYR272D |
E-M |
-22.2974 |
-16.3487 |
-272.404 |
-311.05 |
98 |
16 |
13 |
11788 |
1 |
16 |
11 |
|
F-G |
-117.2459 |
-32.553 |
-619.632 |
-769.4309 |
202 |
33 |
12 |
24354 |
9 |
48 |
48 |
|
F-H |
0.0 |
0.0 |
-0.2838 |
-0.2838 |
5 |
0 |
0 |
54 |
0 |
1 |
2 |
|
F-I |
0.0 |
0.0 |
-0.28 |
-0.28 |
5 |
0 |
0 |
54 |
0 |
1 |
2 |
|
F-J |
-120.8545 |
-33.6559 |
-599.848 |
-754.3584 |
199 |
30 |
12 |
23893 |
9 |
48 |
47 |
|
G-H |
-108.9687 |
-35.9945 |
-602.964 |
-747.9272 |
200 |
22 |
12 |
23931 |
9 |
48 |
48 |
|
G-I |
0.0 |
0.0 |
-0.2175 |
-0.2175 |
5 |
0 |
0 |
45 |
0 |
1 |
2 |
|
G-J |
0.0 |
0.0 |
-0.2322 |
-0.2322 |
5 |
0 |
0 |
48 |
0 |
1 |
2 |
|
H-I |
-113.8649 |
-36.0361 |
-602.771 |
-752.672 |
199 |
28 |
13 |
24055 |
9 |
47 |
48 |
|
H-J |
0.0 |
0.0 |
-0.2345 |
-0.2345 |
5 |
0 |
0 |
48 |
0 |
1 |
2 |
|
H-K |
-19.4817 |
-17.8069 |
-270.142 |
-307.4306 |
96 |
10 |
13 |
11445 |
1 |
16 |
11 |
|
H-O |
0.0 |
5.4544 |
4 |
GLU38H, GLU38O, LYS33H, LYS33O |
I-J |
-114.0047 |
-36.2363 |
-591.424 |
-741.665 |
199 |
24 |
12 |
23790 |
9 |
47 |
48 |
|
I-O |
-19.3805 |
-16.2867 |
10 |
ALA143O, ALA316I, ALA58O, ARG55O, ASN59O, GLU274I, LYS267I, LYS33O, PHE244I, SER246I |
I-Q |
0.0 |
5.7391 |
4 |
GLU38I, GLU38Q, LYS33I, LYS33Q |
I-R |
-25.484 |
-17.4891 |
10 |
ALA143I, ALA316R, ARG55I, ASN59I, GLU151I, GLU274R, LYS267R, LYS33I, PHE244R, TYR272R |
J-Q |
-25.0313 |
-18.6912 |
10 |
ALA143Q, ALA316J, ARG55Q, ASN59Q, GLU274J, LYS267J, LYS33Q, PHE244J, PHE32Q, THR103Q |
K-L |
-109.1516 |
-43.1948 |
-608.184 |
-760.5304 |
196 |
21 |
13 |
24032 |
9 |
48 |
48 |
|
K-O |
-143.7791 |
-29.8194 |
48 |
ALA296K, ARG284K, ARG289K, ARG293K, ARG469O, ARG485K, ASP346K, ASP352K, ASP427O, ASP433O, ASP476O, GLN405K, GLU158O, GLU254K, GLU264K, GLU344K, GLU383K, GLU38O, GLU411K, GLU411O, GLU445K, GLU449O, GLY413K, GLY413O, GLY417O, GLY434O, HIS437O, ILE41O, LEU408K, LYS121O, LYS267K, LYS282K, LYS403K, LYS414K, LYS414O, LYS423O, LYS443K, LYS443O, LYS482K, PHE412K, PHE455O, PRO341K, SER342K, SER415O, THR42O, TYR467O, VAL349K, VAL438O |
L-M |
-121.6125 |
-41.821 |
-443.369 |
-606.8025 |
162 |
14 |
9 |
16725 |
7 |
33 |
25 |
|
M-N |
-104.8956 |
-31.2603 |
45 |
ALA296N, ARG284N, ARG289N, ARG293N, ARG469M, ARG485N, ASP346N, ASP352N, ASP427M, ASP433M, ASP476M, GLN405N, GLU158M, GLU254N, GLU264N, GLU344N, GLU383N, GLU38M, GLU411M, GLU411N, GLU445N, GLU449M, GLY413M, GLY413N, GLY417M, GLY434M, HIS437M, ILE41M, LEU408N, LYS121M, LYS267N, LYS282N, LYS403N, LYS414M, LYS414N, LYS423M, LYS443M, LYS443N, LYS482N, PHE412N, PHE455M, SER342N, SER415M, VAL349N, VAL438M |
N-O |
-126.5345 |
-36.8377 |
47 |
ALA296O, ARG284O, ARG289O, ARG293O, ARG469N, ARG485O, ASP346O, ASP352O, ASP427N, ASP433N, ASP476N, GLN405O, GLU158N, GLU254O, GLU264O, GLU344O, GLU383O, GLU38N, GLU411N, GLU411O, GLU445O, GLU449N, GLY413N, GLY413O, GLY417N, GLY434N, HIS437N, ILE41N, LEU408O, LYS121N, LYS267O, LYS282O, LYS403O, LYS414N, LYS414O, LYS423N, LYS443N, LYS443O, LYS482O, PHE412O, PHE455N, PRO341O, SER342O, SER415N, THR42N, VAL349O, VAL438N |
