## |
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 |
|
D |
116 |
30 |
8838 |
◊ |
C |
x,y,z |
1_555 |
116 |
31 |
8760 |
1178.9 |
-13.4 |
0.246 |
15 |
9 |
0 |
0.452 |
2 |
|
E |
116 |
32 |
8781 |
◊ |
A |
x,y,z |
1_555 |
110 |
28 |
8790 |
1110.3 |
-13.1 |
0.183 |
14 |
7 |
0 |
0.452 |
3 |
|
F |
111 |
30 |
8767 |
◊ |
B |
x,y,z |
1_555 |
110 |
29 |
8843 |
1101.8 |
-14.6 |
0.178 |
14 |
8 |
0 |
0.452 |
Average: |
1130.3 |
-13.7 |
0.202 |
14 |
8 |
0 |
0.452 |
2 |
4 |
|
E |
64 |
16 |
8781 |
◊ |
D |
x,y,z |
1_555 |
65 |
20 |
8838 |
624.2 |
-10.4 |
0.118 |
2 |
0 |
0 |
0.492 |
5 |
|
E |
64 |
20 |
8781 |
◊ |
B |
x,y,z |
1_555 |
62 |
18 |
8843 |
614.4 |
-8.0 |
0.218 |
6 |
1 |
0 |
0.492 |
6 |
|
F |
63 |
20 |
8767 |
◊ |
A |
x,y,z |
1_555 |
59 |
16 |
8790 |
589.1 |
-7.6 |
0.205 |
5 |
1 |
0 |
0.492 |
7 |
|
F |
60 |
16 |
8767 |
◊ |
C |
x,y,z |
1_555 |
55 |
17 |
8760 |
572.3 |
-11.2 |
0.074 |
3 |
0 |
0 |
0.492 |
8 |
|
D |
61 |
17 |
8838 |
◊ |
B |
x,y,z |
1_555 |
61 |
19 |
8843 |
570.8 |
-11.1 |
0.084 |
3 |
0 |
0 |
0.492 |
9 |
|
C |
56 |
16 |
8760 |
◊ |
A |
x,y,z |
1_555 |
64 |
19 |
8790 |
564.9 |
-9.9 |
0.099 |
4 |
0 |
0 |
0.492 |
Average: |
589.3 |
-9.7 |
0.133 |
4 |
0 |
0 |
0.492 |
3 |
10 |
|
[COA]B:201 |
46 |
1 |
897 |
f |
B |
x,y,z |
1_555 |
66 |
27 |
8843 |
538.6 |
-3.5 |
0.389 |
13 |
0 |
0 |
0.172 |
11 |
|
[COA]A:201 |
43 |
1 |
895 |
f |
A |
x,y,z |
1_555 |
61 |
29 |
8790 |
530.4 |
-0.9 |
0.386 |
14 |
0 |
0 |
0.172 |
Average: |
534.5 |
-2.2 |
0.388 |
14 |
0 |
0 |
0.172 |
4 |
12 |
|
[COA]E:202 |
44 |
1 |
957 |
f |
E |
x,y,z |
1_555 |
65 |
25 |
8781 |
532.8 |
-0.3 |
0.606 |
20 |
0 |
0 |
0.178 |
13 |
|
[COA]F:201 |
45 |
1 |
964 |
f |
F |
x,y,z |
1_555 |
69 |
26 |
8767 |
516.5 |
-0.7 |
0.596 |
17 |
0 |
0 |
0.178 |
Average: |
524.6 |
-0.5 |
0.601 |
19 |
0 |
0 |
0.178 |
5 |
14 |
|
[COA]D:201 |
42 |
1 |
877 |
f |
D |
x,y,z |
1_555 |
61 |
27 |
8838 |
532.0 |
-2.5 |
0.416 |
13 |
0 |
0 |
0.175 |
6 |
15 |
|
[COA]C:201 |
42 |
1 |
905 |
f |
C |
x,y,z |
1_555 |
58 |
27 |
8760 |
471.9 |
-2.3 |
0.391 |
14 |
0 |
0 |
0.180 |
7 |
16 |
|
A |
37 |
12 |
8790 |
◊ |
F |
-x+2,y-1/2,-z |
2_745 |
32 |
15 |
8767 |
315.9 |
1.3 |
0.830 |
5 |
1 |
0 |
0.000 |
17 |
|
E |
33 |
15 |
8781 |
◊ |
B |
-x+3,y-1/2,-z+1 |
