## |
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 |
79 |
21 |
6452 |
◊ |
A |
x,y,z |
1_555 |
78 |
21 |
6461 |
693.5 |
-10.7 |
0.123 |
0 |
0 |
0 |
0.083 |
2 |
|
C |
74 |
20 |
6402 |
◊ |
B |
x,y,z |
1_555 |
78 |
20 |
6461 |
686.9 |
-11.9 |
0.079 |
0 |
0 |
0 |
0.083 |
Average: |
690.2 |
-11.3 |
0.101 |
0 |
0 |
0 |
0.083 |
2 |
3 |
|
[HEM]A:150 |
43 |
1 |
820 |
cf |
A |
x,y,z |
1_555 |
70 |
21 |
6461 |
533.2 |
-19.0 |
0.340 |
0 |
0 |
0 |
0.373 |
4 |
|
[HEM]D:150 |
43 |
1 |
818 |
cf |
D |
x,y,z |
1_555 |
74 |
20 |
6452 |
531.9 |
-19.0 |
0.366 |
0 |
0 |
0 |
0.373 |
5 |
|
[HEM]B:150 |
43 |
1 |
837 |
cf |
B |
x,y,z |
1_555 |
73 |
21 |
6461 |
530.5 |
-19.7 |
0.350 |
0 |
0 |
0 |
0.373 |
6 |
|
[HEM]C:150 |
42 |
1 |
835 |
cf |
C |
x,y,z |
1_555 |
71 |
21 |
6402 |
530.0 |
-19.1 |
0.346 |
0 |
0 |
0 |
0.373 |
Average: |
531.4 |
-19.2 |
0.351 |
0 |
0 |
0 |
0.373 |
3 |
7 |
|
B |
53 |
19 |
6461 |
◊ |
A |
x,y,z |
1_555 |
53 |
16 |
6461 |
484.0 |
0.2 |
0.716 |
2 |
6 |
0 |
0.009 |
8 |
|
D |
54 |
18 |
6452 |
◊ |
C |
x,y,z |
1_555 |
53 |
16 |
6402 |
468.4 |
-0.1 |
0.703 |
2 |
4 |
0 |
0.009 |
Average: |
476.2 |
0.0 |
0.710 |
2 |
5 |
0 |
0.009 |
4 |
9 |
|
D |
28 |
7 |
6452 |
◊ |
B |
x,y,z |
1_555 |
25 |
7 |
6461 |
244.1 |
-0.1 |
0.657 |
6 |
9 |
0 |
0.039 |
10 |
|
C |
27 |
7 |
6402 |
◊ |
A |
x,y,z |
1_555 |
27 |
7 |
6461 |
226.4 |
-0.4 |
0.633 |
5 |
6 |
0 |
0.039 |
Average: |
235.3 |
-0.2 |
0.645 |
6 |
8 |
0 |
0.039 |
5 |
11 |
|
B |
29 |
6 |
6461 |
◊ |
C |
x-y,x,z+1/6 |
6_555 |
25 |
7 |
6402 |
218.2 |
1.8 |
0.817 |
3 |
0 |
0 |
0.000 |
12 |
|
A |
25 |
7 |
6461 |
◊ |
D |
x-y+1,x+1,z+1/6 |
6_665 |
29 |
6 |
6452 |
208.2 |
2.1 |
0.835 |
2 |
0 |
0 |
0.000 |
Average: |
213.2 |
2.0 |
0.826 |
3 |
0 |
0 |
0.000 |
6 |
13 |
|
C |
17 |
5 |
6402 |
◊ |
D |
x,y-1,z |
1_545 |
13 |
4 |
6452 |
137.2 |
1.7 |
0.820 |
3 |
3 |
0 |
0.002 |
14 |
|
B |
13 |
4 |
6461 |
◊ |
A |
x,y-1,z |
1_545 |
16 |
5 |
6461 |
124.5 |
1.4 |
0.798 |
4 |
4 |
0 |
0.002 |
Average: |
130.9 |
1.5 |
0.809 |
4 |
4 |
0 |
0.002 |
7 |
15 |
|
A |
12 |
5 |
6461 |
◊ |
C |
x-y,x+1,z+1/6 |
6_565 |
13 |
5 |
6402 |
103.3 |
1.1 |
0.812 |
0 |
0 |
0 |
0.000 |
8 |
16 |
|
A |
12 |
4 |
6461 |
◊ |
B |
x-1,y,z |
1_455 |
12 |
7 |
6461 |
101.4 |
0.5 |
0.691 |
2 |
0 |
0 |
0.000 |
17 |
|
C |
9 |
4 |
6402 |
◊ |
D |
x-1,y-1,z |
1_445 |
18 |
7 |
6452 |
97.8 |
0.5 |
0.696 |
2 |
0 |
0 |
0.000 |
Average: |
99.6 |
