## |
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 |
|
A |
829 |
142 |
363442 |
◊ |
D |
x,y,z |
1_555 |
743 |
166 |
18354 |
7151.8 |
-130.7 |
0.673 |
163 |
0 |
0 |
0.115 |
2 |
|
A |
793 |
152 |
363442 |
◊ |
N |
x,y,z |
1_555 |
634 |
137 |
12831 |
6675.4 |
-128.1 |
0.639 |
135 |
0 |
0 |
0.211 |
3 |
|
A |
733 |
117 |
363442 |
◊ |
C |
x,y,z |
1_555 |
607 |
132 |
14213 |
6136.2 |
-112.5 |
0.577 |
132 |
0 |
0 |
0.209 |
4 |
|
A |
651 |
110 |
363442 |
◊ |
E |
x,y,z |
1_555 |
519 |
131 |
14364 |
5424.7 |
-91.4 |
0.631 |
108 |
0 |
0 |
0.103 |
5 |
|
A |
487 |
97 |
363442 |
◊ |
Q |
x,y,z |
1_555 |
392 |
95 |
10687 |
4202.8 |
-78.4 |
0.620 |
106 |
0 |
0 |
0.104 |
6 |
|
A |
503 |
95 |
363442 |
◊ |
Z |
x,y,z |
1_555 |
380 |
86 |
10451 |
4048.8 |
-70.3 |
0.777 |
84 |
0 |
0 |
0.092 |
7 |
|
A |
505 |
108 |
363442 |
◊ |
M |
x,y,z |
1_555 |
373 |
82 |
11351 |
4012.2 |
-67.2 |
0.606 |
90 |
0 |
0 |
0.097 |
8 |
|
A |
383 |
71 |
363442 |
◊ |
S |
x,y,z |
1_555 |
322 |
82 |
8441 |
3108.5 |
-51.2 |
0.607 |
71 |
0 |
0 |
0.083 |
9 |
|
A |
379 |
60 |
363442 |
◊ |
4 |
x,y,z |
1_555 |
324 |
69 |
7763 |
3080.1 |
-63.7 |
0.294 |
52 |
0 |
0 |
0.084 |
10 |
|
A |
368 |
74 |
363442 |
◊ |
2 |
x,y,z |
1_555 |
261 |
54 |
4847 |
2832.9 |
-54.7 |
0.690 |
58 |
0 |
0 |
0.089 |
11 |
|
A |
339 |
57 |
363442 |
◊ |
U |
x,y,z |
1_555 |
281 |
68 |
8054 |
2780.1 |
-43.0 |
0.743 |
54 |
0 |
0 |
0.077 |
12 |
|
A |
315 |
58 |
363442 |
◊ |
J |
x,y,z |
1_555 |
271 |
62 |
8644 |
2588.6 |
-52.9 |
0.471 |
43 |
0 |
0 |
0.083 |
13 |
|
A |
289 |
60 |
363442 |
◊ |
R |
x,y,z |
1_555 |
245 |
59 |
6624 |
2459.1 |
-54.3 |
0.474 |
60 |
0 |
0 |
0.084 |
14 |
|
A |
275 |
49 |
363442 |
◊ |
K |
x,y,z |
1_555 |
252 |
70 |
8471 |
2430.3 |
-34.5 |
0.704 |
46 |
0 |
0 |
0.065 |
15 |
|
A |
317 |
52 |
363442 |
◊ |
3 |
x,y,z |
1_555 |
221 |
43 |
5011 |
2366.9 |
-31.1 |
0.646 |
32 |
0 |
0 |
0.058 |
16 |
|
B |
271 |
42 |
19906 |
◊ |
O |
x,y,z |
1_555 |
237 |
64 |
10637 |
2302.4 |
-33.8 |
0.927 |
58 |
0 |
0 |
0.859 |
17 |
|
A |
237 |
40 |
363442 |
◊ |
X |
x,y,z |
1_555 |
206 |
53 |
8122 |
2025.1 |
-37.9 |
0.331 |
38 |
0 |
0 |
0.070 |
18 |
|
A |
235 |
46 |
363442 |
◊ |
L |
x,y,z |
1_555 |
198 |
49 |
7297 |
1949.8 |
-29.3 |
0.770 |
49 |
0 |
0 |
0.065 |
19 |
|
A |
214 |
31 |
363442 |
◊ |
P |
x,y,z |
1_555 |
184 |
51 |
6514 |
1842.9 |
-24.3 |
0.761 |
42 |
0 |
0 |
0.055 |
20 |
|
A |
207 |
40 |
363442 |
◊ |
Y |
x,y,z |
1_555 |
164 |
37 |
5133 |
1678.0 |
-25.7 |
0.689 |
31 |
0 |
0 |
0.050 |