2_846 |
36 |
12 |
8843 |
299.0 |
0.5 |
0.762 |
4 |
0 |
0 |
0.000 |
Average: |
307.5 |
0.9 |
0.796 |
5 |
1 |
0 |
0.000 |
8 |
18 |
|
A |
27 |
10 |
8790 |
◊ |
D |
-x+3,y-1/2,-z |
2_845 |
22 |
7 |
8838 |
236.8 |
-0.5 |
0.600 |
3 |
6 |
0 |
0.000 |
19 |
|
C |
19 |
6 |
8760 |
◊ |
B |
-x+3,y-1/2,-z |
2_845 |
28 |
9 |
8843 |
229.0 |
-0.1 |
0.709 |
3 |
5 |
0 |
0.000 |
Average: |
232.9 |
-0.3 |
0.655 |
3 |
6 |
0 |
0.000 |
9 |
20 |
|
[POP]D:202 |
9 |
1 |
262 |
f |
D |
x,y,z |
1_555 |
31 |
13 |
8838 |
176.3 |
0.9 |
0.730 |
5 |
0 |
0 |
0.028 |
10 |
21 |
|
[POP]F:202 |
9 |
1 |
264 |
f |
F |
x,y,z |
1_555 |
30 |
12 |
8767 |
159.6 |
-1.0 |
0.551 |
1 |
0 |
0 |
0.026 |
11 |
22 |
|
F |
19 |
4 |
8767 |
◊ |
E |
x,y,z |
1_555 |
19 |
4 |
8781 |
157.7 |
-1.5 |
0.477 |
0 |
0 |
0 |
0.038 |
23 |
|
D |
19 |
5 |
8838 |
◊ |
A |
x,y,z |
1_555 |
21 |
5 |
8790 |
156.1 |
-3.1 |
0.257 |
0 |
0 |
0 |
0.038 |
24 |
|
C |
18 |
5 |
8760 |
◊ |
B |
x,y,z |
1_555 |
23 |
5 |
8843 |
145.7 |
-3.9 |
0.214 |
0 |
0 |
0 |
0.038 |
Average: |
153.2 |
-2.8 |
0.316 |
0 |
0 |
0 |
0.038 |
12 |
25 |
|
[DMS]F:205 |
4 |
1 |
210 |
◊ |
F |
x,y,z |
1_555 |
20 |
5 |
8767 |
126.5 |
1.6 |
0.468 |
0 |
0 |
0 |
0.000 |
13 |
26 |
|
[DMS]A:202 |
4 |
1 |
210 |
f |
A |
x,y,z |
1_555 |
22 |
7 |
8790 |
115.6 |
2.1 |
0.448 |
0 |
0 |
0 |
0.000 |
14 |
27 |
|
[DMS]A:205 |
4 |
1 |
209 |
f |
A |
x,y,z |
1_555 |
21 |
11 |
8790 |
112.5 |
2.7 |
0.567 |
0 |
0 |
0 |
0.000 |
15 |
28 |
|
[DMS]A:203 |
4 |
1 |
210 |
◊ |
A |
x,y,z |
1_555 |
22 |
9 |
8790 |
111.5 |
2.8 |
0.475 |
1 |
0 |
0 |
0.000 |
16 |
29 |
|
C |
15 |
5 |
8760 |
◊ |
E |
x,y,z-1 |
1_554 |
11 |
4 |
8781 |
110.7 |
0.9 |
0.777 |
0 |
2 |
0 |
0.000 |
30 |
|
F |
12 |
5 |
8767 |
◊ |
D |
x-1,y,z |
1_455 |
15 |
5 |
8838 |
101.7 |
1.1 |
0.809 |
1 |
2 |
0 |
0.000 |
Average: |
106.2 |
1.0 |
0.793 |
1 |
2 |
0 |
0.000 |
17 |
31 |
|
[DMS]E:204 |
4 |
1 |
208 |
f |
E |
x,y,z |
1_555 |
18 |
6 |
8781 |
109.9 |
1.2 |
0.349 |
0 |
0 |
0 |
0.000 |
18 |
32 |
|
[COA]B:201 |
8 |
1 |
897 |
◊ |
E |
x,y,z |
1_555 |
11 |
4 |
8781 |
104.9 |
1.0 |
0.493 |
0 |
0 |
0 |
0.000 |
33 |
|
[COA]A:201 |
8 |
1 |
895 |
◊ |
F |
x,y,z |
1_555 |
8 |
4 |
8767 |
102.1 |
0.9 |
0.376 |
0 |
0 |
0 |
0.000 |
Average: |
103.5 |
0.9 |
0.434 |
0 |
0 |
0 |
