| ## |
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 |
141 |
37 |
12423 |
◊ |
C |
x,y,z |
1_555 |
139 |
35 |
12432 |
1212.5 |
-1.0 |
0.703 |
34 |
0 |
0 |
0.084 |
2 |
|
B |
141 |
37 |
12433 |
◊ |
A |
x,y,z |
1_555 |
135 |
35 |
12423 |
1198.8 |
-0.6 |
0.714 |
36 |
0 |
0 |
0.084 |
| Average: |
1205.7 |
-0.8 |
0.709 |
35 |
0 |
0 |
0.084 |
| 2 |
3 |
|
B |
61 |
15 |
12433 |
◊ |
C |
x-1,y,z |
1_455 |
63 |
17 |
12432 |
548.6 |
-3.8 |
0.399 |
3 |
0 |
0 |
0.000 |
4 |
|
D |
59 |
15 |
12423 |
◊ |
A |
x,y,z |
1_555 |
60 |
16 |
12423 |
530.1 |
-3.4 |
0.418 |
3 |
0 |
0 |
0.000 |
| Average: |
539.4 |
-3.6 |
0.408 |
3 |
0 |
0 |
0.000 |
| 3 |
5 |
|
A |
58 |
14 |
12423 |
◊ |
D |
x-1,y-1,z-1 |
1_444 |
61 |
15 |
12423 |
547.3 |
-8.5 |
0.091 |
4 |
2 |
0 |
0.070 |
6 |
|
B |
56 |
15 |
12433 |
◊ |
C |
x-1,y-1,z-1 |
1_444 |
55 |
14 |
12432 |
498.1 |
-8.0 |
0.097 |
3 |
2 |
0 |
0.070 |
| Average: |
522.7 |
-8.2 |
0.094 |
4 |
2 |
0 |
0.070 |
| 4 |
7 |
|
G |
47 |
11 |
2036 |
◊ |
C |
x,y,z |
1_555 |
57 |
17 |
12432 |
489.9 |
-7.4 |
0.146 |
3 |
0 |
0 |
0.183 |
8 |
|
H |
43 |
11 |
2039 |
◊ |
D |
x,y,z |
1_555 |
55 |
17 |
12423 |
488.5 |
-7.5 |
0.130 |
3 |
0 |
0 |
0.183 |
9 |
|
F |
44 |
11 |
2029 |
◊ |
B |
x,y,z |
1_555 |
56 |
17 |
12433 |
485.8 |
-7.4 |
0.139 |
3 |
0 |
0 |
0.183 |
10 |
|
E |
43 |
11 |
2034 |
◊ |
A |
x,y,z |
1_555 |
56 |
17 |
12423 |
482.3 |
-7.4 |
0.139 |
3 |
0 |
0 |
0.183 |
| Average: |
486.6 |
-7.4 |
0.138 |
3 |
0 |
0 |
0.183 |
| 5 |
11 |
|
B |
59 |
21 |
12433 |
◊ |
D |
x-1,y,z-1 |
1_454 |
51 |
16 |
12423 |
451.6 |
-1.5 |
0.533 |
3 |
0 |
0 |
0.010 |
| 6 |
12 |
|
A |
41 |
15 |
12423 |
◊ |
B |
x,y-1,z |
1_545 |
40 |
13 |
12433 |
320.8 |
-2.8 |
0.349 |
0 |
0 |
0 |
0.018 |
| 7 |
13 |
|
[GDP]C:3 |
27 |
1 |
579 |
f |
C |
x,y,z |
1_555 |
52 |
20 |
12432 |
281.2 |
-4.6 |
0.620 |
18 |
0 |
0 |
0.258 |
14 |
|
[GDP]A:1 |
28 |
1 |
578 |
f |
A |
x,y,z |
1_555 |
52 |
19 |
12423 |
279.9 |
-4.6 |
0.623 |
16 |
0 |
0 |
0.258 |
15 |
|
[GDP]D:4 |
28 |
1 |
575 |
f |
D |
x,y,z |
1_555 |
53 |
21 |
12423 |
274.5 |
-4.5 |
0.632 |
18 |
0 |
0 |
0.258 |
16 |
|
[GDP]B:2 |
27 |
1 |
573 |
f |
B |
x,y,z |
1_555 |
51 |
18 |
12433 |
274.0 |
-4.1 |
0.642 |
18 |
0 |
0 |
0.258 |
| Average: |
277.4 |
-4.4 |
0.629 |
18 |
0 |
0 |
0.258 |
| 8 |
17 |
|
B |
32 |
8 |
12433 |
◊ |
A |
x-1,y,z |
1_455 |
32 |
7 |
12423 |
269.8 |
-0.4 |
0.608 |
1 |
4 |
0 |
0.000 |
18 |
|
D |
31 |
8 |
12423 |
