## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
|
B |
68 |
9 |
4796 |
◊ |
A |
x,y,z |
1_555 |
66 |
26 |
8033 |
568.8 |
-11.1 |
0.716 |
12 |
0 |
0 |
0.417 |
2 |
|
A |
35 |
12 |
8033 |
x |
A |
x-1/2,-y+1/2,-z |
4_455 |
41 |
12 |
8033 |
294.8 |
-2.8 |
0.378 |
3 |
0 |
0 |
0.000 |
3 |
|
B |
25 |
6 |
4796 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
24 |
8 |
8033 |
199.5 |
-4.2 |
0.632 |
3 |
0 |
0 |
0.000 |
4 |
|
[AS]C:9 |
16 |
1 |
503 |
f |
A |
x,y,z |
1_555 |
24 |
10 |
8033 |
162.0 |
-2.7 |
0.273 |
4 |
0 |
0 |
0.113 |
5 |
|
[SC]C:10 |
15 |
1 |
466 |
f |
A |
x,y,z |
1_555 |
31 |
11 |
8033 |
160.6 |
-4.5 |
0.226 |
2 |
0 |
0 |
0.138 |
6 |
|
[SC]C:12 |
14 |
1 |
469 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
23 |
9 |
8033 |
144.1 |
-1.2 |
0.440 |
3 |
0 |
0 |
0.000 |
7 |
|
A |
20 |
6 |
8033 |
◊ |
[T39]C:3 |
x,y-1,z |
1_545 |
14 |
1 |
530 |
142.1 |
-0.7 |
0.558 |
0 |
0 |
0 |
0.000 |
8 |
|
[T39]C:3 |
16 |
1 |
530 |
cf |
[N7X]C:2 |
x,y,z |
1_555 |
19 |
1 |
558 |
132.8 |
2.7 |
0.667 |
1 |
0 |
0 |
0.000 |
9 |
|
[SC]C:6 |
15 |
1 |
467 |
cf |
[A2M]C:5 |
x,y,z |
1_555 |
17 |
1 |
499 |
129.9 |
2.6 |
0.589 |
0 |
0 |
0 |
0.000 |
10 |
|
[C5L]C:4 |
15 |
1 |
544 |
cf |
[T39]C:3 |
x,y,z |
1_555 |
19 |
1 |
530 |
128.2 |
2.2 |
0.699 |
0 |
0 |
0 |
0.000 |
11 |
|
[SC]C:8 |
12 |
1 |
464 |
f |
A |
x,y,z |
1_555 |
19 |
7 |
8033 |
127.2 |
0.6 |
0.559 |
2 |
0 |
0 |
0.008 |
12 |
|
[AS]C:13 |
9 |
1 |
484 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
20 |
10 |
8033 |
125.4 |
-2.9 |
0.261 |
0 |
0 |
0 |
0.000 |
13 |
|
A |
22 |
7 |
8033 |
◊ |
[6OO]C:19 |
x-1/2,-y+1/2,-z |
4_455 |
11 |
1 |
484 |
124.7 |
-3.0 |
0.304 |
0 |
0 |
0 |
0.000 |
14 |
|
[RFJ]C:17 |
16 |
1 |
537 |
cf |
[6OO]C:18 |
x,y,z |
1_555 |
16 |
1 |
482 |
123.7 |
2.2 |
0.747 |
0 |
0 |
0 |
0.000 |
15 |
|
[A2M]C:5 |
15 |
1 |
499 |
cf |
[C5L]C:4 |
x,y,z |
1_555 |
18 |
1 |
544 |
123.0 |
2.2 |
0.632 |
0 |
0 |
0 |
0.000 |
16 |
|
[N7X]C:2 |
15 |
1 |
558 |
cf |
[OMC]C:1 |
x,y,z |
1_555 |
14 |
1 |
405 |
118.7 |
2.3 |
0.400 |
0 |
0 |
0 |
0.000 |
17 |
|
[RFJ]C:17 |
13 |
1 |
537 |
◊ |
B |
x,y,z |
