| ## |
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 |
|
0 |
820 |
143 |
364929 |
◊ |
B |
x,y,z |
1_555 |
742 |
166 |
18404 |
7172.0 |
-136.2 |
0.597 |
164 |
0 |
0 |
0.129 |
2 |
|
0 |
763 |
140 |
364929 |
◊ |
M |
x,y,z |
1_555 |
615 |
135 |
12373 |
6319.3 |
-122.9 |
0.533 |
138 |
0 |
0 |
0.210 |
3 |
|
0 |
737 |
118 |
364929 |
◊ |
A |
x,y,z |
1_555 |
607 |
131 |
14279 |
6174.2 |
-117.4 |
0.543 |
135 |
0 |
0 |
0.232 |
4 |
|
0 |
644 |
109 |
364929 |
◊ |
C |
x,y,z |
1_555 |
521 |
129 |
14435 |
5426.0 |
-87.1 |
0.717 |
107 |
0 |
0 |
0.103 |
5 |
|
0 |
484 |
96 |
364929 |
◊ |
P |
x,y,z |
1_555 |
395 |
94 |
10759 |
4238.7 |
-80.9 |
0.619 |
110 |
0 |
0 |
0.111 |
6 |
|
0 |
509 |
107 |
364929 |
◊ |
L |
x,y,z |
1_555 |
374 |
81 |
11399 |
4060.3 |
-68.8 |
0.571 |
90 |
0 |
0 |
0.102 |
7 |
|
0 |
490 |
97 |
364929 |
◊ |
Y |
x,y,z |
1_555 |
380 |
87 |
10502 |
4045.3 |
-73.5 |
0.725 |
85 |
0 |
0 |
0.098 |
8 |
|
0 |
389 |
71 |
364929 |
◊ |
R |
x,y,z |
1_555 |
333 |
82 |
8487 |
3125.5 |
-54.6 |
0.536 |
68 |
0 |
0 |
0.089 |
9 |
|
0 |
371 |
59 |
364929 |
◊ |
3 |
x,y,z |
1_555 |
320 |
68 |
7807 |
3048.7 |
-62.9 |
0.237 |
56 |
0 |
0 |
0.088 |
10 |
|
0 |
368 |
73 |
364929 |
◊ |
1 |
x,y,z |
1_555 |
263 |
54 |
4877 |
2846.4 |
-55.7 |
0.661 |
54 |
0 |
0 |
0.092 |
11 |
|
0 |
343 |
59 |
364929 |
◊ |
T |
x,y,z |
1_555 |
276 |
68 |
8108 |
2786.8 |
-39.5 |
0.837 |
57 |
0 |
0 |
0.079 |
12 |
|
0 |
322 |
57 |
364929 |
◊ |
H |
x,y,z |
1_555 |
277 |
62 |
9487 |
2667.2 |
-49.6 |
0.423 |
52 |
0 |
0 |
0.088 |
13 |
|
0 |
292 |
60 |
364929 |
◊ |
Q |
x,y,z |
1_555 |
245 |
60 |
6654 |
2469.1 |
-54.8 |
0.461 |
63 |
0 |
0 |
0.090 |
14 |
|
0 |
274 |
49 |
364929 |
◊ |
J |
x,y,z |
1_555 |
251 |
68 |
8530 |
2434.9 |
-35.6 |
0.651 |
47 |
0 |
0 |
0.070 |
15 |
|
0 |
331 |
54 |
364929 |
◊ |
2 |
x,y,z |
1_555 |
226 |
44 |
5103 |
2393.2 |
-33.1 |
0.549 |
33 |
0 |
0 |
0.076 |
16 |
|
9 |
274 |
42 |
19911 |
◊ |
N |
x,y,z |
1_555 |
242 |
65 |
10923 |
2271.8 |
-35.3 |
0.899 |
57 |
0 |
0 |
0.866 |
17 |
|
0 |
238 |
40 |
364929 |
◊ |
W |
x,y,z |
1_555 |
211 |
52 |
8180 |
2054.1 |
-38.6 |
0.351 |
38 |
0 |
0 |
0.076 |
18 |
|
0 |
231 |
45 |
364929 |
◊ |