21 |
|
A |
202 |
36 |
363442 |
◊ |
G |
x,y,z |
1_555 |
163 |
44 |
10202 |
1649.2 |
-22.7 |
0.429 |
23 |
0 |
0 |
0.042 |
22 |
|
A |
170 |
36 |
363442 |
◊ |
1 |
x,y,z |
1_555 |
124 |
38 |
5704 |
1306.2 |
-21.5 |
0.876 |
22 |
0 |
0 |
0.040 |
23 |
|
B |
143 |
20 |
19906 |
◊ |
F |
x,y,z |
1_555 |
129 |
35 |
9725 |
1291.8 |
-19.5 |
0.722 |
16 |
0 |
0 |
0.034 |
24 |
|
A |
127 |
18 |
363442 |
◊ |
O |
x,y,z |
1_555 |
115 |
31 |
10637 |
1104.3 |
-8.7 |
0.343 |
9 |
0 |
0 |
0.015 |
25 |
|
A |
118 |
19 |
363442 |
◊ |
F |
x,y,z |
1_555 |
124 |
41 |
9725 |
1089.1 |
-11.1 |
0.905 |
21 |
0 |
0 |
0.026 |
26 |
|
B |
128 |
25 |
19906 |
◊ |
A |
x,y,z |
1_555 |
149 |
35 |
363442 |
1087.1 |
-26.2 |
0.964 |
13 |
0 |
0 |
0.041 |
27 |
|
1 |
110 |
30 |
5704 |
◊ |
C |
x,y,z |
1_555 |
114 |
36 |
14213 |
1046.1 |
-17.5 |
0.076 |
13 |
2 |
0 |
0.571 |
28 |
|
A |
116 |
21 |
363442 |
◊ |
W |
x,y,z |
1_555 |
110 |
28 |
4566 |
991.5 |
-13.7 |
0.752 |
20 |
0 |
0 |
0.028 |
29 |
|
A |
125 |
27 |
363442 |
◊ |
T |
x,y,z |
1_555 |
101 |
32 |
5192 |
984.9 |
-16.5 |
0.750 |
23 |
0 |
0 |
0.034 |
30 |
|
N |
72 |
21 |
12831 |
◊ |
H |
x,y,z |
1_555 |
70 |
18 |
6135 |
698.0 |
-7.4 |
0.085 |
8 |
4 |
0 |
0.013 |
31 |
|
A |
89 |
16 |
363442 |
◊ |
V |
x,y,z |
1_555 |
71 |
19 |
3949 |
687.5 |
-10.0 |
0.790 |
7 |
0 |
0 |
0.016 |
32 |
|
A |
69 |
10 |
363442 |
◊ |
H |
x,y,z |
1_555 |
56 |
20 |
6135 |
617.6 |
-12.9 |
0.520 |
16 |
0 |
0 |
0.024 |
33 |
|
B |
68 |
11 |
19906 |
◊ |
X |
x,y,z |
1_555 |
53 |
18 |
8122 |
547.6 |
-8.1 |
0.715 |
7 |
0 |
0 |
0.014 |
34 |
|
V |
54 |
15 |
3949 |
◊ |
L |
x,y,z |
1_555 |
50 |
16 |
7297 |
518.9 |
-7.7 |
0.062 |
6 |
1 |
0 |
0.011 |
35 |
|
R |
49 |
13 |
6624 |
◊ |
O |
x,y,z |
1_555 |
63 |
18 |
10637 |
511.3 |
-7.7 |
0.078 |
2 |
0 |
0 |
0.008 |
36 |
|
[SPR]A:9001 |
38 |
1 |
1114 |
cf |
A |
x,y,z |
1_555 |
75 |
14 |
363442 |
487.9 |
-1.6 |
0.900 |
2 |
0 |
0 |
0.003 |
37 |
|
A |
53 |
9 |
363442 |
◊ |
I |
x,y,z |
1_555 |
47 |
13 |
2741 |
465.8 |
-6.4 |
0.754 |
8 |
0 |
0 |
0.011 |
38 |
|
W |
34 |
10 |
4566 |
◊ |
T |
x,y,z |
1_555 |
39 |
10 |
5192 |
341.5 |
-4.6 |
0.150 |
0 |
1 |
0 |
0.006 |
39 |
|
L |
27 |
10 |
7297 |
◊ |
D |
x,y,z |
1_555 |
35 |
11 |
18354 |
281.3 |
-1.5 |
0.324 |
1 |
0 |
0 |
0.000 |
40 |
|
K |
28 |
6 |
8471 |
◊ |
G |
x,y,z |
1_555 |
30 |
8 |
10202 |
268.7 |
-3.9 |
0.091 |
2 |
0 |
0 |
0.006 |
41 |
|
B |
33 |
7 |
19906 |
◊ |
R |
x,y,z |
1_555 |
25 |
5 |
6624 |
263.3 |
-2.9 |
0.754 |
5 |
0 |
0 |
0.005 |
42 |
|
3 |
29 |