◊ |
C |
x-1,y,z |
1_455 |
32 |
7 |
12432 |
261.5 |
-0.3 |
0.612 |
0 |
3 |
0 |
0.000 |
| Average: |
265.6 |
-0.4 |
0.610 |
1 |
4 |
0 |
0.000 |
| 9 |
19 |
|
F |
24 |
5 |
2029 |
◊ |
A |
x,y,z |
1_555 |
30 |
9 |
12423 |
237.5 |
-2.4 |
0.280 |
4 |
0 |
0 |
0.035 |
20 |
|
G |
24 |
5 |
2036 |
◊ |
D |
x,y,z |
1_555 |
30 |
9 |
12423 |
235.5 |
-2.4 |
0.281 |
4 |
0 |
0 |
0.035 |
21 |
|
H |
24 |
5 |
2039 |
◊ |
C |
x,y,z |
1_555 |
30 |
9 |
12432 |
234.6 |
-2.4 |
0.280 |
4 |
0 |
0 |
0.035 |
22 |
|
E |
24 |
5 |
2034 |
◊ |
B |
x,y,z |
1_555 |
30 |
9 |
12433 |
234.4 |
-2.4 |
0.283 |
4 |
0 |
0 |
0.035 |
| Average: |
235.5 |
-2.4 |
0.281 |
4 |
0 |
0 |
0.035 |
| 10 |
23 |
|
D |
25 |
10 |
12423 |
◊ |
C |
x,y-1,z |
1_545 |
18 |
6 |
12432 |
191.5 |
-0.1 |
0.585 |
2 |
1 |
0 |
0.004 |
| 11 |
24 |
|
G |
19 |
4 |
2036 |
◊ |
F |
x,y,z |
1_555 |
14 |
3 |
2029 |
142.2 |
-0.2 |
0.567 |
0 |
0 |
0 |
0.000 |
25 |
|
E |
19 |
4 |
2034 |
◊ |
H |
x-1,y,z |
1_455 |
13 |
3 |
2039 |
125.2 |
-0.1 |
0.577 |
0 |
0 |
0 |
0.000 |
| Average: |
133.7 |
-0.1 |
0.572 |
0 |
0 |
0 |
0.000 |
| 12 |
26 |
|
[GDP]B:2 |
14 |
1 |
573 |
◊ |
A |
x,y,z |
1_555 |
22 |
6 |
12423 |
105.3 |
-0.8 |
0.518 |
1 |
0 |
0 |
0.011 |
27 |
|
[GDP]D:4 |
14 |
1 |
575 |
◊ |
C |
x,y,z |
1_555 |
20 |
6 |
12432 |
104.9 |
-0.7 |
0.516 |
1 |
0 |
0 |
0.011 |
28 |
|
[GDP]C:3 |
12 |
1 |
579 |
◊ |
D |
x,y,z |
1_555 |
21 |
6 |
12423 |
102.8 |
-0.6 |
0.511 |
1 |
0 |
0 |
0.011 |
29 |
|
[GDP]A:1 |
12 |
1 |
578 |
◊ |
B |
x,y,z |
1_555 |
19 |
6 |
12433 |
99.7 |
-0.5 |
0.507 |
1 |
0 |
0 |
0.011 |
| Average: |
103.2 |
-0.7 |
0.513 |
1 |
0 |
0 |
0.011 |
| 13 |
30 |
|
[SO4]A:10 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
12423 |
89.0 |
-14.9 |
0.458 |
3 |
0 |
0 |
0.178 |
| 14 |
31 |
|
[SO4]B:14 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
13 |
5 |
12433 |
86.6 |
-13.8 |
0.698 |
2 |
0 |
0 |
0.224 |
| 15 |
32 |
|
[AF3]A:368 |
4 |
1 |
188 |
f |
A |
x,y,z |
1_555 |
20 |
10 |
12423 |
84.1 |
1.8 |
0.659 |
5 |
0 |
0 |
0.004 |
| 16 |
33 |
|
[AF3]C:368 |
4 |
1 |
187 |
f |
C |
x,y,z |
1_555 |
18 |
9 |
12432 |
83.8 |
2.0 |
0.887 |
7 |
0 |
0 |
0.013 |
| 17 |
34 |
|
[AF3]B:368 |
4 |
1 |
189 |
f |
B |
x,y,z |
1_555 |
19 |
10 |
12433 |
83.3 |
1.8 |
0.665 |
5 |
0 |
0 |
0.007 |
| 18 |
35 |
|
[SO4]A:13 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
14 |
6 |
12423 |
83.1 |
-12.1 |
0.675 |
2 |
0 |
0 |
0.143 |
| 19 |
36 |