1_555 |
15 |
3 |
4796 |
116.1 |
1.8 |
0.818 |
3 |
0 |
0 |
0.000 |
18 |
|
[AS]C:13 |
16 |
1 |
484 |
cf |
[SC]C:14 |
x,y,z |
1_555 |
15 |
1 |
455 |
113.8 |
2.6 |
0.560 |
0 |
0 |
0 |
0.000 |
19 |
|
[RFJ]C:17 |
16 |
1 |
537 |
cf |
[6OO]C:16 |
x,y,z |
1_555 |
16 |
1 |
479 |
113.7 |
1.4 |
0.705 |
0 |
0 |
0 |
0.000 |
20 |
|
[RFJ]C:17 |
8 |
1 |
537 |
◊ |
A |
-x+1/2,-y+1,z-1/2 |
2_564 |
16 |
5 |
8033 |
113.7 |
-4.1 |
0.222 |
0 |
0 |
0 |
0.000 |
21 |
|
[6OO]C:16 |
14 |
1 |
479 |
cf |
[PST]C:15 |
x,y,z |
1_555 |
16 |
1 |
456 |
113.3 |
1.8 |
0.745 |
0 |
0 |
0 |
0.000 |
22 |
|
A |
13 |
7 |
8033 |
◊ |
[6NW]C:20 |
x-1/2,-y+1/2,-z |
4_455 |
9 |
1 |
520 |
112.0 |
-2.2 |
0.326 |
1 |
0 |
0 |
0.000 |
23 |
|
[SC]C:11 |
10 |
1 |
446 |
f |
A |
x,y,z |
1_555 |
24 |
6 |
8033 |
111.8 |
-1.9 |
0.364 |
3 |
0 |
0 |
0.082 |
24 |
|
[6NW]C:20 |
15 |
1 |
520 |
cf |
[6OO]C:19 |
x,y,z |
1_555 |
17 |
1 |
484 |
111.0 |
1.0 |
0.657 |
0 |
0 |
0 |
0.000 |
25 |
|
A |
12 |
4 |
8033 |
◊ |
B |
x,y-1,z |
1_545 |
12 |
2 |
4796 |
109.9 |
1.2 |
0.816 |
1 |
0 |
0 |
0.000 |
26 |
|
[PST]C:7 |
15 |
1 |
455 |
cf |
[SC]C:6 |
x,y,z |
1_555 |
11 |
1 |
467 |
107.6 |
1.4 |
0.615 |
0 |
0 |
0 |
0.000 |
27 |
|
[PST]C:15 |
14 |
1 |
456 |
cf |
[SC]C:14 |
x,y,z |
1_555 |
11 |
1 |
455 |
107.1 |
1.5 |
0.655 |
0 |
0 |
0 |
0.000 |
28 |
|
[6OO]C:19 |
14 |
1 |
484 |
cf |
[6OO]C:18 |
x,y,z |
1_555 |
17 |
1 |
482 |
106.1 |
1.2 |
0.758 |
0 |
0 |
0 |
0.000 |
29 |
|
[AS]C:9 |
16 |
1 |
503 |
cf |
[SC]C:8 |
x,y,z |
1_555 |
13 |
1 |
464 |
105.6 |
2.2 |
0.541 |
0 |
0 |
0 |
0.000 |
30 |
|
[PST]C:7 |
12 |
1 |
455 |
cf |
[SC]C:8 |
x,y,z |
1_555 |
11 |
1 |
464 |
105.0 |
2.2 |
0.670 |
0 |
0 |
0 |
0.000 |
31 |
|
[AS]C:9 |
17 |
1 |
503 |
cf |
[SC]C:10 |
x,y,z |
1_555 |
14 |
1 |
466 |
103.3 |
2.2 |
0.560 |
0 |
0 |
0 |
0.000 |
32 |
|
A |
15 |
5 |
8033 |
◊ |
[N7X]C:2 |
x,y-1,z |
1_545 |
9 |
1 |
558 |
103.2 |
1.3 |
0.660 |
1 |
0 |
0 |
0.000 |
33 |
|
[6NW]C:20 |
13 |
1 |
520 |
◊ |
[OMC]C:1 |
-x+1/2,-y+1,z-1/2 |
2_564 |
12 |
1 |
405 |
101.3 |
2.5 |
0.497 |
0 |
0 |
0 |
0.000 |
34 |
|
[A2M]C:5 |
12 |
1 |
499 |
◊ |
B |
x,y,z |
1_555 |
15 |
