## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
Id |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
1 |
|
P |
142 |
50 |
10136 |
◊ |
L |
x,y,z |
1_555 |
112 |
27 |
9006 |
1233.0 |
-25.3 |
0.031 |
7 |
0 |
0 |
0.361 |
2 |
|
M |
123 |
43 |
9895 |
◊ |
I |
x,y,z |
1_555 |
100 |
23 |
8570 |
1072.9 |
-21.3 |
0.065 |
7 |
0 |
0 |
0.361 |
3 |
|
F |
123 |
44 |
10417 |
◊ |
B |
x,y,z |
1_555 |
97 |
22 |
8063 |
1051.8 |
-21.3 |
0.045 |
6 |
0 |
0 |
0.361 |
4 |
|
E |
118 |
43 |
10487 |
◊ |
A |
x,y,z |
1_555 |
96 |
22 |
8439 |
1021.1 |
-18.9 |
0.078 |
8 |
0 |
0 |
0.361 |
5 |
|
H |
112 |
41 |
10427 |
◊ |
D |
x,y,z |
1_555 |
93 |
19 |
7857 |
964.6 |
-18.9 |
0.070 |
7 |
0 |
0 |
0.361 |
6 |
|
O |
111 |
44 |
9957 |
◊ |
K |
x,y,z |
1_555 |
89 |
23 |
8555 |
955.7 |
-19.2 |
0.069 |
5 |
0 |
0 |
0.361 |
7 |
|
G |
110 |
42 |
10202 |
◊ |
C |
x,y,z |
1_555 |
91 |
20 |
8200 |
954.6 |
-18.6 |
0.071 |
6 |
0 |
0 |
0.361 |
8 |
|
N |
109 |
42 |
9886 |
◊ |
J |
x,y,z |
1_555 |
87 |
20 |
8460 |
926.0 |
-18.0 |
0.089 |
7 |
0 |
0 |
0.361 |
Average: |
1022.5 |
-20.2 |
0.065 |
7 |
0 |
0 |
0.361 |
2 |
9 |
|
D |
66 |
21 |
7857 |
◊ |
A |
x,y,z |
1_555 |
76 |
22 |
8439 |
727.5 |
-2.5 |
0.824 |
12 |
8 |
0 |
0.183 |
10 |
|
L |
74 |
22 |
9006 |
◊ |
K |
x,y,z |
1_555 |
66 |
21 |
8555 |
725.0 |
-2.2 |
0.859 |
13 |
8 |
0 |
0.183 |
11 |
|
D |
77 |
22 |
7857 |
◊ |
C |
x,y,z |
1_555 |
66 |
21 |
8200 |
722.6 |
-2.5 |
0.809 |
12 |
8 |
0 |
0.183 |
12 |
|
C |
76 |
22 |
8200 |
◊ |
B |
x,y,z |
1_555 |
67 |
21 |
8063 |
720.8 |
-2.5 |
0.802 |
12 |
8 |
0 |
0.183 |
13 |
|
J |
75 |
22 |
8460 |
◊ |
I |
x,y,z |
1_555 |
67 |
21 |
8570 |
720.7 |
-2.5 |
0.847 |
10 |
8 |
0 |
0.183 |
14 |
|
L |
67 |
21 |
9006 |
◊ |
I |
x,y,z |
1_555 |
76 |
22 |
8570 |
719.4 |
-2.3 |
0.879 |
12 |
8 |
0 |
0.183 |
15 |
|
K |
78 |
22 |
8555 |
◊ |
J |
x,y,z |
1_555 |
69 |
21 |
8460 |
717.5 |
-2.4 |
0.848 |
14 |
8 |
0 |
0.183 |
16 |
|
B |
74 |
22 |
8063 |
◊ |
A |
x,y,z |
1_555 |
67 |
21 |
8439 |
711.6 |
-2.3 |
0.817 |
11 |
7 |
0 |
0.183 |
Average: |
720.6 |
-2.4 |
0.836 |
12 |
8 |
0 |
0.183 |
3 |
17 |
|
P |
58 |
17 |
10136 |
◊ |
E |
x,y,z |
1_555 |
68 |
19 |
10487 |