|
[SO4]C:15 |
5 |
1 |
186 |
f |
C |
x,y,z |
1_555 |
14 |
6 |
12432 |
82.6 |
-12.0 |
0.713 |
3 |
0 |
0 |
0.156 |
| 20 |
37 |
|
[AF3]D:368 |
4 |
1 |
187 |
◊ |
D |
x,y,z |
1_555 |
22 |
10 |
12423 |
82.6 |
1.4 |
0.665 |
3 |
0 |
0 |
0.000 |
| 21 |
38 |
|
E |
10 |
2 |
2034 |
◊ |
C |
x-1,y-1,z |
1_445 |
9 |
4 |
12432 |
81.2 |
-2.0 |
0.231 |
0 |
0 |
0 |
0.001 |
| 22 |
39 |
|
[SO4]B:8 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
17 |
8 |
12433 |
80.5 |
-12.6 |
0.660 |
1 |
0 |
0 |
0.199 |
| 23 |
40 |
|
[SO4]D:6 |
5 |
1 |
184 |
f |
D |
x,y,z |
1_555 |
16 |
7 |
12423 |
78.4 |
-12.1 |
0.655 |
1 |
0 |
0 |
0.260 |
| 24 |
41 |
|
[SO4]C:4 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
13 |
6 |
12432 |
77.8 |
-12.2 |
0.691 |
3 |
0 |
0 |
0.158 |
| 25 |
42 |
|
[SO4]C:9 |
5 |
1 |
187 |
f |
C |
x,y,z |
1_555 |
15 |
7 |
12432 |
77.3 |
-12.0 |
0.652 |
1 |
0 |
0 |
0.145 |
| 26 |
43 |
|
[SO4]A:5 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
15 |
7 |
12423 |
77.2 |
-12.2 |
0.610 |
2 |
0 |
0 |
0.144 |
| 27 |
44 |
|
[SO4]B:1 |
5 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
13 |
6 |
12433 |
77.2 |
-12.3 |
0.685 |
3 |
0 |
0 |
0.208 |
| 28 |
45 |
|
[SO4]A:3 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
12423 |
77.0 |
-12.3 |
0.690 |
3 |
0 |
0 |
0.150 |
| 29 |
46 |
|
[SO4]D:2 |
5 |
1 |
184 |
f |
D |
x,y,z |
1_555 |
13 |
6 |
12423 |
76.5 |
-12.3 |
0.689 |
3 |
0 |
0 |
0.282 |
| 30 |
47 |
|
[SO4]C:11 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
10 |
5 |
12432 |
71.9 |
-9.8 |
0.679 |
2 |
0 |
0 |
0.125 |
| 31 |
48 |
|
[SO4]A:7 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
11 |
6 |
12423 |
71.3 |
-10.3 |
0.716 |
2 |
0 |
0 |
0.123 |
| 32 |
49 |
|
[SO4]D:12 |
4 |
1 |
185 |
f |
C |
x,y-1,z |
1_545 |
9 |
4 |
12432 |
61.9 |
-8.4 |
0.660 |
0 |
0 |
0 |
0.098 |
| 33 |
50 |
|
[SO4]C:4 |
4 |
1 |
185 |
◊ |
D |
x,y,z |
1_555 |
8 |
4 |
12423 |
56.6 |
-6.6 |
0.884 |
2 |
0 |
0 |
0.039 |
| 34 |
51 |
|
[SO4]B:1 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
8 |
4 |
12423 |
56.5 |
-6.7 |
0.874 |
1 |
0 |
0 |
0.033 |
| 35 |
52 |
|
[SO4]D:2 |
4 |
1 |
184 |
◊ |
C |
x,y,z |
1_555 |
8 |
4 |
12432 |
56.2 |
-6.7 |
0.871 |
2 |
0 |
0 |
0.040 |
| 36 |
53 |
|
[SO4]A:3 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
8 |
4 |
12433 |
56.1 |
-6.6 |
0.869 |
2 |
0 |
0 |
0.035 |
| 37 |
54 |
|
[SO4]A:10 |
4 |
1 |
185 |
◊ |
B |
x,y-1,z |