3 |
4796 |
95.5 |
1.7 |
0.780 |
1 |
0 |
0 |
0.000 |
35 |
|
[AS]C:13 |
11 |
1 |
484 |
◊ |
B |
x,y,z |
1_555 |
15 |
3 |
4796 |
92.6 |
1.5 |
0.724 |
1 |
0 |
0 |
0.000 |
36 |
|
[SC]C:12 |
14 |
1 |
469 |
cf |
[SC]C:11 |
x,y,z |
1_555 |
14 |
1 |
446 |
91.5 |
1.2 |
0.552 |
0 |
0 |
0 |
0.000 |
37 |
|
[AS]C:13 |
14 |
1 |
484 |
cf |
[SC]C:12 |
x,y,z |
1_555 |
11 |
1 |
469 |
89.1 |
1.9 |
0.535 |
0 |
0 |
0 |
0.000 |
38 |
|
[6OO]C:18 |
6 |
1 |
482 |
◊ |
A |
-x+1/2,-y+1,z-1/2 |
2_564 |
13 |
4 |
8033 |
89.0 |
-4.3 |
0.192 |
1 |
0 |
0 |
0.000 |
39 |
|
[6NW]C:20 |
11 |
1 |
520 |
◊ |
B |
x,y,z |
1_555 |
13 |
2 |
4796 |
88.8 |
1.7 |
0.783 |
2 |
0 |
0 |
0.000 |
40 |
|
B |
13 |
1 |
4796 |
x |
B |
-x+1/2,-y+1,z-1/2 |
2_564 |
12 |
1 |
4796 |
87.1 |
0.9 |
0.858 |
0 |
0 |
0 |
0.000 |
41 |
|
[6OO]C:16 |
8 |
1 |
479 |
◊ |
A |
-x+1/2,-y+1,z-1/2 |
2_564 |
8 |
3 |
8033 |
86.9 |
-1.5 |
0.505 |
3 |
0 |
0 |
0.000 |
42 |
|
[SC]C:14 |
7 |
1 |
455 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
17 |
6 |
8033 |
86.3 |
-3.7 |
0.249 |
0 |
0 |
0 |
0.000 |
43 |
|
A |
9 |
2 |
8033 |
x |
A |
-x,y-1/2,-z+1/2 |
3_545 |
15 |
6 |
8033 |
85.5 |
-0.6 |
0.492 |
1 |
0 |
0 |
0.000 |
44 |
|
[GOL]A:303 |
6 |
1 |
214 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
8033 |
85.4 |
0.1 |
0.596 |
2 |
0 |
0 |
0.019 |
45 |
|
[N7X]C:2 |
10 |
1 |
558 |
◊ |
B |
x,y,z |
1_555 |
10 |
3 |
4796 |
84.8 |
1.3 |
0.720 |
3 |
0 |
0 |
0.002 |
46 |
|
[T39]C:3 |
11 |
1 |
530 |
◊ |
B |
x,y,z |
1_555 |
11 |
3 |
4796 |
83.1 |
1.2 |
0.762 |
1 |
0 |
0 |
0.000 |
47 |
|
[6OO]C:19 |
11 |
1 |
484 |
◊ |
B |
x,y,z |
1_555 |
12 |
3 |
4796 |
82.4 |
0.9 |
0.795 |
3 |
0 |
0 |
0.011 |
48 |
|
[SO4]A:301 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
12 |
4 |
8033 |
81.4 |
-10.5 |
0.785 |
2 |
0 |
0 |
0.290 |
49 |
|
[PST]C:15 |
11 |
1 |
456 |
◊ |
B |
x,y,z |
1_555 |
10 |
3 |
4796 |
80.7 |
1.4 |
0.788 |
1 |
0 |
0 |
0.000 |
50 |
|
[AS]C:9 |
7 |
1 |
503 |
◊ |
B |
x,y,z |
1_555 |
13 |
3 |
4796 |
79.3 |
0.7 |
0.714 |
3 |
0 |
0 |
0.015 |
51 |
|
[PST]C:7 |
10 |
1 |
455 |
◊ |
B |
x,y,z |
1_555 |
11 |
2 |
4796 |
77.7 |
1.4 |
0.770 |