7 |
5011 |
◊ |
T |
x,y,z |
1_555 |
33 |
9 |
5192 |
253.9 |
-3.1 |
0.198 |
1 |
0 |
0 |
0.005 |
43 |
|
L |
26 |
11 |
7297 |
◊ |
L |
-x+1,y,-z+1/2 |
3_655 |
26 |
11 |
7297 |
241.8 |
-0.6 |
0.407 |
0 |
0 |
0 |
0.000 |
44 |
|
K |
27 |
9 |
8471 |
◊ |
D |
x,y,z |
1_555 |
25 |
8 |
18354 |
234.7 |
1.0 |
0.588 |
7 |
1 |
0 |
0.000 |
45 |
|
O |
32 |
8 |
10637 |
◊ |
F |
x,y,z |
1_555 |
20 |
5 |
9725 |
217.7 |
0.6 |
0.661 |
2 |
0 |
0 |
0.000 |
46 |
|
P |
16 |
4 |
6514 |
◊ |
E |
x,y,z |
1_555 |
19 |
5 |
14364 |
178.1 |
-1.4 |
0.253 |
0 |
0 |
0 |
0.000 |
47 |
|
V |
15 |
4 |
3949 |
◊ |
D |
x,y,z |
1_555 |
19 |
6 |
18354 |
176.3 |
-1.2 |
0.356 |
4 |
0 |
0 |
0.000 |
48 |
|
3 |
19 |
5 |
5011 |
◊ |
2 |
x,y,z |
1_555 |
18 |
6 |
4847 |
171.5 |
-3.1 |
0.201 |
0 |
0 |
0 |
0.003 |
49 |
|
2 |
15 |
4 |
4847 |
◊ |
E |
x,y,z |
1_555 |
20 |
6 |
14364 |
158.0 |
-1.1 |
0.392 |
3 |
3 |
0 |
0.002 |
50 |
|
N |
24 |
6 |
12831 |
◊ |
4 |
x,y,z |
1_555 |
11 |
4 |
7763 |
156.0 |
-3.3 |
0.083 |
1 |
0 |
0 |
0.002 |
51 |
|
B |
25 |
3 |
19906 |
◊ |
A |
x-1/2,y-1/2,z |
5_445 |
19 |
1 |
363442 |
132.9 |
1.2 |
0.949 |
0 |
0 |
0 |
0.000 |
52 |
|
[K]A:8602 |
1 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
24 |
11 |
363442 |
131.8 |
-87.2 |
0.000 |
0 |
0 |
0 |
0.111 |
53 |
|
A |
13 |
2 |
363442 |
x |
A |
x-1/2,y-1/2,z |
5_445 |
19 |
4 |
363442 |
130.8 |
-4.7 |
0.508 |
1 |
0 |
0 |
0.000 |
54 |
|
A |
19 |
5 |
363442 |
◊ |
W |
x,-y+1,-z |
4_565 |
15 |
6 |
4566 |
121.7 |
-2.5 |
0.488 |
1 |
0 |
0 |
0.000 |
55 |
|
[K]A:8601 |
1 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
14 |
8 |
363442 |
120.8 |
-105.7 |
0.000 |
0 |
0 |
0 |
0.134 |
56 |
|
[K]A:8603 |
1 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
20 |
4 |
363442 |
120.8 |
-69.0 |
0.000 |
0 |
0 |
0 |
0.088 |
57 |
|
P |
15 |
6 |
6514 |
◊ |
M |
x,y,z |
1_555 |
11 |
4 |
11351 |
111.1 |
-0.0 |
0.417 |
0 |
0 |
0 |
0.000 |
58 |
|
B |
16 |
4 |
19906 |
◊ |
J |
x,y,z |
1_555 |
16 |
5 |
8644 |
109.7 |
0.3 |
0.768 |
0 |
0 |
0 |
0.000 |
59 |
|
A |
16 |
3 |
363442 |
◊ |
A |
-x+1,y,-z+1/2 |
3_655 |
17 |
3 |
363442 |
99.7 |
1.5 |
0.945 |
0 |
0 |
0 |
0.000 |
60 |
|
A |
17 |
7 |
363442 |
◊ |
G |
-x,y,-z+1/2 |
3_555 |
13 |
5 |
10202 |
90.9 |
-0.6 |
0.753 |
0 |
0 |
0 |
0.000 |
61 |
|
[CL]A:8505 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
21 |
7 |
363442 |
89.5 |
-11.0 |
0.000 |
0 |
0 |
0 |
0.014 |
62 |
|
U |
16 |
5 |
8054 |
◊ |
E |
x,y,z |
1_555 |
12 |
5 |
14364 |
87.3 |
-1.0 |
0.316 |
0 |
0 |