K |
x,y,z |
1_555 |
198 |
49 |
7303 |
1929.3 |
-30.8 |
0.709 |
50 |
0 |
0 |
0.076 |
19 |
|
0 |
210 |
31 |
364929 |
◊ |
O |
x,y,z |
1_555 |
186 |
51 |
6538 |
1851.3 |
-26.4 |
0.715 |
41 |
0 |
0 |
0.071 |
20 |
|
0 |
207 |
40 |
364929 |
◊ |
X |
x,y,z |
1_555 |
171 |
39 |
5121 |
1698.2 |
-27.8 |
0.644 |
32 |
0 |
0 |
0.067 |
21 |
|
0 |
208 |
37 |
364929 |
◊ |
E |
x,y,z |
1_555 |
167 |
45 |
10236 |
1643.7 |
-23.9 |
0.338 |
23 |
0 |
0 |
0.054 |
22 |
|
9 |
145 |
20 |
19911 |
◊ |
D |
x,y,z |
1_555 |
122 |
34 |
9735 |
1261.0 |
-20.4 |
0.668 |
15 |
0 |
0 |
1.000 |
23 |
|
0 |
169 |
34 |
364929 |
◊ |
Z |
x,y,z |
1_555 |
118 |
35 |
5578 |
1225.8 |
-13.4 |
0.683 |
21 |
0 |
0 |
0.030 |
24 |
|
0 |
126 |
18 |
364929 |
◊ |
N |
x,y,z |
1_555 |
118 |
31 |
10923 |
1124.6 |
-8.8 |
0.367 |
13 |
0 |
0 |
0.018 |
25 |
|
0 |
119 |
19 |
364929 |
◊ |
D |
x,y,z |
1_555 |
120 |
40 |
9735 |
1114.4 |
-11.5 |
0.902 |
21 |
0 |
0 |
0.033 |
26 |
|
9 |
123 |
26 |
19911 |
◊ |
0 |
x,y,z |
1_555 |
146 |
37 |
364929 |
1055.5 |
-25.7 |
0.961 |
12 |
0 |
0 |
0.049 |
27 |
|
Z |
113 |
32 |
5578 |
◊ |
A |
x,y,z |
1_555 |
114 |
37 |
14279 |
1046.2 |
-15.0 |
0.016 |
17 |
2 |
0 |
0.734 |
28 |
|
0 |
125 |
26 |
364929 |
◊ |
S |
x,y,z |
1_555 |
105 |
33 |
5209 |
1002.2 |
-18.9 |
0.689 |
22 |
0 |
0 |
0.045 |
29 |
|
0 |
115 |
21 |
364929 |
◊ |
V |
x,y,z |
1_555 |
110 |
28 |
4628 |
1000.5 |
-14.1 |
0.746 |
20 |
0 |
0 |
0.037 |
30 |
|
0 |
109 |
18 |
364929 |
◊ |
I |
x,y,z |
1_555 |
99 |
30 |
4526 |
929.3 |
-18.4 |
0.523 |
11 |
0 |
0 |
0.037 |
31 |
|
M |
76 |
21 |
12373 |
◊ |
F |
x,y,z |
1_555 |
73 |
18 |
6209 |
709.6 |
-8.9 |
0.040 |
9 |
4 |
0 |
0.015 |
32 |
|
0 |
97 |
17 |
364929 |
◊ |
U |
x,y,z |
1_555 |
69 |
18 |
3965 |
701.2 |
-9.6 |
0.829 |
8 |
0 |
0 |
0.015 |
33 |
|
0 |
66 |
10 |
364929 |
◊ |
F |
x,y,z |
1_555 |
59 |
20 |
6209 |
625.7 |
-12.9 |
0.471 |
17 |
0 |
0 |
0.027 |
34 |
|
9 |
68 |
11 |
19911 |
◊ |
W |
x,y,z |
1_555 |
50 |
16 |
8180 |
545.8 |
-7.5 |
0.697 |
7 |
0 |
0 |
0.014 |
35 |
|
Q |
50 |
12 |
6654 |
◊ |
N |
x,y,z |
1_555 |
66 |
18 |
10923 |
523.1 |
-8.1 |
0.059 |
2 |
0 |
0 |
0.000 |
36 |
|
U |
52 |
15 |
3965 |
◊ |
K |
x,y,z |
1_555 |
