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 |
-124.1195 |
-33.5997 |
-597.783 |
-755.5023 |
199 |
25 |
12 |
23692 |
9 |
47 |
48 |
|
A-C |
0.0 |
0.0 |
-0.2874 |
-0.2874 |
5 |
0 |
0 |
55 |
0 |
1 |
2 |
|
A-D |
0.0 |
0.0 |
-0.2849 |
-0.2849 |
5 |
0 |
0 |
55 |
0 |
1 |
2 |
|
A-E |
-127.0061 |
-29.6367 |
-597.044 |
-753.6868 |
201 |
28 |
12 |
24007 |
9 |
48 |
48 |
|
B-C |
-133.9591 |
-37.0516 |
-621.037 |
-792.0477 |
199 |
31 |
13 |
24458 |
9 |
49 |
49 |
|
B-D |
0.0 |
0.0 |
-0.2495 |
-0.2495 |
5 |
0 |
0 |
50 |
0 |
1 |
2 |
|
B-E |
0.0 |
0.0 |
-0.2401 |
-0.2401 |
5 |
0 |
0 |
50 |
0 |
1 |
2 |
|
C-D |
-116.6138 |
-33.422 |
-586.309 |
-736.3449 |
197 |
25 |
12 |
23647 |
9 |
47 |
47 |
|
C-E |
0.0 |
0.0 |
-0.2841 |
-0.2841 |
5 |
0 |
0 |
54 |
0 |
1 |
2 |
|
C-S |
0.0 |
5.841 |
4 |
GLU38C, GLU38S, LYS33C, LYS33S |
C-T |
-19.0943 |
-17.1605 |
9 |
ALA143C, ALA316T, ARG55C, ASN59C, GLU274T, LYS267T, LYS33C, PHE244T, THR103C |
D-E |
-110.6337 |
-39.6534 |
-591.582 |
-741.8691 |
198 |
25 |
13 |
23829 |
9 |
49 |
47 |
|
D-M |
0.0 |
6.0212 |
-52.4895 |
-46.4683 |
23 |
1 |
1 |
2060 |
0 |
10 |
9 |
|
D-N |
-30.2609 |
-18.2775 |
10 |
ALA143D, ALA316N, ARG55D, ASN59D, GLU274N, LYS267N, LYS33D, PHE244N, PHE32D, THR103D |
D-S |
-31.3687 |
-17.544 |
11 |
ALA143S, ALA316D, ARG55S, ASN59S, GLU151S, GLU274D, LYS267D, LYS33S, PHE244D, PHE32S, TYR272D |
E-M |
-30.8421 |
-17.1853 |
-261.148 |
-309.1754 |
97 |
22 |
12 |
11570 |
1 |
16 |
11 |
|
F-G |
-123.5228 |
-32.479 |
-624.842 |
-780.8438 |
203 |
31 |
13 |
24468 |
10 |
49 |
48 |
|
F-H |
0.0 |
0.0 |
-0.2352 |
-0.2352 |
5 |
0 |
0 |
49 |
0 |
1 |
2 |
|
F-I |
0.0 |
0.0 |
-0.249 |
-0.249 |
5 |
0 |
0 |
51 |
0 |
1 |
2 |
|
F-J |
-156.7227 |
-31.4414 |
-659.005 |
-847.1692 |
202 |
39 |
13 |
24966 |
9 |
48 |
48 |
|
G-H |
-116.9675 |
-35.5636 |
-593.011 |
-745.5421 |
201 |
33 |
12 |
24100 |
9 |
46 |
49 |
|
G-I |
0.0 |
0.0 |
-0.2854 |
-0.2854 |
5 |
0 |
0 |
51 |
0 |
1 |
2 |
|
G-J |
0.0 |
0.0 |
-0.3444 |
-0.3444 |
5 |
0 |
0 |
59 |
0 |
2 |
2 |
|
H-I |
-129.7636 |
-33.0236 |
-611.307 |
-774.0942 |
204 |
38 |
12 |
24579 |
9 |
50 |
49 |
|
H-J |
0.0 |
0.0 |
-0.3285 |
-0.3285 |
5 |
0 |
0 |
58 |
0 |
2 |
2 |
|
H-K |
-24.2738 |
-17.9083 |
-269.619 |
-311.8011 |
93 |
10 |
13 |
11391 |
1 |
16 |
11 |
|
H-O |
0.0 |
5.6291 |
4 |
GLU38H, GLU38O, LYS33H, LYS33O |
I-J |
-126.1278 |
-38.3294 |
-660.346 |
-824.8032 |
203 |
31 |
13 |
25080 |
10 |
48 |
48 |
|
I-O |
-24.6077 |
-19.2445 |
10 |
ALA143O, ALA316I, ARG55O, ASN59O, GLU274I, LYS267I, LYS33O, PHE244I, PHE32O, THR103O |
I-Q |
0.0 |
5.9242 |
4 |
GLU38I, GLU38Q, LYS33I, LYS33Q |
I-R |
-26.8428 |
-16.2504 |
11 |
ALA143I, ALA316R, ALA58I, ARG55I, ASN59I, GLU274R, LYS267R, LYS33I, PHE244R, PHE32I, SER246R |
J-Q |
-19.9772 |
-16.1476 |
9 |
ALA143Q, ALA316J, ARG55Q, ASN59Q, GLU274J, LYS267J, LYS33Q, PHE244J, THR103Q |
K-L |
-112.1458 |
-34.8588 |
-602.006 |
-749.0106 |
199 |
25 |
12 |
23993 |
9 |
48 |
48 |
|
K-O |
-121.4878 |
-34.0701 |
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, MET430O, PHE412K, PHE455O, PRO341K, SER342K, SER415O, TYR467O, VAL349K, VAL438O |
L-M |
-119.3045 |
-29.6078 |
-423.89 |
-572.8023 |
161 |
15 |
8 |
16472 |
8 |
31 |
25 |
|
M-N |
-115.3614 |
-33.4903 |
47 |
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, MET430M, PHE412N, PHE455M, SER342N, SER415M, THR42M, VAL349N, VAL438M |
N-O |
-107.5229 |
-35.228 |
46 |
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 |
6.1395 |
4 |
GLU38N, GLU38R, LYS33N, LYS33R |
N-S |
-19.3843 |
-17.3005 |
10 |
ALA143N, ALA316S, ALA58N, ARG55N, ASN59N, GLU274S, LYS267S, LYS33N, PHE244S, SER246S |
O-R |
-22.8188 |
-16.231 |
11 |
ALA143R, ALA316O, ARG55R, ASN59R, GLU151R, GLU274O, LYS267O, LYS33R, PHE244O, THR103R, TYR272O |
P-Q |
-126.0817 |
-36.434 |
47 |
ALA296Q, ALA456P, 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, VAL349Q, VAL438P |
P-T |
-115.8338 |
-32.5873 |
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 |
-105.5567 |
-32.573 |
45 |
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, LYS482R, PHE412R, PHE455Q, SER339R, SER342R, SER415Q, VAL349R, VAL438Q |
R-S |
-121.0806 |
-34.0373 |
46 |
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, PRO341S, SER342S, SER415R, VAL349S, VAL438R |
S-T |
-113.5282 |
-34.2377 |
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, MET430S, PHE412T, PHE455S, SER339T, SER342T, SER415S, VAL349T, VAL438S |
|