0.5 |
0.693 |
2 |
0 |
0 |
0.000 |
9 |
18 |
|
B |
11 |
5 |
6461 |
◊ |
C |
x-y+1,x+1,z+1/6 |
6_665 |
10 |
5 |
6402 |
91.7 |
1.8 |
0.814 |
1 |
2 |
0 |
0.000 |
19 |
|
A |
12 |
6 |
6461 |
◊ |
D |
x-y,x,z+1/6 |
6_555 |
13 |
5 |
6452 |
88.7 |
1.6 |
0.822 |
1 |
1 |
0 |
0.000 |
Average: |
90.2 |
1.7 |
0.818 |
1 |
2 |
0 |
0.000 |
10 |
20 |
|
D |
11 |
5 |
6452 |
◊ |
[ME7]D:501 |
x-1,y,z |
1_455 |
8 |
1 |
368 |
88.6 |
-0.6 |
0.664 |
0 |
0 |
0 |
0.000 |
11 |
21 |
|
B |
9 |
3 |
6461 |
◊ |
D |
x,y-1,z |
1_545 |
9 |
3 |
6452 |
78.0 |
1.3 |
0.817 |
4 |
3 |
0 |
0.000 |
12 |
22 |
|
[ME7]D:501 |
5 |
1 |
368 |
cf |
B |
x,y,z |
1_555 |
8 |
4 |
6461 |
78.0 |
-2.4 |
0.222 |
0 |
0 |
0 |
0.023 |
13 |
23 |
|
[ME7]D:501 |
7 |
1 |
368 |
c |
D |
x,y,z |
1_555 |
7 |
3 |
6452 |
74.5 |
-2.1 |
0.229 |
0 |
0 |
0 |
0.021 |
14 |
24 |
|
[ME7]C:501 |
6 |
1 |
363 |
cf |
C |
x,y,z |
1_555 |
8 |
4 |
6402 |
71.8 |
-2.7 |
0.192 |
0 |
0 |
0 |
0.019 |
15 |
25 |
|
D |
7 |
4 |
6452 |
◊ |
C |
x-1,y,z |
1_455 |
8 |
4 |
6402 |
71.4 |
-1.0 |
0.370 |
0 |
0 |
0 |
0.000 |
26 |
|
B |
7 |
3 |
6461 |
◊ |
A |
x-1,y-1,z |
1_445 |
7 |
3 |
6461 |
64.7 |
-1.5 |
0.248 |
0 |
0 |
0 |
0.000 |
Average: |
68.0 |
-1.3 |
0.309 |
0 |
0 |
0 |
0.000 |
16 |
27 |
|
[ME7]C:501 |
6 |
1 |
363 |
c |
A |
x,y,z |
1_555 |
7 |
4 |
6461 |
70.7 |
-2.5 |
0.181 |
0 |
0 |
0 |
0.015 |
17 |
28 |
|
D |
6 |
3 |
6452 |
◊ |
B |
x-1,y,z |
1_455 |
6 |
4 |
6461 |
62.7 |
-0.1 |
0.593 |
0 |
0 |
0 |
0.000 |
29 |
|
B |
5 |
2 |
6461 |
◊ |
D |
x-1,y-1,z |
1_445 |
7 |
4 |
6452 |
62.4 |
-0.1 |
0.598 |
0 |
0 |
0 |
0.000 |
Average: |
62.5 |
-0.1 |
0.595 |
0 |
0 |
0 |
0.000 |
18 |
30 |
|
B |
7 |
2 |
6461 |
◊ |
[HEM]C:150 |
x-y,x,z+1/6 |
6_555 |
9 |
1 |
835 |
57.9 |
-0.6 |
0.928 |
1 |
0 |
0 |
0.003 |
31 |
|
[HEM]A:150 |
9 |
1 |
820 |
◊ |
D |
x-y+1,x+1,z+1/6 |
6_665 |
3 |
2 |
6452 |
37.2 |
0.1 |
0.970 |
1 |
0 |
0 |
0.003 |
Average: |
47.5 |
-0.3 |
0.949 |
1 |
0 |
0 |
0.003 |
19 |
32 |
|
B |
11 |
5 |
6461 |
◊ |
[ME7]D:501 |
x-1,y-1,z |
1_445 |
7 |
1 |
368 |
49.7 |
-0.6 |
0.668 |
0 |
0 |
0 |
0.000 |
20 |
33 |
|
[HEM]B:150 |
5 |
1 |
837 |
◊ |
A |
x,y-1,z |
1_545 |
10 |
3 |
6461 |
41.9 |
-2.2 |
0.538 |
0 |
0 |
0 |
0.004 |
21 |
34 |
|
A |
6 |
2 |
6461 |
c |
[ZN]C:108 |
x-y,x+1,z+1/6 |
6_565 |
1 |
1 |
98 |
37.6 |
-20.1 |
0.000 |
0 |
0 |
0 |
0.075 |
35 |
|
[ZN]C:108 |
1 |
1 |
98 |
c |
C |
x,y,z |
1_555 |
6 |
2 |
6402 |
36.7 |
-18.7 |
0.000 |