1_545 |
6 |
3 |
12433 |
50.1 |
-6.8 |
0.554 |
1 |
0 |
0 |
0.048 |
| 38 |
55 |
|
A |
4 |
1 |
12423 |
◊ |
[SO4]C:11 |
x-1,y-1,z |
1_445 |
4 |
1 |
185 |
40.0 |
-5.1 |
0.346 |
1 |
0 |
0 |
0.003 |
| 39 |
56 |
|
[SO4]D:6 |
4 |
1 |
184 |
◊ |
[SO4]C:9 |
x,y,z |
1_555 |
4 |
1 |
187 |
37.9 |
-8.5 |
0.998 |
0 |
0 |
0 |
0.044 |
| 40 |
57 |
|
[SO4]D:6 |
4 |
1 |
184 |
◊ |
C |
x,y,z |
1_555 |
3 |
1 |
12432 |
37.7 |
-5.2 |
0.325 |
0 |
0 |
0 |
0.027 |
| 41 |
58 |
|
[MG]C:367 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
15 |
9 |
12432 |
37.7 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.054 |
59 |
|
[MG]D:367 |
1 |
1 |
98 |
◊ |
D |
x,y,z |
1_555 |
14 |
9 |
12423 |
37.5 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.054 |
60 |
|
[MG]A:367 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
16 |
9 |
12423 |
36.7 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.054 |
61 |
|
[MG]B:367 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
12 |
8 |
12433 |
36.2 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.054 |
| Average: |
37.0 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.054 |
| 42 |
62 |
|
[SO4]C:9 |
4 |
1 |
187 |
◊ |
D |
x,y,z |
1_555 |
3 |
1 |
12423 |
37.3 |
-5.5 |
0.348 |
0 |
0 |
0 |
0.029 |
| 43 |
63 |
|
[SO4]A:5 |
3 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
4 |
1 |
12433 |
35.9 |
-5.5 |
0.448 |
0 |
0 |
0 |
0.026 |
| 44 |
64 |
|
[SO4]B:8 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
12423 |
35.8 |
-5.1 |
0.345 |
0 |
0 |
0 |
0.024 |
| 45 |
65 |
|
[SO4]B:8 |
4 |
1 |
185 |
◊ |
[SO4]A:5 |
x,y,z |
1_555 |
4 |
1 |
185 |
35.5 |
-7.8 |
0.998 |
0 |
0 |
0 |
0.037 |
| 46 |
66 |
|
[AF3]D:368 |
4 |
1 |
187 |
◊ |
[GDP]D:4 |
x,y,z |
1_555 |
6 |
1 |
575 |
35.0 |
-1.7 |
0.438 |
1 |
0 |
0 |
0.011 |
| 47 |
67 |
|
[AF3]B:368 |
4 |
1 |
189 |
f |
[GDP]B:2 |
x,y,z |
1_555 |
5 |
1 |
573 |
34.7 |
-1.8 |
0.393 |
0 |
0 |
0 |
0.028 |
| 48 |
68 |
|
[AF3]C:368 |
4 |
1 |
187 |
cf |
[GDP]C:3 |
x,y,z |
1_555 |
7 |
1 |
579 |
34.5 |
-1.9 |
0.460 |
0 |
0 |
0 |
0.022 |
| 49 |
69 |
|
[SO4]A:7 |
4 |
1 |
185 |
◊ |
B |
x,y-1,z |
1_545 |
6 |
1 |
12433 |
34.3 |
-4.2 |
0.652 |
0 |
0 |
0 |
0.028 |
| 50 |
70 |
|
[AF3]A:368 |
4 |
1 |
188 |
f |
[GDP]A:1 |
x,y,z |
1_555 |
6 |
1 |
578 |
33.7 |
-1.9 |
0.418 |
0 |
0 |
0 |
0.021 |
| 51 |
71 |
|
[SO4]D:12 |
3 |
1 |
185 |
◊ |
D |
x,y,z |
1_555 |
5 |
2 |
12423 |
28.6 |
-3.5 |
0.724 |
0 |
0 |