542.3 |
-3.0 |
0.691 |
5 |
2 |
0 |
0.036 |
18 |
|
O |
44 |
12 |
9957 |
◊ |
F |
x,y,z |
1_555 |
55 |
16 |
10417 |
409.5 |
-4.1 |
0.517 |
4 |
0 |
0 |
0.036 |
19 |
|
N |
41 |
14 |
9886 |
◊ |
G |
x,y,z |
1_555 |
48 |
14 |
10202 |
365.7 |
-1.3 |
0.692 |
3 |
0 |
0 |
0.036 |
20 |
|
M |
41 |
13 |
9895 |
◊ |
H |
x,y,z |
1_555 |
48 |
14 |
10427 |
341.1 |
-2.3 |
0.688 |
2 |
0 |
0 |
0.036 |
Average: |
414.6 |
-2.7 |
0.647 |
4 |
1 |
0 |
0.036 |
4 |
21 |
|
P |
52 |
19 |
10136 |
◊ |
H |
x-1,y-1,z |
1_445 |
49 |
12 |
10427 |
493.4 |
-4.7 |
0.451 |
5 |
0 |
0 |
0.017 |
5 |
22 |
|
N |
55 |
14 |
9886 |
◊ |
K |
x,y,z |
1_555 |
51 |
15 |
8555 |
482.2 |
-4.5 |
0.599 |
5 |
1 |
0 |
0.063 |
23 |
|
M |
55 |
15 |
9895 |
◊ |
J |
x,y,z |
1_555 |
51 |
16 |
8460 |
475.6 |
-4.5 |
0.615 |
5 |
0 |
0 |
0.063 |
24 |
|
E |
57 |
14 |
10487 |
◊ |
B |
x,y,z |
1_555 |
51 |
15 |
8063 |
474.8 |
-4.6 |
0.580 |
5 |
1 |
0 |
0.063 |
25 |
|
F |
55 |
15 |
10417 |
◊ |
C |
x,y,z |
1_555 |
51 |
14 |
8200 |
474.1 |
-4.8 |
0.549 |
5 |
0 |
0 |
0.063 |
26 |
|
O |
53 |
14 |
9957 |
◊ |
L |
x,y,z |
1_555 |
50 |
14 |
9006 |
454.2 |
-4.4 |
0.614 |
4 |
1 |
0 |
0.063 |
27 |
|
P |
52 |
13 |
10136 |
◊ |
I |
x,y,z |
1_555 |
53 |
15 |
8570 |
453.1 |
-4.3 |
0.624 |
4 |
0 |
0 |
0.063 |
28 |
|
G |
56 |
15 |
10202 |
◊ |
D |
x,y,z |
1_555 |
49 |
14 |
7857 |
439.0 |
-4.3 |
0.577 |
5 |
0 |
0 |
0.063 |
29 |
|
H |
54 |
15 |
10427 |
◊ |
A |
x,y,z |
1_555 |
47 |
14 |
8439 |
426.1 |
-4.4 |
0.591 |
5 |
0 |
0 |
0.063 |
Average: |
459.9 |
-4.5 |
0.594 |
5 |
0 |
0 |
0.063 |
6 |
30 |
|
F |
24 |
7 |
10417 |
◊ |
D |
x,y-1,z |
1_545 |
23 |
8 |
7857 |
229.2 |
-5.8 |
0.118 |
1 |
0 |
0 |
0.023 |
31 |
|
C |
18 |
6 |
8200 |
◊ |
E |
x,y,z-1 |
1_554 |
19 |
9 |
10487 |
192.3 |
-3.0 |
0.331 |
0 |
0 |
0 |
0.023 |
Average: |
210.8 |
-4.4 |
0.225 |
1 |
0 |
0 |
0.023 |
7 |
32 |
|
F |
15 |
4 |
10417 |
◊ |
E |
x,y,z-1 |
1_554 |
17 |
5 |
10487 |
152.9 |
-1.6 |
0.491 |
0 |
0 |
0 |
0.000 |
33 |
|
F |
15 |
4 |
10417 |
◊ |
G |
x,y-1,z |
1_545 |
14 |
4 |
10202 |
127.3 |
-1.3 |
0.513 |
0 |
0 |
0 |
0.000 |
Average: |
140.1 |
-1.5 |
0.502 |
0 |
0 |
0 |
0.000 |
8 |
34 |
|
N |
21 |
6 |