0 |
0 |
0 |
0.075 |
Average: |
37.2 |
-19.4 |
0.000 |
0 |
0 |
0 |
0.075 |
22 |
36 |
|
[ZN]A:107 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
6 |
2 |
6461 |
36.9 |
-23.5 |
0.000 |
0 |
0 |
0 |
0.275 |
37 |
|
[ZN]C:107 |
1 |
1 |
98 |
cf |
C |
x,y,z |
1_555 |
6 |
2 |
6402 |
35.6 |
-21.9 |
0.000 |
0 |
0 |
0 |
0.275 |
Average: |
36.3 |
-22.7 |
0.000 |
0 |
0 |
0 |
0.275 |
23 |
38 |
|
[HEM]A:150 |
4 |
1 |
820 |
◊ |
[HEM]D:150 |
x-y+1,x+1,z+1/6 |
6_665 |
4 |
1 |
818 |
34.9 |
-3.1 |
0.515 |
0 |
0 |
0 |
0.011 |
39 |
|
[HEM]B:150 |
6 |
1 |
837 |
◊ |
[HEM]C:150 |
x-y,x,z+1/6 |
6_555 |
5 |
1 |
835 |
31.7 |
-2.8 |
0.763 |
0 |
0 |
0 |
0.011 |
Average: |
33.3 |
-2.9 |
0.639 |
0 |
0 |
0 |
0.011 |
24 |
40 |
|
[ZN]C:107 |
1 |
1 |
98 |
◊ |
D |
x,y-1,z |
1_545 |
9 |
3 |
6452 |
34.1 |
-16.7 |
0.000 |
0 |
0 |
0 |
0.112 |
41 |
|
B |
8 |
3 |
6461 |
◊ |
[ZN]A:107 |
x,y-1,z |
1_545 |
1 |
1 |
98 |
32.6 |
-15.1 |
0.000 |
0 |
0 |
0 |
0.112 |
42 |
|
[ZN]A:109 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
6 |
3 |
6461 |
29.3 |
-14.0 |
0.000 |
0 |
0 |
0 |
0.112 |
43 |
|
[ZN]A:110 |
1 |
1 |
98 |
◊ |
C |
x-y,x+1,z+1/6 |
6_565 |
6 |
3 |
6402 |
27.9 |
-12.4 |
0.000 |
0 |
0 |
0 |
0.112 |
Average: |
31.0 |
-14.6 |
0.000 |
0 |
0 |
0 |
0.112 |
25 |
44 |
|
[ZN]B:500 |
1 |
1 |
98 |
cf |
B |
x,y,z |
1_555 |
5 |
2 |
6461 |
31.4 |
-17.0 |
0.000 |
0 |
0 |
0 |
0.322 |
45 |
|
[ZN]D:500 |
1 |
1 |
98 |
cf |
D |
x,y,z |
1_555 |
5 |
2 |
6452 |
30.9 |
-16.3 |
0.000 |
0 |
0 |
0 |
0.322 |
46 |
|
[ZN]C:500 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
5 |
2 |
6402 |
30.9 |
-16.2 |
0.000 |
0 |
0 |
0 |
0.322 |
47 |
|
[ZN]A:500 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
4 |
2 |
6461 |
30.7 |
-16.1 |
0.000 |
0 |
0 |
0 |
0.322 |
Average: |
31.0 |
-16.4 |
0.000 |
0 |
0 |
0 |
0.322 |
26 |
48 |
|
[ZN]D:500 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
5 |
3 |
6461 |
27.9 |
-11.6 |
0.000 |
0 |
0 |
0 |
0.222 |
49 |
|
[ZN]B:500 |
1 |
1 |
98 |
◊ |
D |
x,y,z |
1_555 |
6 |
3 |
6452 |
27.1 |
-11.4 |
0.000 |
0 |
0 |
0 |
0.222 |
50 |
|
[ZN]C:500 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
6 |
3 |
6461 |
26.9 |
-10.9 |
0.000 |
0 |
0 |
0 |
0.222 |
51 |
|
[ZN]A:500 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
6 |
3 |
6402 |
26.2 |
-10.6 |
0.000 |
0 |
0 |
0 |
0.222 |
Average: |
27.0 |
-11.1 |
0.000 |
0 |
0 |
0 |
0.222 |
27 |
52 |
|