0.000 |
19 |
34 |
|
[ACT]F:206 |
4 |
1 |
182 |
f |
F |
x,y,z |
1_555 |
20 |
10 |
8767 |
102.4 |
0.7 |
0.795 |
4 |
0 |
0 |
0.020 |
20 |
35 |
|
[COA]C:201 |
8 |
1 |
905 |
◊ |
A |
x,y,z |
1_555 |
9 |
4 |
8790 |
101.2 |
1.0 |
0.364 |
0 |
0 |
0 |
0.000 |
21 |
36 |
|
[COA]D:201 |
8 |
1 |
877 |
◊ |
B |
x,y,z |
1_555 |
9 |
4 |
8843 |
100.6 |
1.2 |
0.414 |
0 |
0 |
0 |
0.000 |
22 |
37 |
|
[ACT]C:206 |
4 |
1 |
182 |
f |
C |
x,y,z |
1_555 |
18 |
10 |
8760 |
99.3 |
0.7 |
0.800 |
3 |
0 |
0 |
0.012 |
23 |
38 |
|
[DMS]D:204 |
4 |
1 |
208 |
◊ |
D |
x,y,z |
1_555 |
13 |
7 |
8838 |
98.6 |
1.9 |
0.409 |
4 |
0 |
0 |
0.000 |
24 |
39 |
|
[ACT]E:206 |
4 |
1 |
184 |
f |
E |
x,y,z |
1_555 |
20 |
10 |
8781 |
98.0 |
0.0 |
0.702 |
3 |
0 |
0 |
0.025 |
25 |
40 |
|
[DMS]D:203 |
4 |
1 |
210 |
◊ |
D |
x,y,z |
1_555 |
16 |
8 |
8838 |
94.2 |
1.8 |
0.530 |
1 |
0 |
0 |
0.000 |
26 |
41 |
|
[DMS]A:204 |
4 |
1 |
208 |
◊ |
A |
x,y,z |
1_555 |
18 |
9 |
8790 |
94.2 |
1.3 |
0.393 |
0 |
0 |
0 |
0.000 |
27 |
42 |
|
[ACT]A:208 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
21 |
11 |
8790 |
86.7 |
0.4 |
0.804 |
3 |
0 |
0 |
0.020 |
28 |
43 |
|
[FMT]A:206 |
3 |
1 |
149 |
f |
D |
-x+3,y-1/2,-z |
2_845 |
10 |
5 |
8838 |
82.5 |
-0.7 |
0.342 |
1 |
0 |
0 |
0.024 |
29 |
44 |
|
[FMT]C:203 |
3 |
1 |
148 |
f |
C |
x,y,z |
1_555 |
18 |
6 |
8760 |
82.3 |
-0.5 |
0.610 |
0 |
0 |
0 |
0.010 |
30 |
45 |
|
[DMS]F:204 |
4 |
1 |
210 |
◊ |
F |
x,y,z |
1_555 |
13 |
5 |
8767 |
81.4 |
2.3 |
0.533 |
1 |
0 |
0 |
0.000 |
31 |
46 |
|
[FMT]C:202 |
3 |
1 |
149 |
f |
C |
x,y,z |
1_555 |
16 |
7 |
8760 |
79.9 |
-0.8 |
0.379 |
0 |
0 |
0 |
0.017 |
32 |
47 |
|
[FMT]B:202 |
3 |
1 |
149 |
f |
B |
x,y,z |
1_555 |
15 |
5 |
8843 |
77.6 |
-0.1 |
0.656 |
0 |
0 |
0 |
0.001 |
33 |
48 |
|
[FMT]E:201 |
3 |
1 |
148 |
f |
E |
x,y,z |
1_555 |
14 |
6 |
8781 |
75.7 |
-0.3 |
0.382 |
1 |
0 |
0 |
0.015 |
34 |
49 |
|
[FMT]B:205 |
3 |
1 |
148 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
8843 |
73.7 |
-0.1 |
0.412 |
1 |
0 |
0 |
0.010 |
35 |
50 |
|
[FMT]B:207 |
3 |
1 |
148 |
f |
B |
x,y,z |
1_555 |
12 |
4 |
8843 |
70.0 |
0.3 |
0.441 |
4 |
0 |
0 |
0.027 |
36 |
51 |
|
[FMT]A:207 |
3 |
1 |
149 |
f |
F |
-x+2,y-1/2,-z |
2_745 |
12 |
4 |
8767 |
66.9 |
0.2 |
0.685 |
1 |
0 |
0 |