9886 |
◊ |
P |
x,y,z-1 |
1_554 |
13 |
4 |
10136 |
140.3 |
0.4 |
0.757 |
1 |
0 |
0 |
0.000 |
35 |
|
O |
12 |
4 |
9957 |
◊ |
M |
x,y-1,z |
1_545 |
16 |
6 |
9895 |
134.5 |
0.7 |
0.775 |
2 |
0 |
0 |
0.000 |
Average: |
137.4 |
0.5 |
0.766 |
2 |
0 |
0 |
0.000 |
9 |
36 |
|
I |
15 |
5 |
8570 |
◊ |
A |
x,y,z |
1_555 |
15 |
5 |
8439 |
131.1 |
0.4 |
0.822 |
0 |
0 |
0 |
0.000 |
37 |
|
L |
12 |
5 |
9006 |
◊ |
B |
x,y,z |
1_555 |
12 |
4 |
8063 |
99.6 |
0.3 |
0.796 |
1 |
1 |
0 |
0.000 |
38 |
|
K |
9 |
5 |
8555 |
◊ |
C |
x,y,z |
1_555 |
8 |
4 |
8200 |
53.8 |
-0.5 |
0.614 |
0 |
0 |
0 |
0.000 |
39 |
|
J |
6 |
3 |
8460 |
◊ |
D |
x,y,z |
1_555 |
9 |
3 |
7857 |
48.2 |
-0.3 |
0.652 |
0 |
0 |
0 |
0.000 |
Average: |
83.2 |
-0.0 |
0.721 |
0 |
0 |
0 |
0.001 |
10 |
40 |
|
F |
10 |
2 |
10417 |
◊ |
H |
x,y-1,z |
1_545 |
10 |
5 |
10427 |
100.6 |
-2.6 |
0.153 |
0 |
0 |
0 |
0.000 |
41 |
|
G |
9 |
5 |
10202 |
◊ |
E |
x,y,z-1 |
1_554 |
6 |
2 |
10487 |
70.9 |
-1.8 |
0.182 |
0 |
0 |
0 |
0.000 |
Average: |
85.8 |
-2.2 |
0.167 |
0 |
0 |
0 |
0.000 |
11 |
42 |
|
P |
17 |
8 |
10136 |
◊ |
A |
x,y,z |
1_555 |
10 |
4 |
8439 |
99.2 |
-0.3 |
0.664 |
0 |
0 |
0 |
0.002 |
43 |
|
O |
18 |
7 |
9957 |
◊ |
B |
x,y,z |
1_555 |
9 |
4 |
8063 |
93.7 |
-0.9 |
0.571 |
1 |
0 |
0 |
0.002 |
44 |
|
E |
11 |
3 |
10487 |
◊ |
L |
x,y,z |
1_555 |
7 |
3 |
9006 |
49.9 |
0.7 |
0.831 |
1 |
0 |
0 |
0.002 |
45 |
|
H |
9 |
4 |
10427 |
◊ |
I |
x,y,z |
1_555 |
6 |
3 |
8570 |
39.8 |
-0.3 |
0.643 |
0 |
0 |
0 |
0.002 |
Average: |
70.6 |
-0.2 |
0.677 |
1 |
0 |
0 |
0.002 |
12 |
46 |
|
G |
10 |
2 |
10202 |
◊ |
H |
x,y,z-1 |
1_554 |
13 |
5 |
10427 |
98.4 |
-1.4 |
0.383 |
0 |
0 |
0 |
0.000 |
13 |
47 |
|
N |
13 |
5 |
9886 |
◊ |
C |
x,y,z |
1_555 |
11 |
3 |
8200 |
94.2 |
0.0 |
0.724 |
0 |
0 |
0 |
0.000 |
48 |
|
M |
5 |
3 |
9895 |
◊ |
D |
x,y,z |
1_555 |
2 |
2 |
7857 |
24.3 |
-0.1 |
0.422 |
0 |
0 |
0 |
0.000 |
49 |
|
F |
2 |
1 |
10417 |
◊ |
K |
x,y,z |
1_555 |
1 |
1 |
8555 |
19.7 |
0.7 |
0.922 |
0 |
0 |
0 |
0.000 |
Average: |
46.1 |
0.2 |
0.689 |
0 |
0 |
0 |
0.000 |
14 |
50 |
|
E |
12 |
5 |
10487 |
◊ |
H |
x,y-1,z |
1_545 |
11 |
2 |
10427 |
93.2 |
-1.0 |
0.488 |
0 |
0 |