52 |
15 |
7303 |
514.3 |
-8.1 |
0.048 |
6 |
1 |
0 |
0.012 |
37 |
|
0 |
53 |
9 |
364929 |
◊ |
G |
x,y,z |
1_555 |
47 |
13 |
2801 |
469.4 |
-6.2 |
0.771 |
9 |
0 |
0 |
0.000 |
38 |
|
K |
43 |
13 |
7303 |
◊ |
K |
-x+1,y,-z+1/2 |
3_655 |
43 |
13 |
7303 |
431.1 |
-0.1 |
0.424 |
6 |
6 |
0 |
0.000 |
39 |
|
V |
38 |
10 |
4628 |
◊ |
S |
x,y,z |
1_555 |
40 |
10 |
5209 |
340.3 |
-4.8 |
0.159 |
1 |
1 |
0 |
0.009 |
40 |
|
[1MA]0:628 |
23 |
1 |
498 |
cf |
0 |
x,y,z |
1_555 |
49 |
10 |
364929 |
327.5 |
-1.9 |
0.773 |
5 |
0 |
0 |
0.006 |
41 |
|
[OMG]0:2588 |
24 |
1 |
507 |
cf |
0 |
x,y,z |
1_555 |
47 |
7 |
364929 |
291.2 |
-2.3 |
0.797 |
2 |
0 |
0 |
0.005 |
42 |
|
[OMU]0:2587 |
21 |
1 |
457 |
cf |
0 |
x,y,z |
1_555 |
47 |
11 |
364929 |
278.3 |
-0.7 |
0.842 |
1 |
0 |
0 |
0.002 |
43 |
|
K |
26 |
8 |
7303 |
◊ |
B |
x,y,z |
1_555 |
35 |
10 |
18404 |
278.1 |
-1.8 |
0.292 |
2 |
0 |
0 |
0.000 |
44 |
|
J |
29 |
6 |
8530 |
◊ |
E |
x,y,z |
1_555 |
31 |
8 |
10236 |
277.4 |
-3.1 |
0.141 |
3 |
0 |
0 |
0.006 |
45 |
|
[UR3]0:2619 |
21 |
1 |
456 |
cf |
0 |
x,y,z |
1_555 |
36 |
5 |
364929 |
272.7 |
-1.4 |
0.841 |
0 |
0 |
0 |
0.002 |
46 |
|
2 |
31 |
7 |
5103 |
◊ |
S |
x,y,z |
1_555 |
34 |
9 |
5209 |
260.3 |
-3.3 |
0.188 |
2 |
0 |
0 |
0.007 |
47 |
|
9 |
33 |
7 |
19911 |
◊ |
Q |
x,y,z |
1_555 |
24 |
5 |
6654 |
255.2 |
-2.7 |
0.761 |
4 |
0 |
0 |
0.000 |
48 |
|
[PSU]0:2621 |
19 |
1 |
429 |
cf |
0 |
x,y,z |
1_555 |
40 |
7 |
364929 |
249.8 |
-1.6 |
0.712 |
4 |
0 |
0 |
0.005 |
49 |
|
J |
28 |
10 |
8530 |
◊ |
B |
x,y,z |
1_555 |
26 |
8 |
18404 |
241.8 |
0.7 |
0.535 |
6 |
1 |
0 |
0.000 |
50 |
|
N |
30 |
8 |
10923 |
◊ |
D |
x,y,z |
1_555 |
20 |
5 |
9735 |
225.7 |
1.4 |
0.681 |
2 |
0 |
0 |
0.000 |
51 |
|
O |
17 |
4 |
6538 |
◊ |
C |
x,y,z |
1_555 |
17 |
5 |
14435 |
178.9 |
-1.4 |
0.257 |
0 |
0 |
0 |
0.000 |
52 |
|
9 |
28 |
3 |
19911 |
◊ |
0 |
x-1/2,y-1/2,z |
5_445 |
23 |
3 |
364929 |
178.7 |
-0.4 |
0.928 |
1 |
0 |
0 |
0.000 |
53 |
|
2 |
20 |
5 |
5103 |
◊ |
1 |
x,y,z |
1_555 |
20 |
7 |
4877 |
177.3 |
-2.4 |
0.245 |
0 |
0 |
0 |
0.003 |
54 |
|
U |
15 |
4 |
3965 |
◊ |
B |
x,y,z |
1_555 |
22 |
6 |
18404 |
177.3 |
-1.4 |
0.333 |
5 |
0 |
0 |
0.000 |