0.004 |
37 |
52 |
|
E |
12 |
5 |
8781 |
f |
[FMT]B:203 |
-x+3,y-1/2,-z+1 |
2_846 |
3 |
1 |
149 |
63.8 |
-1.1 |
0.354 |
0 |
0 |
0 |
0.021 |
38 |
53 |
|
[FMT]B:206 |
3 |
1 |
149 |
f |
B |
x,y,z |
1_555 |
7 |
3 |
8843 |
63.8 |
-0.3 |
0.424 |
0 |
0 |
0 |
0.006 |
39 |
54 |
|
[FMT]B:204 |
3 |
1 |
148 |
f |
B |
x,y,z |
1_555 |
11 |
5 |
8843 |
63.6 |
-0.0 |
0.652 |
0 |
0 |
0 |
0.000 |
40 |
55 |
|
[FMT]C:204 |
3 |
1 |
147 |
f |
C |
x,y,z |
1_555 |
8 |
3 |
8760 |
62.4 |
0.3 |
0.712 |
1 |
0 |
0 |
0.002 |
41 |
56 |
|
[FMT]C:205 |
3 |
1 |
149 |
◊ |
C |
x,y,z |
1_555 |
8 |
4 |
8760 |
60.1 |
0.5 |
0.701 |
1 |
0 |
0 |
0.000 |
42 |
57 |
|
[GOL]D:206 |
4 |
1 |
220 |
f |
D |
x,y,z |
1_555 |
9 |
3 |
8838 |
59.7 |
-0.6 |
0.459 |
0 |
0 |
0 |
0.013 |
43 |
58 |
|
[COA]F:201 |
6 |
1 |
964 |
◊ |
C |
x,y,z |
1_555 |
6 |
4 |
8760 |
56.5 |
0.1 |
0.362 |
0 |
0 |
0 |
0.003 |
59 |
|
[COA]E:202 |
7 |
1 |
957 |
◊ |
D |
x,y,z |
1_555 |
4 |
3 |
8838 |
45.5 |
-0.3 |
0.291 |
0 |
0 |
0 |
0.003 |
Average: |
51.0 |
-0.1 |
0.327 |
0 |
0 |
0 |
0.003 |
44 |
60 |
|
[FMT]E:205 |
3 |
1 |
148 |
f |
E |
x,y,z |
1_555 |
11 |
6 |
8781 |
56.1 |
-0.1 |
0.418 |
2 |
0 |
0 |
0.018 |
45 |
61 |
|
[DMS]A:203 |
4 |
1 |
210 |
f |
D |
-x+3,y-1/2,-z |
2_845 |
9 |
3 |
8838 |
55.7 |
-0.2 |
0.291 |
1 |
0 |
0 |
0.013 |
46 |
62 |
|
[DMS]F:204 |
4 |
1 |
210 |
f |
B |
x,y,z |
1_555 |
9 |
3 |
8843 |
55.0 |
-0.7 |
0.269 |
0 |
0 |
0 |
0.013 |
47 |
63 |
|
[DMS]A:204 |
3 |
1 |
208 |
◊ |
[COA]A:201 |
x,y,z |
1_555 |
8 |
1 |
895 |
53.1 |
3.0 |
0.505 |
0 |
0 |
0 |
0.000 |
48 |
64 |
|
[DMS]D:203 |
3 |
1 |
210 |
◊ |
[COA]D:201 |
x,y,z |
1_555 |
6 |
1 |
877 |
48.7 |
2.6 |
0.386 |
0 |
0 |
0 |
0.000 |
49 |
65 |
|
[FMT]A:207 |
2 |
1 |
149 |
◊ |
A |
x,y,z |
1_555 |
11 |
4 |
8790 |
48.7 |
-0.1 |
0.620 |
0 |
0 |
0 |
0.000 |
50 |
66 |
|
[FMT]C:205 |
3 |
1 |
149 |
f |
D |
x,y,z |
1_555 |
7 |
3 |
8838 |
47.0 |
-0.9 |
0.358 |
0 |
0 |
0 |
0.018 |
51 |
67 |
|
[ACT]A:208 |
3 |
1 |
183 |
f |
[COA]A:201 |
x,y,z |
1_555 |
10 |
1 |
895 |
46.3 |
-1.6 |
0.352 |
0 |
0 |
0 |
0.034 |
52 |
68 |
|
[FMT]D:205 |
3 |
1 |
148 |
f |
D |
x,y,z |
1_555 |
7 |
4 |
8838 |
44.0 |
0.1 |
0.615 |
1 |
0 |
0 |
0.007 |
53 |
69 |
|
[COA]F:201 |
8 |
1 |
964 |
f |
[ACT]F:206 |
x,y,z |
1_555 |
3 |