N-R |
0.0 |
5.8161 |
4 |
GLU38N, GLU38R, LYS33N, LYS33R |
N-S |
-32.8833 |
-17.3886 |
13 |
ALA143N, ALA316S, ALA58N, ARG55N, ASN59N, GLU151N, GLU274S, LYS267S, LYS33N, PHE244S, PHE32N, SER246S, TYR272S |
O-R |
-31.0545 |
-18.2909 |
10 |
ALA143R, ALA316O, ARG55R, ASN59R, GLU274O, LYS267O, LYS33R, PHE244O, PHE32R, THR103R |
P-Q |
-141.8708 |
-29.0207 |
47 |
ALA296Q, ARG284Q, ARG289Q, ARG293Q, ARG469P, ARG485Q, ASP346Q, ASP352Q, ASP427P, ASP433P, ASP476P, GLN405Q, GLU158P, GLU254Q, GLU264Q, GLU344Q, GLU383Q, GLU38P, GLU411P, GLU411Q, GLU445Q, GLU449P, GLY413P, GLY413Q, GLY417P, GLY434P, HIS437P, ILE41P, LEU408Q, LYS121P, LYS267Q, LYS282Q, LYS403Q, LYS414P, LYS414Q, LYS423P, LYS443P, LYS443Q, LYS482Q, PHE412Q, PHE455P, PRO341Q, SER342Q, SER415P, THR42P, VAL349Q, VAL438P |
P-T |
-126.982 |
-36.2807 |
47 |
ALA296P, ARG284P, ARG289P, ARG293P, ARG469T, ARG485P, ASP346P, ASP352P, ASP427T, ASP433T, ASP476T, GLN405P, GLU158T, GLU254P, GLU264P, GLU344P, GLU383P, GLU38T, GLU411P, GLU411T, GLU445P, GLU449T, GLY413P, GLY413T, GLY417T, GLY434T, HIS437T, ILE41T, LEU408P, LYS121T, LYS267P, LYS282P, LYS403P, LYS414P, LYS414T, LYS423T, LYS443P, LYS443T, LYS482P, PHE412P, PHE455T, SER342P, SER415T, THR42T, TYR467T, VAL349P, VAL438T |
Q-R |
-117.2695 |
-34.7207 |
47 |
ALA296R, ARG284R, ARG289R, ARG293R, ARG469Q, ARG485R, ASP346R, ASP352R, ASP427Q, ASP433Q, ASP476Q, GLN405R, GLU158Q, GLU254R, GLU264R, GLU344R, GLU383R, GLU38Q, GLU411Q, GLU411R, GLU445R, GLU449Q, GLY413Q, GLY413R, GLY417Q, GLY434Q, HIS437Q, ILE41Q, LEU408R, LYS121Q, LYS267R, LYS282R, LYS403R, LYS414Q, LYS414R, LYS423Q, LYS443Q, LYS443R, LYS482R, PHE412R, PHE455Q, PRO341R, SER342R, SER415Q, THR42Q, VAL349R, VAL438Q |
R-S |
-113.2599 |
-35.8375 |
45 |
ALA296S, ARG284S, ARG289S, ARG293S, ARG469R, ARG485S, ASP346S, ASP352S, ASP427R, ASP433R, ASP476R, GLN405S, GLU158R, GLU254S, GLU264S, GLU344S, GLU383S, GLU38R, GLU411R, GLU411S, GLU445S, GLU449R, GLY413R, GLY413S, GLY417R, GLY434R, HIS437R, ILE41R, LEU408S, LYS121R, LYS267S, LYS282S, LYS403S, LYS414R, LYS414S, LYS423R, LYS443R, LYS443S, LYS482S, PHE412S, PHE455R, SER342S, SER415R, VAL349S, VAL438R |
S-T |
-122.3367 |
-34.397 |
47 |
ALA296T, ARG284T, ARG289T, ARG293T, ARG469S, ARG485T, ASP346T, ASP352T, ASP427S, ASP433S, ASP476S, GLN405T, GLU158S, GLU254T, GLU264T, GLU344T, GLU383T, GLU38S, GLU411S, GLU411T, GLU445T, GLU449S, GLY413S, GLY413T, GLY417S, GLY434S, HIS437S, ILE41S, LEU408T, LYS121S, LYS267T, LYS282T, LYS403T, LYS414S, LYS414T, LYS423S, LYS443S, LYS443T, LYS482T, PHE412T, PHE455S, PRO341T, SER342T, SER415S, THR42S, VAL349T, VAL438S |
|