55 |
|
0 |
26 |
6 |
364929 |
◊ |
V |
x,-y+1,-z |
4_565 |
17 |
6 |
4628 |
173.8 |
-3.6 |
0.450 |
3 |
0 |
0 |
0.000 |
56 |
|
0 |
23 |
4 |
364929 |
◊ |
0 |
-x+1,y,-z+1/2 |
3_655 |
23 |
4 |
364929 |
162.3 |
-0.0 |
0.932 |
2 |
0 |
0 |
0.000 |
57 |
|
1 |
16 |
4 |
4877 |
◊ |
C |
x,y,z |
1_555 |
21 |
6 |
14435 |
160.4 |
-1.0 |
0.395 |
3 |
3 |
0 |
0.002 |
58 |
|
0 |
16 |
2 |
364929 |
x |
0 |
x-1/2,y-1/2,z |
5_445 |
20 |
4 |
364929 |
154.1 |
-5.6 |
0.526 |
2 |
0 |
0 |
0.000 |
59 |
|
3 |
11 |
4 |
7807 |
◊ |
M |
x,y,z |
1_555 |
22 |
6 |
12373 |
150.2 |
-2.7 |
0.107 |
1 |
0 |
0 |
0.002 |
60 |
|
[K]0:8202 |
1 |
1 |
216 |
f |
0 |
x,y,z |
1_555 |
24 |
12 |
364929 |
130.3 |
-88.3 |
0.000 |
0 |
0 |
0 |
0.140 |
61 |
|
[K]0:8201 |
1 |
1 |
216 |
f |
0 |
x,y,z |
1_555 |
14 |
8 |
364929 |
120.9 |
-104.3 |
0.000 |
0 |
0 |
0 |
0.166 |
62 |
|
N |
14 |
7 |
10923 |
◊ |
0 |
x-1/2,y-1/2,z |
5_445 |
16 |
2 |
364929 |
119.2 |
-2.7 |
0.407 |
0 |
0 |
0 |
0.000 |
63 |
|
9 |
14 |
4 |
19911 |
◊ |
H |
x,y,z |
1_555 |
19 |
5 |
9487 |
116.0 |
0.4 |
0.725 |
2 |
0 |
0 |
0.000 |
64 |
|
O |
16 |
7 |
6538 |
◊ |
L |
x,y,z |
1_555 |
11 |
4 |
11399 |
115.0 |
-0.1 |
0.417 |
0 |
0 |
0 |
0.000 |
65 |
|
[OMG]0:2588 |
13 |
1 |
507 |
cf |
[OMU]0:2587 |
x,y,z |
1_555 |
13 |
1 |
457 |
92.1 |
-0.5 |
0.532 |
0 |
0 |
0 |
0.000 |
66 |
|
[CL]0:8505 |
1 |
1 |
125 |
f |
0 |
x,y,z |
1_555 |
20 |
7 |
364929 |
87.8 |
-11.2 |
0.000 |
0 |
0 |
0 |
0.018 |
67 |
|
T |
17 |
5 |
8108 |
◊ |
C |
x,y,z |
1_555 |
12 |
5 |
14435 |
86.0 |
-1.0 |
0.315 |
0 |
0 |
0 |
0.000 |
68 |
|
0 |
15 |
5 |
364929 |
◊ |
E |
-x,y,-z+1/2 |
3_555 |
10 |
3 |
10236 |
81.7 |
-0.1 |
0.774 |
0 |
0 |
0 |
0.000 |
69 |
|
[CL]R:8506 |
1 |
1 |
125 |
f |
R |
x,y,z |
1_555 |
10 |
4 |
8487 |
73.4 |
-9.8 |
0.000 |
0 |
0 |
0 |
0.100 |
70 |
|
[CL]3:8504 |
1 |
1 |
125 |
f |
3 |
x,y,z |
1_555 |
13 |
6 |
7807 |
69.1 |
-10.7 |
0.000 |
0 |
0 |
0 |
0.100 |
71 |
|
[CL]M:8518 |
1 |
1 |
125 |
f |
M |
x,y,z |
1_555 |
13 |
7 |
12373 |
68.8 |
-12.4 |
0.000 |
0 |
0 |
0 |
0.100 |
72 |
|
[CD]O:8405 |
1 |
1 |
112 |
f |
O |
x,y,z |
1_555 |
19 |
7 |
6538 |
68.0 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.049 |
73 |