0 |
0.012 |
| 52 |
72 |
|
[AF3]C:368 |
3 |
1 |
187 |
◊ |
[GDP]D:4 |
x,y,z |
1_555 |
4 |
1 |
575 |
26.9 |
0.4 |
0.334 |
0 |
0 |
0 |
0.000 |
| 53 |
73 |
|
[AF3]D:368 |
3 |
1 |
187 |
f |
[GDP]C:3 |
x,y,z |
1_555 |
4 |
1 |
579 |
26.9 |
0.6 |
0.327 |
1 |
0 |
0 |
0.000 |
| 54 |
74 |
|
[AF3]A:368 |
3 |
1 |
188 |
◊ |
[GDP]B:2 |
x,y,z |
1_555 |
4 |
1 |
573 |
26.9 |
0.5 |
0.333 |
1 |
0 |
0 |
0.000 |
| 55 |
75 |
|
[AF3]B:368 |
3 |
1 |
189 |
◊ |
[GDP]A:1 |
x,y,z |
1_555 |
4 |
1 |
578 |
26.8 |
0.6 |
0.339 |
1 |
0 |
0 |
0.000 |
| 56 |
76 |
|
A |
3 |
2 |
12423 |
◊ |
F |
x,y-1,z |
1_545 |
4 |
2 |
2029 |
24.7 |
-0.6 |
0.338 |
0 |
0 |
0 |
0.004 |
| 57 |
77 |
|
[MG]A:367 |
1 |
1 |
98 |
◊ |
[GDP]A:1 |
x,y,z |
1_555 |
4 |
1 |
578 |
22.3 |
-3.4 |
0.000 |
0 |
0 |
0 |
0.031 |
78 |
|
[MG]B:367 |
1 |
1 |
98 |
◊ |
[GDP]B:2 |
x,y,z |
1_555 |
4 |
1 |
573 |
20.5 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.031 |
79 |
|
[MG]D:367 |
1 |
1 |
98 |
◊ |
[GDP]D:4 |
x,y,z |
1_555 |
4 |
1 |
575 |
19.6 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.031 |
80 |
|
[MG]C:367 |
1 |
1 |
98 |
◊ |
[GDP]C:3 |
x,y,z |
1_555 |
4 |
1 |
579 |
19.2 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.031 |
| Average: |
20.4 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.031 |
| 58 |
81 |
|
[AF3]B:368 |
3 |
1 |
189 |
◊ |
[MG]B:367 |
x,y,z |
1_555 |
1 |
1 |
98 |
22.2 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.021 |
82 |
|
[AF3]A:368 |
3 |
1 |
188 |
◊ |
[MG]A:367 |
x,y,z |
1_555 |
1 |
1 |
98 |
20.3 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.021 |
83 |
|
[AF3]C:368 |
3 |
1 |
187 |
◊ |
[MG]C:367 |
x,y,z |
1_555 |
1 |
1 |
98 |
19.8 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.021 |
| Average: |
20.8 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.021 |
| 59 |
84 |
|
[GDP]A:1 |
4 |
1 |
578 |
◊ |
E |
x,y,z |
1_555 |
3 |
1 |
2034 |
22.1 |
-0.6 |
0.579 |
1 |
0 |
0 |
0.018 |
85 |
|
[GDP]C:3 |
4 |
1 |
579 |
◊ |
G |
x,y,z |
1_555 |
3 |
1 |
2036 |
21.9 |
-0.6 |
0.596 |
1 |
0 |
0 |
0.018 |
86 |
|
[GDP]D:4 |
3 |
1 |
575 |
◊ |
H |
x,y,z |
1_555 |
3 |
1 |
2039 |
21.8 |
-0.4 |
0.607 |
1 |
0 |
0 |
0.018 |
87 |
|
[GDP]B:2 |
4 |
1 |
573 |
◊ |
F |
x,y,z |
1_555 |
3 |
1 |
2029 |
21.3 |
-0.5 |
0.595 |
1 |
0 |
0 |
0.018 |
| Average: |
21.8 |
-0.6 |
0.594 |
1 |
0 |
0 |
0.018 |
| 60 |
88 |
|
[AF3]D:368 |
3 |
1 |
187 |
f |
[MG]D:367 |
x,y,z |
1_555 |
1 |