0 |
0.000 |
63 |
|
O |
11 |
5 |
10637 |
◊ |
A |
x-1/2,y-1/2,z |
5_445 |
14 |
2 |
363442 |
86.0 |
-1.7 |
0.511 |
0 |
0 |
0 |
0.000 |
64 |
|
[CL]S:8506 |
1 |
1 |
125 |
f |
S |
x,y,z |
1_555 |
9 |
4 |
8441 |
72.4 |
-8.9 |
0.000 |
0 |
0 |
0 |
0.100 |
65 |
|
[CL]4:8504 |
1 |
1 |
125 |
f |
4 |
x,y,z |
1_555 |
12 |
6 |
7763 |
69.4 |
-10.9 |
0.000 |
0 |
0 |
0 |
0.100 |
66 |
|
[CL]A:8515 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
14 |
6 |
363442 |
67.9 |
-9.7 |
0.000 |
0 |
0 |
0 |
0.012 |
67 |
|
[CD]P:8405 |
1 |
1 |
112 |
f |
P |
x,y,z |
1_555 |
14 |
6 |
6514 |
67.7 |
-7.3 |
0.000 |
0 |
0 |
0 |
0.049 |
68 |
|
[CL]A:8513 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
363442 |
66.7 |
-9.8 |
0.000 |
0 |
0 |
0 |
0.012 |
69 |
|
[SPR]A:9001 |
8 |
1 |
1114 |
◊ |
E |
x,y,z |
1_555 |
8 |
3 |
14364 |
65.4 |
-0.6 |
0.583 |
0 |
0 |
0 |
0.000 |
70 |
|
[CL]C:8509 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
8 |
4 |
14213 |
63.8 |
-9.2 |
0.000 |
0 |
0 |
0 |
0.224 |
71 |
|
[CL]K:8502 |
1 |
1 |
125 |
f |
K |
x,y,z |
1_555 |
10 |
4 |
8471 |
63.8 |
-10.0 |
0.000 |
0 |
0 |
0 |
0.038 |
72 |
|
[CL]Z:8520 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
15 |
5 |
363442 |
63.5 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.008 |
73 |
|
[CL]A:8514 |
1 |
1 |
125 |
f |
M |
x,y,z |
1_555 |
12 |
4 |
11351 |
63.4 |
-7.1 |
0.000 |
0 |
0 |
0 |
0.047 |
74 |
|
[CL]N:8518 |
1 |
1 |
125 |
f |
N |
x,y,z |
1_555 |
7 |
6 |
12831 |
63.3 |
-12.4 |
0.000 |
0 |
0 |
0 |
0.100 |
75 |
|
[CL]K:8501 |
1 |
1 |
125 |
f |
K |
x,y,z |
1_555 |
13 |
5 |
8471 |
63.2 |
-9.0 |
0.000 |
0 |
0 |
0 |
0.034 |
76 |
|
[CL]A:8522 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
10 |
3 |
363442 |
62.2 |
-8.9 |
0.000 |
0 |
0 |
0 |
0.011 |
77 |
|
[CL]P:8508 |
1 |
1 |
125 |
f |
P |
x,y,z |
1_555 |
10 |
4 |
6514 |
62.1 |
-7.5 |
0.000 |
0 |
0 |
0 |
0.051 |
78 |
|
[CL]O:8507 |
1 |
1 |
125 |
f |
O |
x,y,z |
1_555 |
11 |
4 |
10637 |
60.6 |
-9.1 |
0.000 |
0 |
0 |
0 |
0.131 |
79 |
|
[CL]A:8503 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
363442 |
59.9 |
-7.7 |
0.000 |
0 |
0 |
0 |
0.010 |
80 |
|
[CL]D:8519 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
10 |
5 |
18354 |
58.8 |
-8.6 |
0.000 |
0 |
0 |
0 |
0.100 |
81 |
|
[CL]M:8510 |
1 |
1 |
125 |
f |
M |
x,y,z |
1_555 |
12 |
4 |
11351 |
58.5 |
-8.1 |
0.000 |
0 |
0 |
0 |
0.053 |
82 |
|
[CL]R:8511 |
1 |
1 |
125 |
f |
R |
x,y,z |
1_555 |
10 |
6 |
6624 |
57.7 |
-9.3 |
0.000 |
0 |
0 |
0 |