0 |
0.000 |
15 |
51 |
|
N |
6 |
2 |
9886 |
◊ |
H |
x,y,z-1 |
1_554 |
13 |
4 |
10427 |
88.1 |
-1.5 |
0.309 |
0 |
0 |
0 |
0.000 |
16 |
52 |
|
O |
9 |
2 |
9957 |
◊ |
P |
x,y,z-1 |
1_554 |
10 |
3 |
10136 |
84.0 |
-1.0 |
0.435 |
0 |
0 |
0 |
0.000 |
53 |
|
O |
8 |
3 |
9957 |
◊ |
N |
x,y-1,z |
1_545 |
7 |
2 |
9886 |
69.3 |
-0.2 |
0.630 |
0 |
0 |
0 |
0.000 |
Average: |
76.7 |
-0.6 |
0.532 |
0 |
0 |
0 |
0.000 |
17 |
54 |
|
E |
8 |
4 |
10487 |
◊ |
M |
x,y-1,z |
1_545 |
8 |
2 |
9895 |
75.3 |
-1.1 |
0.402 |
0 |
0 |
0 |
0.000 |
18 |
55 |
|
O |
9 |
4 |
9957 |
◊ |
G |
x-1,y-1,z |
1_445 |
8 |
5 |
10202 |
75.2 |
0.2 |
0.743 |
2 |
1 |
0 |
0.000 |
19 |
56 |
|
F |
12 |
4 |
10417 |
◊ |
M |
x,y-1,z |
1_545 |
8 |
4 |
9895 |
73.7 |
1.1 |
0.858 |
1 |
0 |
0 |
0.000 |
57 |
|
N |
7 |
2 |
9886 |
◊ |
E |
x,y,z-1 |
1_554 |
8 |
3 |
10487 |
51.6 |
0.7 |
0.809 |
1 |
0 |
0 |
0.000 |
Average: |
62.7 |
0.9 |
0.834 |
1 |
0 |
0 |
0.000 |
20 |
58 |
|
[NA]F:702 |
1 |
1 |
125 |
f |
F |
x,y,z |
1_555 |
13 |
6 |
10417 |
61.1 |
-8.6 |
0.000 |
0 |
0 |
0 |
0.110 |
59 |
|
[NA]G:704 |
1 |
1 |
125 |
f |
G |
x,y,z |
1_555 |
12 |
6 |
10202 |
60.7 |
-9.0 |
0.000 |
0 |
0 |
0 |
0.110 |
60 |
|
[NA]E:703 |
1 |
1 |
125 |
f |
E |
x,y,z |
1_555 |
12 |
6 |
10487 |
59.7 |
-8.1 |
0.000 |
0 |
0 |
0 |
0.110 |
61 |
|
[NA]H:701 |
1 |
1 |
125 |
f |
H |
x,y,z |
1_555 |
13 |
6 |
10427 |
58.7 |
-8.0 |
0.000 |
0 |
0 |
0 |
0.110 |
Average: |
60.1 |
-8.4 |
0.000 |
0 |
0 |
0 |
0.110 |
21 |
62 |
|
L |
5 |
2 |
9006 |
◊ |
M |
x,y-1,z |
1_545 |
9 |
3 |
9895 |
47.1 |
-0.6 |
0.522 |
0 |
0 |
0 |
0.000 |
22 |
63 |
|
[CA]N:507 |
1 |
1 |
85 |
f |
N |
x,y,z |
1_555 |
8 |
5 |
9886 |
45.7 |
-12.3 |
0.000 |
0 |
0 |
0 |
0.185 |
64 |
|
[CA]M:506 |
1 |
1 |
85 |
f |
M |
x,y,z |
1_555 |
8 |
5 |
9895 |
45.7 |
-12.3 |
0.000 |
0 |
0 |
0 |
0.185 |
65 |
|
[CA]E:503 |
1 |
1 |
85 |
f |
E |
x,y,z |
1_555 |
7 |
5 |
10487 |
44.6 |
-12.1 |
0.000 |
0 |
0 |
0 |
0.185 |
66 |
|
[CA]F:501 |
1 |
1 |
85 |
f |
F |
x,y,z |
1_555 |
6 |
5 |
10417 |
43.7 |
-12.3 |
0.000 |
0 |
0 |
0 |
0.185 |
67 |
|
[CA]P:505 |
1 |
1 |
85 |
f |
P |
x,y,z |
1_555 |
7 |
5 |
10136 |
43.5 |
-12.5 |
0.000 |
0 |
0 |
0 |