1 |
0 |
0 |
0.000 |
52 |
|
[SC]C:11 |
11 |
1 |
446 |
cf |
[SC]C:10 |
x,y,z |
1_555 |
11 |
1 |
466 |
77.6 |
1.8 |
0.618 |
0 |
0 |
0 |
0.000 |
53 |
|
[C5L]C:4 |
7 |
1 |
544 |
◊ |
B |
x,y,z |
1_555 |
9 |
3 |
4796 |
77.4 |
0.8 |
0.731 |
3 |
0 |
0 |
0.015 |
54 |
|
[SC]C:11 |
10 |
1 |
446 |
◊ |
B |
x,y,z |
1_555 |
12 |
3 |
4796 |
77.2 |
1.0 |
0.715 |
3 |
0 |
0 |
0.009 |
55 |
|
[SC]C:8 |
9 |
1 |
464 |
◊ |
B |
x,y,z |
1_555 |
10 |
3 |
4796 |
73.7 |
1.2 |
0.700 |
3 |
0 |
0 |
0.003 |
56 |
|
[SC]C:6 |
6 |
1 |
467 |
◊ |
B |
x,y,z |
1_555 |
10 |
3 |
4796 |
73.5 |
-0.1 |
0.611 |
5 |
0 |
0 |
0.059 |
57 |
|
[SC]C:12 |
9 |
1 |
469 |
◊ |
B |
x,y,z |
1_555 |
11 |
3 |
4796 |
72.1 |
0.7 |
0.708 |
3 |
0 |
0 |
0.015 |
58 |
|
[6OO]C:16 |
8 |
1 |
479 |
◊ |
B |
x,y,z |
1_555 |
9 |
2 |
4796 |
71.6 |
0.7 |
0.759 |
2 |
0 |
0 |
0.004 |
59 |
|
B |
10 |
1 |
4796 |
◊ |
[OMC]C:1 |
-x+1/2,-y+1,z-1/2 |
2_564 |
9 |
1 |
405 |
67.8 |
1.6 |
0.646 |
0 |
0 |
0 |
0.000 |
60 |
|
A |
12 |
4 |
8033 |
◊ |
B |
-x+1,y-1/2,-z+1/2 |
3_645 |
9 |
3 |
4796 |
67.4 |
-2.9 |
0.436 |
0 |
0 |
0 |
0.000 |
61 |
|
[SC]C:14 |
6 |
1 |
455 |
◊ |
B |
x,y,z |
1_555 |
9 |
3 |
4796 |
67.4 |
-0.3 |
0.604 |
3 |
0 |
0 |
0.043 |
62 |
|
[6OO]C:18 |
6 |
1 |
482 |
◊ |
B |
x,y,z |
1_555 |
8 |
3 |
4796 |
66.9 |
-0.5 |
0.642 |
2 |
0 |
0 |
0.035 |
63 |
|
A |
10 |
3 |
8033 |
◊ |
[6OO]C:18 |
x-1/2,-y+1/2,-z |
4_455 |
5 |
1 |
482 |
66.6 |
-1.6 |
0.400 |
0 |
0 |
0 |
0.000 |
64 |
|
[PST]C:7 |
7 |
1 |
455 |
f |
A |
x,y,z |
1_555 |
6 |
3 |
8033 |
65.1 |
0.6 |
0.646 |
1 |
0 |
0 |
0.000 |
65 |
|
A |
7 |
4 |
8033 |
◊ |
[C5L]C:4 |
x,y-1,z |
1_545 |
4 |
1 |
544 |
61.6 |
-0.3 |
0.485 |
0 |
0 |
0 |
0.000 |
66 |
|
[OMC]C:1 |
5 |
1 |
405 |
◊ |
B |
x,y,z |
1_555 |
5 |
2 |
4796 |
57.5 |
-0.3 |
0.478 |
3 |
0 |
0 |
0.041 |
67 |
|
A |
5 |
2 |
8033 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
9 |
3 |
4796 |
57.0 |
-0.8 |
0.671 |
1 |
0 |
0 |
0.000 |
68 |
|
[SC]C:10 |
6 |
1 |
466 |
◊ |
B |
x,y,z |
1_555 |
10 |
3 |
4796 |
56.6 |
-0.4 |
0.615 |
3 |
0 |
0 |
0.044 |
69 |
|
[SC]C:11 |
5 |
1 |
446 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