[ZN]A:500 |
1 |
1 |
98 |
c |
D |
x,y,z |
1_555 |
5 |
3 |
6452 |
27.7 |
-12.4 |
0.000 |
0 |
0 |
0 |
0.171 |
53 |
|
[ZN]C:500 |
1 |
1 |
98 |
c |
B |
x,y,z |
1_555 |
5 |
3 |
6461 |
27.1 |
-12.0 |
0.000 |
0 |
0 |
0 |
0.171 |
54 |
|
[ZN]D:500 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
6 |
3 |
6461 |
26.4 |
-11.2 |
0.000 |
0 |
0 |
0 |
0.171 |
55 |
|
[ZN]B:500 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
5 |
3 |
6402 |
25.7 |
-10.8 |
0.000 |
0 |
0 |
0 |
0.171 |
Average: |
26.7 |
-11.6 |
0.000 |
0 |
0 |
0 |
0.171 |
28 |
56 |
|
[ZN]B:108 |
1 |
1 |
98 |
◊ |
[HEM]C:150 |
x-y,x,z+1/6 |
6_555 |
4 |
1 |
835 |
27.0 |
-9.9 |
0.000 |
0 |
0 |
0 |
0.073 |
57 |
|
[ZN]B:107 |
1 |
1 |
98 |
◊ |
[HEM]B:150 |
x,y,z |
1_555 |
5 |
1 |
837 |
25.8 |
-9.3 |
0.000 |
0 |
0 |
0 |
0.073 |
58 |
|
[ZN]A:108 |
1 |
1 |
98 |
◊ |
[HEM]A:150 |
x,y,z |
1_555 |
5 |
1 |
820 |
25.6 |
-10.2 |
0.000 |
0 |
0 |
0 |
0.073 |
59 |
|
[ZN]D:107 |
1 |
1 |
98 |
◊ |
[HEM]D:150 |
x,y,z |
1_555 |
3 |
1 |
818 |
22.9 |
-8.6 |
0.000 |
0 |
0 |
0 |
0.073 |
Average: |
25.4 |
-9.5 |
0.000 |
0 |
0 |
0 |
0.073 |
29 |
60 |
|
B |
3 |
1 |
6461 |
x |
B |
x-1,y-1,z |
1_445 |
5 |
2 |
6461 |
25.8 |
-0.6 |
0.374 |
0 |
0 |
0 |
0.000 |
61 |
|
D |
3 |
1 |
6452 |
x |
D |
x-1,y,z |
1_455 |
4 |
2 |
6452 |
21.2 |
-0.3 |
0.449 |
0 |
0 |
0 |
0.000 |
Average: |
23.5 |
-0.5 |
0.412 |
0 |
0 |
0 |
0.000 |
30 |
62 |
|
[ZN]B:108 |
1 |
1 |
98 |
◊ |
C |
x-y,x,z+1/6 |
6_555 |
3 |
1 |
6402 |
24.4 |
-9.4 |
0.000 |
0 |
0 |
0 |
0.068 |
63 |
|
[ZN]D:107 |
1 |
1 |
98 |
◊ |
D |
x,y,z |
1_555 |
4 |
2 |
6452 |
22.0 |
-9.1 |
0.000 |
0 |
0 |
0 |
0.068 |
64 |
|
[ZN]A:108 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
4 |
1 |
6461 |
21.4 |
-8.3 |
0.000 |
0 |
0 |
0 |
0.068 |
65 |
|
[ZN]B:107 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
4 |
2 |
6461 |
20.8 |
-8.4 |
0.000 |
0 |
0 |
0 |
0.068 |
Average: |
22.1 |
-8.8 |
0.000 |
0 |
0 |
0 |
0.068 |
31 |
66 |
|
[ZN]B:107 |
1 |
1 |
98 |
f |
A |
x,y-1,z |
1_545 |
8 |
3 |
6461 |
24.2 |
-9.9 |
0.000 |
0 |
0 |
0 |
0.116 |
67 |
|
C |
8 |
3 |
6402 |
f |
[ZN]D:107 |
x,y-1,z |
1_545 |
1 |
1 |
98 |
23.8 |
-9.3 |
0.000 |
0 |
0 |
0 |
0.116 |
Average: |
24.0 |
-9.6 |
0.000 |
0 |
0 |
0 |
0.116 |
32 |
68 |
|
[ZN]A:108 |
1 |
1 |
98 |
◊ |
[HEM]D:150 |
x-y+1,x+1,z+1/6 |
6_665 |
3 |
1 |
818 |
24.1 |
-9.1 |
0.000 |
0 |
0 |
0 |
0.029 |
69 |
|
[ZN]B:108 |
1 |
1 |
98 |