0.185 |
68 |
|
[CA]O:508 |
1 |
1 |
85 |
f |
O |
x,y,z |
1_555 |
5 |
4 |
9957 |
43.2 |
-12.5 |
0.000 |
0 |
0 |
0 |
0.185 |
69 |
|
[CA]G:504 |
1 |
1 |
85 |
f |
G |
x,y,z |
1_555 |
5 |
4 |
10202 |
43.2 |
-12.6 |
0.000 |
0 |
0 |
0 |
0.185 |
70 |
|
[CA]H:502 |
1 |
1 |
85 |
f |
H |
x,y,z |
1_555 |
4 |
4 |
10427 |
43.0 |
-12.5 |
0.000 |
0 |
0 |
0 |
0.185 |
Average: |
44.1 |
-12.4 |
0.000 |
0 |
0 |
0 |
0.185 |
23 |
71 |
|
[CA]N:515 |
1 |
1 |
85 |
f |
N |
x,y,z |
1_555 |
8 |
5 |
9886 |
45.4 |
-11.8 |
0.000 |
0 |
0 |
0 |
0.181 |
72 |
|
[CA]M:514 |
1 |
1 |
85 |
f |
M |
x,y,z |
1_555 |
8 |
5 |
9895 |
45.3 |
-11.8 |
0.000 |
0 |
0 |
0 |
0.181 |
73 |
|
[CA]E:511 |
1 |
1 |
85 |
f |
E |
x,y,z |
1_555 |
8 |
5 |
10487 |
45.1 |
-12.0 |
0.000 |
0 |
0 |
0 |
0.181 |
74 |
|
[CA]H:510 |
1 |
1 |
85 |
f |
H |
x,y,z |
1_555 |
8 |
5 |
10427 |
45.0 |
-11.8 |
0.000 |
0 |
0 |
0 |
0.181 |
75 |
|
[CA]G:512 |
1 |
1 |
85 |
f |
G |
x,y,z |
1_555 |
8 |
5 |
10202 |
44.9 |
-11.9 |
0.000 |
0 |
0 |
0 |
0.181 |
76 |
|
[CA]O:516 |
1 |
1 |
85 |
f |
O |
x,y,z |
1_555 |
8 |
5 |
9957 |
43.9 |
-12.3 |
0.000 |
0 |
0 |
0 |
0.181 |
77 |
|
[CA]F:509 |
1 |
1 |
85 |
f |
F |
x,y,z |
1_555 |
8 |
5 |
10417 |
43.9 |
-12.2 |
0.000 |
0 |
0 |
0 |
0.181 |
78 |
|
[CA]P:513 |
1 |
1 |
85 |
f |
P |
x,y,z |
1_555 |
7 |
4 |
10136 |
43.6 |
-12.3 |
0.000 |
0 |
0 |
0 |
0.181 |
Average: |
44.7 |
-12.0 |
0.000 |
0 |
0 |
0 |
0.181 |
24 |
79 |
|
K |
5 |
2 |
8555 |
◊ |
D |
x,y,z |
1_555 |
4 |
1 |
7857 |
40.2 |
-0.5 |
0.533 |
0 |
0 |
0 |
0.002 |
80 |
|
L |
4 |
1 |
9006 |
◊ |
C |
x,y,z |
1_555 |
5 |
2 |
8200 |
34.9 |
-0.5 |
0.538 |
0 |
0 |
0 |
0.002 |
81 |
|
J |
4 |
2 |
8460 |
◊ |
A |
x,y,z |
1_555 |
4 |
1 |
8439 |
22.6 |
-0.3 |
0.559 |
0 |
0 |
0 |
0.002 |
82 |
|
I |
3 |
1 |
8570 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
8063 |
13.2 |
-0.2 |
0.569 |
0 |
0 |
0 |
0.002 |
Average: |
27.7 |
-0.4 |
0.550 |
0 |
0 |
0 |
0.002 |
25 |
83 |
|
[ZN]A:601 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
5 |
3 |
8439 |
37.2 |
-27.1 |
0.000 |
0 |
0 |
0 |
0.542 |
84 |
|
[ZN]I:605 |
1 |
1 |
98 |
f |
I |
x,y,z |
1_555 |
5 |
3 |
8570 |
37.1 |
-26.6 |
0.000 |