9 |
3 |
8033 |
50.3 |
0.3 |
0.568 |
0 |
0 |
0 |
0.000 |
70 |
|
[PST]C:15 |
3 |
1 |
456 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
5 |
3 |
8033 |
47.2 |
-1.9 |
0.314 |
0 |
0 |
0 |
0.000 |
71 |
|
[PEG]C:201 |
4 |
1 |
247 |
◊ |
[SC]C:10 |
x,y,z |
1_555 |
5 |
1 |
466 |
45.8 |
1.9 |
0.347 |
1 |
0 |
0 |
0.000 |
72 |
|
[6OO]C:19 |
3 |
1 |
484 |
◊ |
A |
-x+1/2,-y+1,z-1/2 |
2_564 |
7 |
3 |
8033 |
45.6 |
-2.1 |
0.260 |
1 |
0 |
0 |
0.000 |
73 |
|
[PEG]C:201 |
6 |
1 |
247 |
◊ |
[SC]C:11 |
x,y,z |
1_555 |
5 |
1 |
446 |
42.1 |
0.9 |
0.175 |
1 |
0 |
0 |
0.000 |
74 |
|
[SC]C:12 |
6 |
1 |
469 |
f |
A |
x,y,z |
1_555 |
5 |
2 |
8033 |
38.7 |
-0.1 |
0.418 |
0 |
0 |
0 |
0.002 |
75 |
|
[A2M]C:5 |
4 |
1 |
499 |
f |
[SO4]A:302 |
x,y,z |
1_555 |
4 |
1 |
185 |
37.1 |
-4.7 |
0.583 |
0 |
0 |
0 |
0.120 |
76 |
|
[A2M]C:5 |
4 |
1 |
499 |
f |
[SO4]C:202 |
x,y,z |
1_555 |
4 |
1 |
185 |
36.2 |
-3.3 |
0.772 |
1 |
0 |
0 |
0.095 |
77 |
|
[SC]C:6 |
2 |
1 |
467 |
f |
[SO4]C:202 |
x,y,z |
1_555 |
4 |
1 |
185 |
36.1 |
-3.9 |
0.700 |
1 |
0 |
0 |
0.110 |
78 |
|
[SO4]A:302 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
2 |
1 |
8033 |
35.9 |
-2.9 |
0.972 |
1 |
0 |
0 |
0.085 |
79 |
|
[PEG]C:201 |
5 |
1 |
247 |
◊ |
[SC]C:12 |
x,y,z |
1_555 |
2 |
1 |
469 |
32.9 |
0.1 |
0.137 |
1 |
0 |
0 |
0.009 |
80 |
|
[PEG]C:201 |
4 |
1 |
247 |
f |
B |
x,y,z |
1_555 |
6 |
4 |
4796 |
32.3 |
-0.8 |
0.253 |
0 |
0 |
0 |
0.100 |
81 |
|
[PEG]C:201 |
3 |
1 |
247 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
8033 |
30.0 |
-0.2 |
0.201 |
0 |
0 |
0 |
0.005 |
82 |
|
[C5L]C:4 |
4 |
1 |
544 |
f |
[SO4]C:202 |
x,y,z |
1_555 |
2 |
1 |
185 |
25.4 |
-2.9 |
0.782 |
0 |
0 |
0 |
0.075 |
83 |
|
A |
1 |
1 |
8033 |
◊ |
[SC]C:8 |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
464 |
24.8 |
0.1 |
0.339 |
1 |
0 |
0 |
0.000 |
84 |
|
[PEG]C:201 |
3 |
1 |
247 |
◊ |
[AS]C:9 |
x,y,z |
1_555 |
6 |
1 |
503 |
24.7 |
0.9 |
0.287 |
0 |
0 |
0 |
0.000 |
85 |
|
[SO4]A:302 |
3 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
4 |
1 |
4796 |
22.8 |
-3.3 |
0.753 |
0 |
0 |
0 |
0.084 |
86 |
|