|
[1MA]0:628 |
8 |
1 |
498 |
◊ |
Y |
x,y,z |
1_555 |
6 |
3 |
10502 |
67.9 |
-2.3 |
0.211 |
0 |
0 |
0 |
0.002 |
74 |
|
[CL]0:8515 |
1 |
1 |
125 |
f |
0 |
x,y,z |
1_555 |
14 |
6 |
364929 |
67.6 |
-9.9 |
0.000 |
0 |
0 |
0 |
0.016 |
75 |
|
[CL]0:8513 |
1 |
1 |
125 |
f |
0 |
x,y,z |
1_555 |
12 |
5 |
364929 |
66.1 |
-9.7 |
0.000 |
0 |
0 |
0 |
0.015 |
76 |
|
[CL]J:8502 |
1 |
1 |
125 |
f |
J |
x,y,z |
1_555 |
10 |
4 |
8530 |
63.8 |
-9.7 |
0.000 |
0 |
0 |
0 |
0.037 |
77 |
|
[CL]0:8522 |
1 |
1 |
125 |
f |
0 |
x,y,z |
1_555 |
10 |
3 |
364929 |
62.3 |
-9.2 |
0.000 |
0 |
0 |
0 |
0.015 |
78 |
|
[CL]J:8501 |
1 |
1 |
125 |
f |
J |
x,y,z |
1_555 |
11 |
4 |
8530 |
62.2 |
-8.7 |
0.000 |
0 |
0 |
0 |
0.033 |
79 |
|
[CL]A:8509 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
14279 |
61.7 |
-8.3 |
0.000 |
0 |
0 |
0 |
0.266 |
80 |
|
[CL]O:8508 |
1 |
1 |
125 |
f |
O |
x,y,z |
1_555 |
10 |
4 |
6538 |
61.2 |
-7.4 |
0.000 |
0 |
0 |
0 |
0.051 |
81 |
|
[CL]0:8514 |
1 |
1 |
125 |
f |
L |
x,y,z |
1_555 |
10 |
4 |
11399 |
60.9 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.045 |
82 |
|
[CL]Y:8520 |
1 |
1 |
125 |
f |
0 |
x,y,z |
1_555 |
14 |
5 |
364929 |
60.8 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.010 |
83 |
|
[CL]N:8507 |
1 |
1 |
125 |
f |
N |
x,y,z |
1_555 |
10 |
4 |
10923 |
60.4 |
-8.3 |
0.000 |
0 |
0 |
0 |
0.119 |
84 |
|
[CL]L:8510 |
1 |
1 |
125 |
f |
L |
x,y,z |
1_555 |
13 |
4 |
11399 |
59.6 |
-8.1 |
0.000 |
0 |
0 |
0 |
0.055 |
85 |
|
W |
6 |
1 |
8180 |
◊ |
0 |
x-1/2,y-1/2,z |
5_445 |
10 |
1 |
364929 |
59.0 |
-0.8 |
0.244 |
0 |
0 |
0 |
0.000 |
86 |
|
[CL]0:8511 |
1 |
1 |
125 |
f |
Q |
x,y,z |
1_555 |
12 |
6 |
6654 |
58.8 |
-8.7 |
0.000 |
0 |
0 |
0 |
0.100 |
87 |
|
[CL]0:8503 |
1 |
1 |
125 |
f |
0 |
x,y,z |
1_555 |
10 |
5 |
364929 |
58.1 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.011 |
88 |
|
[CL]B:8519 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
18404 |
57.9 |
-8.5 |
0.000 |
0 |
0 |
0 |
0.100 |
89 |
|
[CL]J:8521 |
1 |
1 |
125 |
f |
J |
x,y,z |
1_555 |
11 |
6 |
8530 |
57.3 |
-8.0 |
0.000 |
0 |
0 |
0 |
0.030 |
90 |
|
Y |
7 |
1 |
10502 |
◊ |
L |
x,y,z |
1_555 |
8 |
4 |
11399 |