0.100 |
83 |
|
[CL]A:8517 |
1 |
1 |
125 |
f |
Z |
x,y,z |
1_555 |
5 |
3 |
10451 |
56.1 |
-6.6 |
0.000 |
0 |
0 |
0 |
0.100 |
84 |
|
[CD]V:8401 |
1 |
1 |
112 |
f |
V |
x,y,z |
1_555 |
1 |
1 |
3949 |
55.9 |
-8.9 |
0.000 |
0 |
0 |
0 |
0.100 |
85 |
|
Z |
6 |
1 |
10451 |
◊ |
M |
x,y,z |
1_555 |
8 |
3 |
11351 |
54.9 |
0.4 |
0.614 |
0 |
0 |
0 |
0.000 |
86 |
|
B |
7 |
2 |
19906 |
◊ |
D |
-x+1/2,y-1/2,-z+1/2 |
7_545 |
4 |
2 |
18354 |
54.5 |
1.0 |
0.797 |
2 |
0 |
0 |
0.000 |
87 |
|
[CL]A:8516 |
1 |
1 |
125 |
◊ |
K |
x,y,z |
1_555 |
8 |
3 |
8471 |
54.1 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.007 |
88 |
|
[CD]1:8403 |
1 |
1 |
112 |
f |
1 |
x,y,z |
1_555 |
5 |
4 |
5704 |
53.5 |
-8.5 |
0.000 |
0 |
0 |
0 |
0.205 |
89 |
|
[CL]K:8521 |
1 |
1 |
125 |
f |
K |
x,y,z |
1_555 |
12 |
6 |
8471 |
53.1 |
-7.1 |
0.000 |
0 |
0 |
0 |
0.027 |
90 |
|
[CL]A:8516 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
8 |
3 |
363442 |
51.6 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.008 |
91 |
|
X |
7 |
1 |
8122 |
◊ |
A |
x-1/2,y-1/2,z |
5_445 |
10 |
1 |
363442 |
50.6 |
-0.4 |
0.344 |
0 |
0 |
0 |
0.000 |
92 |
|
[CL]A:8512 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
9 |
4 |
363442 |
49.4 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.007 |
93 |
|
[CL]A:8517 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
10 |
3 |
363442 |
49.3 |
-6.5 |
0.000 |
0 |
0 |
0 |
0.006 |
94 |
|
[CL]A:8512 |
1 |
1 |
125 |
f |
L |
x,y,z |
1_555 |
10 |
4 |
7297 |
49.1 |
-6.5 |
0.000 |
0 |
0 |
0 |
0.100 |
95 |
|
[K]A:8602 |
1 |
1 |
216 |
◊ |
N |
x,y,z |
1_555 |
6 |
1 |
12831 |
46.0 |
-24.9 |
0.000 |
0 |
0 |
0 |
0.028 |
96 |
|
[CL]Z:8520 |
1 |
1 |
125 |
◊ |
Z |
x,y,z |
1_555 |
5 |
3 |
10451 |
45.6 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.004 |
97 |
|
F |
6 |
1 |
9725 |
◊ |
D |
-x+1/2,y-1/2,-z+1/2 |
7_545 |
3 |
1 |
18354 |
43.0 |
-0.3 |
0.505 |
0 |
0 |
0 |
0.000 |
98 |
|
[CL]P:8508 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
10 |
2 |
363442 |
41.5 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.006 |
99 |
|
[CL]A:8514 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
10 |
2 |
363442 |
41.1 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.005 |
100 |
|
[CL]D:8519 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
363442 |
38.2 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.003 |
101 |
|
[CL]M:8510 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
6 |
2 |
363442 |