[SO4]C:202 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
2 |
2 |
4796 |
19.4 |
-3.3 |
0.543 |
0 |
0 |
0 |
0.083 |
87 |
|
[AS]C:13 |
2 |
1 |
484 |
f |
A |
x,y,z |
1_555 |
3 |
1 |
8033 |
17.9 |
-1.0 |
0.314 |
0 |
0 |
0 |
0.024 |
88 |
|
[6NW]C:20 |
1 |
1 |
520 |
◊ |
A |
-x+1/2,-y+1,z-1/2 |
2_564 |
4 |
1 |
8033 |
17.6 |
-1.3 |
0.233 |
0 |
0 |
0 |
0.000 |
89 |
|
[SC]C:6 |
3 |
1 |
467 |
f |
A |
x,y,z |
1_555 |
2 |
2 |
8033 |
16.3 |
0.5 |
0.600 |
0 |
0 |
0 |
0.000 |
90 |
|
[SO4]A:301 |
2 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
4796 |
15.1 |
-2.1 |
0.702 |
0 |
0 |
0 |
0.053 |
91 |
|
[A2M]C:5 |
3 |
1 |
499 |
f |
A |
x,y,z |
1_555 |
2 |
1 |
8033 |
14.5 |
0.5 |
0.645 |
0 |
0 |
0 |
0.000 |
92 |
|
[OMC]C:1 |
2 |
1 |
405 |
f |
A |
x,y,z |
1_555 |
2 |
1 |
8033 |
13.8 |
0.7 |
0.672 |
0 |
0 |
0 |
0.000 |
93 |
|
[PEG]C:201 |
2 |
1 |
247 |
◊ |
[AS]C:13 |
x,y,z |
1_555 |
2 |
1 |
484 |
12.6 |
0.5 |
0.297 |
0 |
0 |
0 |
0.000 |
94 |
|
[SO4]A:302 |
3 |
1 |
185 |
f |
[SO4]A:301 |
x,y,z |
1_555 |
1 |
1 |
185 |
9.7 |
-2.2 |
0.891 |
0 |
0 |
0 |
0.056 |
95 |
|
B |
2 |
2 |
4796 |
◊ |
[GOL]A:303 |
x-1/2,-y+1/2,-z |
4_455 |
2 |
1 |
214 |
7.8 |
-0.5 |
0.474 |
0 |
0 |
0 |
0.000 |
96 |
|
A |
2 |
2 |
8033 |
◊ |
[GOL]A:303 |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
214 |
6.9 |
0.1 |
0.585 |
0 |
0 |
0 |
0.000 |
97 |
|
[PST]C:7 |
2 |
1 |
455 |
f |
[SO4]C:202 |
x,y,z |
1_555 |
1 |
1 |
185 |
6.0 |
-0.8 |
0.599 |
0 |
0 |
0 |
0.021 |
98 |
|
[SC]C:14 |
1 |
1 |
455 |
f |
A |
x,y,z |
1_555 |
1 |
1 |
8033 |
3.2 |
-0.1 |
0.395 |
0 |
0 |
0 |
0.001 |
99 |
|
A |
2 |
2 |
8033 |
x |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
2 |
1 |
8033 |
3.0 |
0.0 |
0.617 |
0 |
0 |
0 |
0.000 |
100 |
|
A |
1 |
1 |
8033 |
◊ |
[PST]C:7 |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
455 |
1.2 |
0.0 |
0.518 |
0 |
0 |
0 |
0.000 |
101 |
|
[PST]C:15 |
1 |
1 |
456 |
◊ |
A |
-x+1/2,-y+1,z-1/2 |
2_564 |
1 |
1 |
8033 |
0.4 |
-0.0 |
0.509 |
0 |
0 |
0 |
0.000 |
102 |
|
[6NW]C:20 |
1 |
1 |
520 |
◊ |
[N7X]C:2 |
-x+1/2,-y+1,z-1/2 |
2_564 |
1 |
1 |
558 |
0.2 |
0.0 |
0.417 |
0 |
0 |
0 |
0.000 |
|