◊ |
[HEM]B:150 |
x,y,z |
1_555 |
4 |
1 |
837 |
16.6 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.029 |
Average: |
20.3 |
-7.5 |
0.000 |
0 |
0 |
0 |
0.029 |
33 |
70 |
|
C |
3 |
1 |
6402 |
x |
C |
x-1,y,z |
1_455 |
3 |
1 |
6402 |
23.3 |
0.2 |
0.560 |
0 |
0 |
0 |
0.000 |
71 |
|
A |
2 |
1 |
6461 |
x |
A |
x-1,y-1,z |
1_445 |
3 |
1 |
6461 |
20.8 |
-0.4 |
0.374 |
0 |
0 |
0 |
0.000 |
Average: |
22.1 |
-0.1 |
0.467 |
0 |
0 |
0 |
0.000 |
34 |
72 |
|
[ZN]A:110 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
6461 |
22.0 |
-8.0 |
0.000 |
0 |
0 |
0 |
0.031 |
73 |
|
[ZN]A:109 |
1 |
1 |
98 |
◊ |
C |
x-y,x+1,z+1/6 |
6_565 |
3 |
1 |
6402 |
21.5 |
-8.3 |
0.000 |
0 |
0 |
0 |
0.031 |
Average: |
21.8 |
-8.1 |
0.000 |
0 |
0 |
0 |
0.031 |
35 |
74 |
|
[HEM]A:150 |
3 |
1 |
820 |
◊ |
C |
x-y,x+1,z+1/6 |
6_565 |
3 |
1 |
6402 |
18.5 |
-0.9 |
0.645 |
0 |
0 |
0 |
0.003 |
75 |
|
A |
2 |
1 |
6461 |
◊ |
[HEM]C:150 |
x-y,x+1,z+1/6 |
6_565 |
3 |
1 |
835 |
16.2 |
-0.6 |
0.728 |
0 |
0 |
0 |
0.003 |
Average: |
17.3 |
-0.8 |
0.686 |
0 |
0 |
0 |
0.003 |
36 |
76 |
|
A |
3 |
1 |
6461 |
◊ |
[HEM]D:150 |
x-y+1,x+1,z+1/6 |
6_665 |
3 |
1 |
818 |
16.1 |
-0.8 |
0.642 |
0 |
0 |
0 |
0.002 |
77 |
|
[HEM]B:150 |
3 |
1 |
837 |
◊ |
C |
x-y,x,z+1/6 |
6_555 |
3 |
1 |
6402 |
13.5 |
-0.2 |
0.818 |
0 |
0 |
0 |
0.002 |
Average: |
14.8 |
-0.5 |
0.730 |
0 |
0 |
0 |
0.002 |
37 |
78 |
|
C |
3 |
2 |
6402 |
◊ |
[HEM]D:150 |
x,y-1,z |
1_545 |
3 |
1 |
818 |
15.6 |
-0.7 |
0.695 |
0 |
0 |
0 |
0.001 |
38 |
79 |
|
[HEM]B:150 |
2 |
1 |
837 |
◊ |
[ZN]A:109 |
x,y-1,z |
1_545 |
1 |
1 |
98 |
14.3 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.026 |
80 |
|
[HEM]A:150 |
3 |
1 |
820 |
◊ |
[ZN]D:107 |
x-y+1,x+1,z+1/6 |
6_665 |
1 |
1 |
98 |
11.9 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.026 |
81 |
|
[ZN]A:110 |
1 |
1 |
98 |
◊ |
[HEM]D:150 |
x-y+1,x+1,z+1/6 |
6_665 |
3 |
1 |
818 |
10.1 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.026 |
Average: |
12.1 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.026 |
39 |
82 |
|
[ZN]B:108 |
1 |
1 |
98 |
◊ |
A |
x,y-1,z |
1_545 |
4 |
2 |
6461 |
14.1 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.016 |
83 |
|
[ZN]A:108 |
1 |
1 |
98 |
◊ |
C |
x-y,x+1,z+1/6 |
6_565 |
4 |
2 |
6402 |
10.5 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.016 |
Average: |
12.3 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.016 |