0 |
0 |
0 |
0.542 |
85 |
|
[ZN]K:607 |
1 |
1 |
98 |
f |
K |
x,y,z |
1_555 |
6 |
3 |
8555 |
37.0 |
-25.4 |
0.000 |
0 |
0 |
0 |
0.542 |
86 |
|
[ZN]L:608 |
1 |
1 |
98 |
f |
L |
x,y,z |
1_555 |
5 |
3 |
9006 |
36.7 |
-25.5 |
0.000 |
0 |
0 |
0 |
0.542 |
87 |
|
[ZN]J:606 |
1 |
1 |
98 |
cf |
J |
x,y,z |
1_555 |
5 |
3 |
8460 |
36.7 |
-26.5 |
0.000 |
0 |
0 |
0 |
0.542 |
88 |
|
[ZN]C:603 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
5 |
3 |
8200 |
36.6 |
-26.8 |
0.000 |
0 |
0 |
0 |
0.542 |
89 |
|
[ZN]B:602 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
5 |
3 |
8063 |
36.6 |
-26.1 |
0.000 |
0 |
0 |
0 |
0.542 |
90 |
|
[ZN]D:604 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
5 |
3 |
7857 |
36.1 |
-26.0 |
0.000 |
0 |
0 |
0 |
0.542 |
Average: |
36.8 |
-26.2 |
0.000 |
0 |
0 |
0 |
0.542 |
26 |
91 |
|
F |
6 |
2 |
10417 |
◊ |
J |
x,y-1,z |
1_545 |
3 |
1 |
8460 |
36.3 |
-1.1 |
0.284 |
0 |
0 |
0 |
0.000 |
27 |
92 |
|
[ZN]L:608 |
1 |
1 |
98 |
◊ |
I |
x,y,z |
1_555 |
4 |
3 |
8570 |
28.7 |
-14.6 |
0.000 |
0 |
0 |
0 |
0.287 |
93 |
|
[ZN]K:607 |
1 |
1 |
98 |
◊ |
L |
x,y,z |
1_555 |
4 |
3 |
9006 |
28.5 |
-14.7 |
0.000 |
0 |
0 |
0 |
0.287 |
94 |
|
[ZN]D:604 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
4 |
3 |
8439 |
28.1 |
-14.1 |
0.000 |
0 |
0 |
0 |
0.287 |
95 |
|
[ZN]B:602 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
4 |
3 |
8200 |
28.0 |
-13.9 |
0.000 |
0 |
0 |
0 |
0.287 |
96 |
|
[ZN]I:605 |
1 |
1 |
98 |
◊ |
J |
x,y,z |
1_555 |
5 |
3 |
8460 |
27.3 |
-13.5 |
0.000 |
0 |
0 |
0 |
0.287 |
97 |
|
[ZN]J:606 |
1 |
1 |
98 |
◊ |
K |
x,y,z |
1_555 |
4 |
3 |
8555 |
27.1 |
-13.6 |
0.000 |
0 |
0 |
0 |
0.287 |
98 |
|
[ZN]C:603 |
1 |
1 |
98 |
◊ |
D |
x,y,z |
1_555 |
4 |
3 |
7857 |
26.8 |
-13.2 |
0.000 |
0 |
0 |
0 |
0.287 |
99 |
|
[ZN]A:601 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
4 |
3 |
8063 |
26.3 |
-13.0 |
0.000 |
0 |
0 |
0 |
0.287 |
Average: |
27.6 |
-13.8 |
0.000 |
0 |
0 |
0 |
0.287 |
28 |
100 |
|
[NA]H:701 |
1 |
1 |
125 |
◊ |
I |
x,y,z |
1_555 |
2 |
2 |
8570 |
24.3 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.004 |
101 |
|
[NA]E:703 |
1 |
1 |
125 |
◊ |
L |