1 |
182 |
42.4 |
-0.8 |
0.511 |
0 |
0 |
0 |
0.014 |
54 |
70 |
|
[COA]E:202 |
9 |
1 |
957 |
f |
[ACT]E:206 |
x,y,z |
1_555 |
3 |
1 |
184 |
41.4 |
-1.1 |
0.475 |
0 |
0 |
0 |
0.021 |
55 |
71 |
|
[ACT]C:206 |
2 |
1 |
182 |
f |
[COA]C:201 |
x,y,z |
1_555 |
8 |
1 |
905 |
40.9 |
-1.5 |
0.365 |
0 |
0 |
0 |
0.032 |
56 |
72 |
|
[POP]D:202 |
5 |
1 |
262 |
f |
[COA]D:201 |
x,y,z |
1_555 |
6 |
1 |
877 |
39.7 |
-0.9 |
0.387 |
0 |
0 |
0 |
0.019 |
57 |
73 |
|
[FMT]D:205 |
3 |
1 |
148 |
◊ |
[DMS]D:204 |
x,y,z |
1_555 |
3 |
1 |
208 |
35.7 |
1.2 |
0.229 |
0 |
0 |
0 |
0.000 |
58 |
74 |
|
[DMS]D:203 |
2 |
1 |
210 |
f |
B |
x,y,z |
1_555 |
2 |
1 |
8843 |
34.7 |
0.6 |
0.294 |
0 |
0 |
0 |
0.000 |
59 |
75 |
|
[CA]F:203 |
1 |
1 |
85 |
f |
F |
x,y,z |
1_555 |
8 |
5 |
8767 |
34.1 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.119 |
76 |
|
[CA]E:203 |
1 |
1 |
85 |
f |
E |
x,y,z |
1_555 |
6 |
4 |
8781 |
33.3 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.119 |
Average: |
33.7 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.119 |
60 |
77 |
|
[DMS]A:204 |
1 |
1 |
208 |
f |
F |
x,y,z |
1_555 |
2 |
1 |
8767 |
33.5 |
0.6 |
0.244 |
0 |
0 |
0 |
0.000 |
61 |
78 |
|
[CA]F:203 |
1 |
1 |
85 |
f |
[COA]F:201 |
x,y,z |
1_555 |
7 |
1 |
964 |
32.7 |
-6.8 |
0.000 |
0 |
0 |
0 |
0.130 |
79 |
|
[CA]E:203 |
1 |
1 |
85 |
f |
[COA]E:202 |
x,y,z |
1_555 |
7 |
1 |
957 |
32.2 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.130 |
Average: |
32.5 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.130 |
62 |
80 |
|
[DMS]A:205 |
2 |
1 |
209 |
f |
[COA]A:201 |
x,y,z |
1_555 |
7 |
1 |
895 |
32.2 |
-0.3 |
0.369 |
0 |
0 |
0 |
0.006 |
63 |
81 |
|
[FMT]E:201 |
3 |
1 |
148 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
8843 |
30.5 |
0.4 |
0.747 |
1 |
0 |
0 |
0.001 |
64 |
82 |
|
[ACT]A:208 |
3 |
1 |
183 |
f |
[DMS]A:205 |
x,y,z |
1_555 |
3 |
1 |
209 |
27.6 |
0.4 |
0.374 |
0 |
0 |
0 |
0.000 |
65 |
83 |
|
[FMT]C:202 |
3 |
1 |
149 |
◊ |
B |
-x+3,y-1/2,-z |
2_845 |
5 |
2 |
8843 |
26.6 |
0.1 |
0.631 |
0 |
0 |
0 |
0.000 |
66 |
84 |
|
[FMT]B:207 |
2 |
1 |
148 |
◊ |
D |
x,y,z |
1_555 |
4 |
2 |
8838 |
25.1 |
-0.5 |
0.441 |
0 |
0 |
0 |
0.006 |
67 |
85 |
|
[FMT]A:206 |
2 |
1 |
149 |
◊ |
A |
x,y,z |
1_555 |
2 |
2 |
8790 |