1 |
98 |
21.2 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.027 |
| 61 |
89 |
|
[SO4]C:4 |
4 |
1 |
185 |
◊ |
[GDP]D:4 |
x,y,z |
1_555 |
3 |
1 |
575 |
19.4 |
-1.8 |
0.818 |
1 |
0 |
0 |
0.012 |
| 62 |
90 |
|
[SO4]A:3 |
4 |
1 |
185 |
◊ |
[GDP]B:2 |
x,y,z |
1_555 |
3 |
1 |
573 |
19.3 |
-1.8 |
0.822 |
1 |
0 |
0 |
0.011 |
| 63 |
91 |
|
[SO4]D:2 |
4 |
1 |
184 |
◊ |
[GDP]C:3 |
x,y,z |
1_555 |
3 |
1 |
579 |
17.9 |
-1.7 |
0.820 |
1 |
0 |
0 |
0.011 |
| 64 |
92 |
|
[SO4]B:1 |
4 |
1 |
184 |
◊ |
[GDP]A:1 |
x,y,z |
1_555 |
3 |
1 |
578 |
16.4 |
-1.5 |
0.811 |
0 |
0 |
0 |
0.007 |
| 65 |
93 |
|
[GDP]B:2 |
5 |
1 |
573 |
◊ |
[GDP]A:1 |
x,y,z |
1_555 |
5 |
1 |
578 |
16.3 |
-0.2 |
0.686 |
0 |
0 |
0 |
0.001 |
94 |
|
[GDP]D:4 |
4 |
1 |
575 |
◊ |
[GDP]C:3 |
x,y,z |
1_555 |
4 |
1 |
579 |
12.1 |
-0.1 |
0.659 |
0 |
0 |
0 |
0.001 |
| Average: |
14.2 |
-0.2 |
0.672 |
0 |
0 |
0 |
0.001 |
| 66 |
95 |
|
[SO4]D:12 |
2 |
1 |
185 |
◊ |
H |
x,y,z |
1_555 |
3 |
1 |
2039 |
13.9 |
-1.9 |
0.682 |
0 |
0 |
0 |
0.006 |
| 67 |
96 |
|
H |
2 |
2 |
2039 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
12423 |
11.7 |
0.5 |
0.784 |
0 |
0 |
0 |
0.000 |
97 |
|
F |
2 |
2 |
2029 |
◊ |
C |
x-1,y,z |
1_455 |
3 |
2 |
12432 |
11.7 |
0.4 |
0.760 |
0 |
0 |
0 |
0.000 |
| Average: |
11.7 |
0.5 |
0.772 |
0 |
0 |
0 |
0.000 |
| 68 |
98 |
|
H |
2 |
2 |
2039 |
◊ |
C |
x,y-1,z |
1_545 |
2 |
2 |
12432 |
10.2 |
0.1 |
0.676 |
0 |
0 |
0 |
0.000 |
| 69 |
99 |
|
[AF3]D:368 |
2 |
1 |
187 |
f |
C |
x,y,z |
1_555 |
4 |
2 |
12432 |
9.4 |
0.3 |
0.873 |
0 |
0 |
0 |
0.000 |
| 70 |
100 |
|
E |
1 |
1 |
2034 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
12423 |
9.4 |
0.3 |
0.829 |
0 |
0 |
0 |
0.000 |
101 |
|
B |
1 |
1 |
12433 |
◊ |
G |
x-1,y,z |
1_455 |
1 |
1 |
2036 |
8.9 |
0.3 |
0.828 |
0 |
0 |
0 |
0.000 |
| Average: |
9.1 |
0.3 |
0.828 |
0 |
0 |
0 |
0.000 |
| 71 |
102 |
|
A |
1 |
1 |
12423 |
◊ |
C |
x-1,y-1,z |
1_445 |
1 |
1 |
12432 |
4.9 |
-0.6 |
0.104 |
0 |
0 |
0 |
0.000 |
| 72 |
103 |
|
[AF3]B:368 |
2 |
1 |
189 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
12423 |
1.6 |
0.0 |
0.868 |
0 |
0 |
0 |
0.000 |
| 73 |
104 |
|
[AF3]A:368 |
2 |
1 |
188 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
12433 |
1.4 |
-0.0 |
0.863 |
0 |
0 |
0 |
0.000 |
| 74 |
105 |
|
[AF3]C:368 |
1 |
1 |
187 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
12423 |
1.0 |
-0.0 |
0.429 |
0 |
0 |
0 |
0.000 |
|