36.1 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.004 |
102 |
|
[CL]K:8521 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
7 |
2 |
363442 |
32.4 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.005 |
103 |
|
[CL]R:8511 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
5 |
1 |
363442 |
32.3 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.004 |
104 |
|
4 |
6 |
1 |
7763 |
◊ |
M |
x,y,z |
1_555 |
2 |
1 |
11351 |
29.9 |
0.7 |
0.578 |
0 |
0 |
0 |
0.000 |
105 |
|
[CL]O:8507 |
1 |
1 |
125 |
◊ |
F |
x,y,z |
1_555 |
3 |
1 |
9725 |
28.2 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.003 |
106 |
|
[CL]A:8503 |
1 |
1 |
125 |
◊ |
3 |
x,y,z |
1_555 |
2 |
1 |
5011 |
26.2 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.004 |
107 |
|
[CL]K:8501 |
1 |
1 |
125 |
◊ |
G |
x,y,z |
1_555 |
2 |
1 |
10202 |
25.7 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.004 |
108 |
|
[CL]C:8509 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
363442 |
24.0 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.004 |
109 |
|
[CL]A:8522 |
1 |
1 |
125 |
◊ |
X |
x,y,z |
1_555 |
1 |
1 |
8122 |
16.5 |
-1.3 |
0.000 |
0 |
0 |
0 |
0.002 |
110 |
|
[CL]S:8506 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
7 |
2 |
363442 |
16.0 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.002 |
111 |
|
[CL]A:8513 |
1 |
1 |
125 |
◊ |
Z |
x,y,z |
1_555 |
1 |
1 |
10451 |
9.9 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.000 |
112 |
|
[CD]1:8403 |
1 |
1 |
112 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
363442 |
6.5 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.000 |
113 |
|
[SPR]A:9001 |
1 |
1 |
1114 |
◊ |
S |
x,y,z |
1_555 |
1 |
1 |
8441 |
5.5 |
-0.2 |
0.380 |
0 |
0 |
0 |
0.000 |
114 |
|
[CL]O:8507 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
2 |
2 |
19906 |
4.6 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.010 |
115 |
|
[CL]Z:8520 |
1 |
1 |
125 |
f |
[CL]A:8513 |
x,y,z |
1_555 |
1 |
1 |
125 |
3.6 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.000 |
116 |
|
[CL]K:8501 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
363442 |
2.8 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.000 |
117 |
|
I |
2 |
1 |
2741 |
◊ |
A |
-x+1/2,y-1/2,-z+1/2 |
7_545 |
2 |
1 |
363442 |
2.3 |
-0.0 |
0.579 |
0 |
0 |
0 |
0.000 |
118 |
|
[CD]P:8405 |
1 |
1 |
112 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
363442 |
1.7 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.000 |
|