24.0 |
0.6 |
0.706 |
0 |
0 |
0 |
0.000 |
68 |
86 |
|
C |
5 |
1 |
8760 |
◊ |
D |
-x+3,y-1/2,-z |
2_845 |
5 |
1 |
8838 |
15.6 |
0.1 |
0.694 |
0 |
0 |
0 |
0.000 |
69 |
87 |
|
[DMS]F:205 |
3 |
1 |
210 |
f |
[DMS]F:204 |
x,y,z |
1_555 |
1 |
1 |
210 |
15.0 |
0.5 |
0.319 |
0 |
0 |
0 |
0.000 |
70 |
88 |
|
[FMT]C:204 |
2 |
1 |
147 |
◊ |
B |
-x+3,y-1/2,-z |
2_845 |
2 |
2 |
8843 |
14.1 |
0.1 |
0.678 |
0 |
0 |
0 |
0.000 |
71 |
89 |
|
D |
2 |
1 |
8838 |
◊ |
[FMT]B:206 |
-x+3,y-1/2,-z+1 |
2_846 |
2 |
1 |
149 |
12.3 |
0.5 |
0.708 |
0 |
0 |
0 |
0.000 |
72 |
90 |
|
[COA]F:201 |
1 |
1 |
964 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
8790 |
11.5 |
-0.5 |
0.344 |
0 |
0 |
0 |
0.007 |
91 |
|
[COA]E:202 |
1 |
1 |
957 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
8843 |
11.2 |
-0.5 |
0.344 |
0 |
0 |
0 |
0.007 |
Average: |
11.3 |
-0.5 |
0.344 |
0 |
0 |
0 |
0.007 |
73 |
92 |
|
B |
4 |
2 |
8843 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
8790 |
10.8 |
0.1 |
0.739 |
0 |
0 |
0 |
0.000 |
93 |
|
F |
1 |
1 |
8767 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
8838 |
1.6 |
0.0 |
0.619 |
0 |
0 |
0 |
0.000 |
94 |
|
E |
1 |
1 |
8781 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
8760 |
1.5 |
-0.0 |
0.616 |
0 |
0 |
0 |
0.000 |
Average: |
4.6 |
0.0 |
0.658 |
0 |
0 |
0 |
0.000 |
74 |
95 |
|
A |
3 |
1 |
8790 |
◊ |
C |
-x+2,y-1/2,-z |
2_745 |
1 |
1 |
8760 |
6.2 |
-0.1 |
0.476 |
0 |
0 |
0 |
0.000 |
75 |
96 |
|
C |
2 |
2 |
8760 |
◊ |
[FMT]B:207 |
-x+3,y-1/2,-z |
2_845 |
2 |
1 |
148 |
5.3 |
0.2 |
0.669 |
0 |
0 |
0 |
0.000 |
76 |
97 |
|
[CA]E:203 |
1 |
1 |
85 |
f |
[ACT]E:206 |
x,y,z |
1_555 |
2 |
1 |
184 |
2.7 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.008 |
77 |
98 |
|
[CA]F:203 |
1 |
1 |
85 |
f |
[ACT]F:206 |
x,y,z |
1_555 |
2 |
1 |
182 |
2.6 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.008 |
78 |
99 |
|
[COA]C:201 |
1 |
1 |
905 |
◊ |
F |
x,y,z |
1_555 |
1 |
1 |
8767 |
1.8 |
-0.1 |
0.472 |
0 |
0 |
0 |
0.001 |
79 |
100 |
|
A |
1 |
1 |
8790 |
f |
[DMS]D:204 |
-x+3,y-1/2,-z |
2_845 |
1 |
1 |
208 |
1.7 |
0.0 |
0.354 |
0 |
0 |
0 |
0.000 |
80 |
101 |
|
[COA]D:201 |
1 |
1 |
877 |
◊ |
E |
x,y,z |
1_555 |
1 |
1 |
8781 |
0.6 |
-0.0 |
0.457 |
0 |
0 |
0 |
0.000 |
|