56.8 |
0.7 |
0.627 |
0 |
0 |
0 |
0.000 |
91 |
|
[CL]0:8517 |
1 |
1 |
125 |
◊ |
Y |
x,y,z |
1_555 |
8 |
3 |
10502 |
55.6 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.005 |
92 |
|
[CL]0:8516 |
1 |
1 |
125 |
f |
0 |
x,y,z |
1_555 |
8 |
3 |
364929 |
52.9 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.011 |
93 |
|
[CL]0:8516 |
1 |
1 |
125 |
◊ |
J |
x,y,z |
1_555 |
6 |
3 |
8530 |
52.5 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.006 |
94 |
|
[CL]0:8517 |
1 |
1 |
125 |
f |
0 |
x,y,z |
1_555 |
12 |
3 |
364929 |
51.2 |
-7.1 |
0.000 |
0 |
0 |
0 |
0.011 |
95 |
|
9 |
7 |
2 |
19911 |
◊ |
B |
-x+1/2,y-1/2,-z+1/2 |
7_545 |
3 |
1 |
18404 |
50.6 |
0.7 |
0.792 |
2 |
0 |
0 |
0.000 |
96 |
|
[CL]0:8512 |
1 |
1 |
125 |
f |
K |
x,y,z |
1_555 |
9 |
4 |
7303 |
50.0 |
-6.8 |
0.000 |
0 |
0 |
0 |
0.100 |
97 |
|
[CL]0:8512 |
1 |
1 |
125 |
◊ |
0 |
x,y,z |
1_555 |
10 |
4 |
364929 |
48.3 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.008 |
98 |
|
[CL]Y:8520 |
1 |
1 |
125 |
◊ |
Y |
x,y,z |
1_555 |
6 |
3 |
10502 |
46.1 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.004 |
99 |
|
[K]0:8202 |
1 |
1 |
216 |
◊ |
M |
x,y,z |
1_555 |
6 |
1 |
12373 |
43.6 |
-23.4 |
0.000 |
0 |
0 |
0 |
0.027 |
100 |
|
[CL]0:8514 |
1 |
1 |
125 |
◊ |
0 |
x,y,z |
1_555 |
9 |
1 |
364929 |
43.4 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.005 |
101 |
|
[CL]O:8508 |
1 |
1 |
125 |
◊ |
0 |
x,y,z |
1_555 |
10 |
2 |
364929 |
41.9 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.007 |
102 |
|
[CL]B:8519 |
1 |
1 |
125 |
◊ |
0 |
x,y,z |
1_555 |
5 |
3 |
364929 |
39.3 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.003 |
103 |
|
[CL]L:8510 |
1 |
1 |
125 |
◊ |
0 |
x,y,z |
1_555 |
6 |
2 |
364929 |
36.7 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.004 |
104 |
|
[CL]0:8511 |
1 |
1 |
125 |
◊ |
0 |
x,y,z |
1_555 |
5 |
2 |
364929 |
35.8 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.005 |
105 |
|
0 |
4 |
2 |
364929 |
◊ |
F |
x,-y+1,-z |
4_565 |
4 |
1 |
6209 |
33.6 |
-1.9 |
0.291 |
0 |
0 |
0 |
0.000 |
106 |
|
D |
7 |
1 |
9735 |
◊ |
B |
-x+1/2,y-1/2,-z+1/2 |
7_545 |
3 |
1 |
18404 |
33.4 |
-0.4 |
0.517 |
0 |