x,y,z |
1_555 |
1 |
1 |
9006 |
14.8 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.004 |
Average: |
19.6 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.004 |
29 |
102 |
|
J |
2 |
1 |
8460 |
◊ |
G |
x-1,y,z |
1_455 |
3 |
1 |
10202 |
18.4 |
0.5 |
0.689 |
0 |
0 |
0 |
0.000 |
103 |
|
M |
2 |
1 |
9895 |
◊ |
D |
x-1,y,z |
1_455 |
2 |
1 |
7857 |
9.3 |
0.3 |
0.777 |
0 |
0 |
0 |
0.000 |
Average: |
13.9 |
0.4 |
0.733 |
0 |
0 |
0 |
0.000 |
30 |
104 |
|
[NA]G:704 |
1 |
1 |
125 |
◊ |
N |
x,y,z |
1_555 |
2 |
1 |
9886 |
14.3 |
-1.2 |
0.000 |
0 |
0 |
0 |
0.009 |
105 |
|
[NA]H:701 |
1 |
1 |
125 |
◊ |
M |
x,y,z |
1_555 |
3 |
2 |
9895 |
14.2 |
-1.3 |
0.000 |
0 |
0 |
0 |
0.009 |
106 |
|
[NA]E:703 |
1 |
1 |
125 |
◊ |
P |
x,y,z |
1_555 |
3 |
1 |
10136 |
13.6 |
-1.6 |
0.000 |
0 |
0 |
0 |
0.009 |
107 |
|
[NA]F:702 |
1 |
1 |
125 |
◊ |
O |
x,y,z |
1_555 |
2 |
1 |
9957 |
4.9 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.009 |
Average: |
11.7 |
-1.2 |
0.000 |
0 |
0 |
0 |
0.009 |
31 |
108 |
|
G |
2 |
1 |
10202 |
◊ |
K |
x,y,z |
1_555 |
3 |
1 |
8555 |
7.9 |
0.3 |
0.790 |
0 |
0 |
0 |
0.000 |
109 |
|
H |
2 |
1 |
10427 |
◊ |
J |
x,y,z |
1_555 |
3 |
1 |
8460 |
5.6 |
0.2 |
0.747 |
0 |
0 |
0 |
0.000 |
110 |
|
O |
2 |
1 |
9957 |
◊ |
C |
x,y,z |
1_555 |
3 |
1 |
8200 |
3.3 |
0.1 |
0.721 |
0 |
0 |
0 |
0.000 |
Average: |
5.6 |
0.2 |
0.753 |
0 |
0 |
0 |
0.000 |
32 |
111 |
|
C |
1 |
1 |
8200 |
◊ |
A |
x,y,z-1 |
1_554 |
1 |
1 |
8439 |
3.6 |
-0.1 |
0.423 |
0 |
0 |
0 |
0.000 |
33 |
112 |
|
C |
2 |
1 |
8200 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
8439 |
3.0 |
-0.1 |
0.601 |
0 |
0 |
0 |
0.000 |
113 |
|
K |
2 |
1 |
8555 |
◊ |
I |
x,y,z |
1_555 |
1 |
1 |
8570 |
1.7 |
-0.0 |
0.568 |
0 |
0 |
0 |
0.000 |
114 |
|
L |
2 |
1 |
9006 |
◊ |
J |
x,y,z |
1_555 |
1 |
1 |
8460 |
0.9 |
-0.0 |
0.614 |
0 |
0 |
0 |
0.000 |
115 |
|
D |
2 |
1 |
7857 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
8063 |
0.8 |
-0.0 |
0.605 |
0 |
0 |
0 |
0.000 |
Average: |
1.6 |
-0.0 |
0.597 |
0 |
0 |
0 |
0.000 |
34 |
116 |
|
I |
1 |
1 |
8570 |
◊ |
C |
x-1,y,z |
1_455 |
1 |
1 |
8200 |
0.4 |
0.0 |
0.697 |
0 |
0 |
0 |
0.000 |
|