40 |
84 |
|
[ZN]B:107 |
1 |
1 |
98 |
◊ |
[HEM]C:150 |
x-y,x,z+1/6 |
6_555 |
3 |
1 |
835 |
13.6 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.018 |
85 |
|
[ZN]A:110 |
1 |
1 |
98 |
◊ |
[HEM]A:150 |
x,y,z |
1_555 |
3 |
1 |
820 |
10.1 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.018 |
86 |
|
[ZN]A:109 |
1 |
1 |
98 |
◊ |
[HEM]C:150 |
x-y,x+1,z+1/6 |
6_565 |
1 |
1 |
835 |
3.4 |
-1.3 |
0.000 |
0 |
0 |
0 |
0.018 |
Average: |
9.0 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.018 |
41 |
87 |
|
[ZN]B:108 |
1 |
1 |
98 |
f |
[ZN]A:109 |
x,y-1,z |
1_545 |
1 |
1 |
98 |
11.7 |
-9.3 |
0.000 |
0 |
0 |
0 |
0.100 |
42 |
88 |
|
[ZN]A:110 |
1 |
1 |
98 |
f |
[ZN]A:108 |
x,y,z |
1_555 |
1 |
1 |
98 |
10.9 |
-8.7 |
0.000 |
0 |
0 |
0 |
0.100 |
43 |
89 |
|
[ZN]B:108 |
1 |
1 |
98 |
◊ |
[ZN]B:107 |
x,y,z |
1_555 |
1 |
1 |
98 |
10.6 |
-8.5 |
0.000 |
0 |
0 |
0 |
0.016 |
44 |
90 |
|
[ZN]A:110 |
1 |
1 |
98 |
◊ |
[ZN]D:107 |
x-y+1,x+1,z+1/6 |
6_665 |
1 |
1 |
98 |
10.1 |
-8.1 |
0.000 |
0 |
0 |
0 |
0.016 |
45 |
91 |
|
[ZN]A:108 |
1 |
1 |
98 |
◊ |
[ZN]D:107 |
x-y+1,x+1,z+1/6 |
6_665 |
1 |
1 |
98 |
9.9 |
-7.9 |
0.000 |
0 |
0 |
0 |
0.015 |
46 |
92 |
|
[ZN]B:107 |
1 |
1 |
98 |
◊ |
[ZN]A:109 |
x,y-1,z |
1_545 |
1 |
1 |
98 |
9.0 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.014 |
47 |
93 |
|
[ZN]A:110 |
1 |
1 |
98 |
◊ |
D |
x-y+1,x+1,z+1/6 |
6_665 |
4 |
2 |
6452 |
8.3 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.016 |
94 |
|
A |
3 |
1 |
6461 |
◊ |
[ZN]D:107 |
x-y+1,x+1,z+1/6 |
6_665 |
1 |
1 |
98 |
7.4 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.016 |
95 |
|
[ZN]B:108 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
6461 |
6.4 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.016 |
96 |
|
B |
2 |
2 |
6461 |
◊ |
[ZN]A:109 |
x,y-1,z |
1_545 |
1 |
1 |
98 |
3.1 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.016 |
Average: |
6.3 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.016 |
48 |
97 |
|
[ZN]A:108 |
1 |
1 |
98 |
◊ |
D |
x-y+1,x+1,z+1/6 |
6_665 |
4 |
2 |
6452 |
8.2 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.005 |
49 |
98 |
|
[ZN]B:107 |
1 |
1 |
98 |
◊ |
C |
x-y,x,z+1/6 |
6_555 |
3 |
1 |
6402 |
7.9 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.004 |
50 |
99 |
|
B |
1 |
1 |
6461 |
◊ |
D |
x-y+1,x,z+1/6 |
6_655 |
1 |
1 |
6452 |
1.1 |
0.1 |
0.772 |
0 |
0 |
0 |
0.000 |
|