0 |
0 |
0.000 |
107 |
|
[CL]N:8507 |
1 |
1 |
125 |
◊ |
D |
x,y,z |
1_555 |
3 |
1 |
9735 |
32.2 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.004 |
108 |
|
[CL]J:8521 |
1 |
1 |
125 |
◊ |
0 |
x,y,z |
1_555 |
6 |
2 |
364929 |
30.0 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.004 |
109 |
|
3 |
4 |
1 |
7807 |
◊ |
L |
x,y,z |
1_555 |
2 |
1 |
11399 |
29.1 |
0.7 |
0.525 |
0 |
0 |
0 |
0.000 |
110 |
|
[CL]0:8503 |
1 |
1 |
125 |
◊ |
2 |
x,y,z |
1_555 |
3 |
1 |
5103 |
28.3 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.005 |
111 |
|
[CL]J:8501 |
1 |
1 |
125 |
◊ |
E |
x,y,z |
1_555 |
2 |
1 |
10236 |
26.9 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.004 |
112 |
|
[CL]A:8509 |
1 |
1 |
125 |
◊ |
0 |
x,y,z |
1_555 |
5 |
3 |
364929 |
25.4 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.005 |
113 |
|
M |
2 |
1 |
12373 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
14279 |
13.2 |
0.8 |
0.842 |
0 |
0 |
0 |
0.000 |
114 |
|
G |
2 |
1 |
2801 |
◊ |
0 |
-x+1/2,y-1/2,-z+1/2 |
7_545 |
4 |
1 |
364929 |
13.1 |
0.1 |
0.596 |
0 |
0 |
0 |
0.000 |
115 |
|
[CL]R:8506 |
1 |
1 |
125 |
◊ |
0 |
x,y,z |
1_555 |
4 |
1 |
364929 |
11.6 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.001 |
116 |
|
[CL]0:8522 |
1 |
1 |
125 |
◊ |
W |
x,y,z |
1_555 |
2 |
1 |
8180 |
11.5 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.001 |
117 |
|
[CL]0:8513 |
1 |
1 |
125 |
◊ |
Y |
x,y,z |
1_555 |
1 |
1 |
10502 |
8.8 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.000 |
118 |
|
N |
1 |
1 |
10923 |
◊ |
P |
x-1/2,y-1/2,z |
5_445 |
2 |
1 |
10759 |
8.8 |
-0.1 |
0.384 |
0 |
0 |
0 |
0.000 |
119 |
|
[CL]N:8507 |
1 |
1 |
125 |
◊ |
9 |
x,y,z |
1_555 |
2 |
2 |
19911 |
6.8 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.014 |
120 |
|
[CL]Y:8520 |
1 |
1 |
125 |
f |
[CL]0:8513 |
x,y,z |
1_555 |
1 |
1 |
125 |
5.8 |
-1.2 |
0.000 |
0 |
0 |
0 |
0.002 |
121 |
|
[CL]J:8501 |
1 |
1 |
125 |
◊ |
0 |
x,y,z |
1_555 |
1 |
1 |
364929 |
2.5 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.000 |
122 |
|
[CL]J:8502 |
1 |
1 |
125 |
◊ |
0 |
x,y,z |
1_555 |
1 |
1 |
364929 |
0.1 |
-0.0 |
0.000 |
0 |
0 |
0 |
0.000 |
|