| ## |
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 |
815 |
142 |
364572 |
◊ |
B |
x,y,z |
1_555 |
749 |
168 |
18344 |
7148.4 |
-132.4 |
0.738 |
168 |
0 |
0 |
0.128 |
2 |
|
0 |
754 |
138 |
364572 |
◊ |
M |
x,y,z |
1_555 |
620 |
136 |
12373 |
6316.9 |
-117.5 |
0.639 |
137 |
0 |
0 |
0.207 |
3 |
|
0 |
725 |
116 |
364572 |
◊ |
A |
x,y,z |
1_555 |
611 |
130 |
14186 |
6138.4 |
-115.9 |
0.571 |
135 |
0 |
0 |
0.233 |
4 |
|
0 |
650 |
110 |
364572 |
◊ |
C |
x,y,z |
1_555 |
524 |
129 |
14371 |
5398.8 |
-89.0 |
0.651 |
103 |
0 |
0 |
0.103 |
5 |
|
0 |
484 |
97 |
364572 |
◊ |
P |
x,y,z |
1_555 |
388 |
93 |
10716 |
4217.3 |
-81.5 |
0.558 |
110 |
0 |
0 |
0.112 |
6 |
|
0 |
498 |
98 |
364572 |
◊ |
Y |
x,y,z |
1_555 |
384 |
86 |
10482 |
4060.6 |
-71.2 |
0.769 |
93 |
0 |
0 |
0.100 |
7 |
|
0 |
509 |
107 |
364572 |
◊ |
L |
x,y,z |
1_555 |
368 |
81 |
11403 |
4039.0 |
-64.6 |
0.711 |
97 |
0 |
0 |
0.103 |
8 |
|
0 |
385 |
70 |
364572 |
◊ |
R |
x,y,z |
1_555 |
327 |
80 |
8440 |
3099.5 |
-53.2 |
0.562 |
73 |
0 |
0 |
0.091 |
9 |
|
0 |
368 |
60 |
364572 |
◊ |
3 |
x,y,z |
1_555 |
320 |
68 |
7792 |
3070.2 |
-61.1 |
0.304 |
58 |
0 |
0 |
0.088 |
10 |
|
0 |
372 |
76 |
364572 |
◊ |
1 |
x,y,z |
1_555 |
263 |
54 |
4832 |
2821.7 |
-56.8 |
0.575 |
52 |
0 |
0 |
0.094 |
11 |
|
0 |
342 |
58 |
364572 |
◊ |
T |
x,y,z |
1_555 |
270 |
67 |
8061 |
2756.5 |
-43.1 |
0.753 |
53 |
0 |
0 |
0.082 |
12 |
|
0 |
313 |
56 |
364572 |
◊ |
H |
x,y,z |
1_555 |
273 |
61 |
9246 |
2639.4 |
-47.1 |
0.543 |
50 |
0 |
0 |
0.085 |
13 |
|
0 |
290 |
60 |
364572 |
◊ |
Q |
x,y,z |
1_555 |
245 |
57 |
6621 |
2458.4 |
-54.3 |
0.509 |
62 |
0 |
0 |
0.090 |
14 |
|
0 |
273 |
49 |
364572 |
◊ |
J |
x,y,z |
1_555 |
251 |
69 |
8435 |
2421.3 |
-35.9 |
0.672 |
45 |
0 |
0 |
0.070 |
15 |
|
0 |
330 |
54 |
364572 |
◊ |
2 |
x,y,z |
1_555 |
231 |
43 |
5044 |
2374.5 |
-31.1 |
0.603 |
36 |
0 |
0 |
0.073 |
16 |
|
9 |
270 |
43 |
19849 |
◊ |
N |
x,y,z |
1_555 |
236 |
64 |
10835 |
2253.0 |
-34.6 |
0.908 |
59 |
0 |
0 |
0.867 |
17 |
|
0 |
237 |
39 |
364572 |
◊ |
W |
x,y,z |
1_555 |
202 |
52 |
8100 |
2028.3 |
-38.4 |
0.359 |
36 |
0 |
0 |
0.075 |
18 |
|
0 |
229 |
45 |
364572 |
◊ |
K |
x,y,z |
1_555 |
190 |
49 |
7236 |
1919.5 |
-32.6 |
0.658 |
45 |
0 |
0 |
0.077 |
19 |
|
0 |
207 |
31 |
364572 |
◊ |
O |
x,y,z |
1_555 |
189 |
50 |
6540 |
1831.6 |
-26.9 |
0.682 |
42 |
0 |
0 |
0.071 |
20 |
|
0 |
205 |
39 |
364572 |
◊ |
X |
x,y,z |
1_555 |
167 |
40 |
5082 |
1688.6 |
-27.1 |
0.680 |
30 |
0 |
0 |
0.063 |
21 |
|
0 |
207 |
36 |
364572 |
◊ |
E |
x,y,z |
1_555 |
167 |
44 |
10148 |
1649.6 |
-23.3 |
0.400 |
24 |
0 |
0 |
0.053 |
22 |
|
0 |
170 |
33 |
364572 |
◊ |
Z |
x,y,z |
1_555 |
114 |
33 |
5619 |
1255.3 |
-13.5 |
0.750 |
22 |
0 |
0 |
0.036 |
23 |
|
9 |
139 |
20 |
19849 |
◊ |
D |
x,y,z |
1_555 |
125 |
36 |
9670 |
1245.0 |
-19.8 |
0.730 |
17 |
0 |
0 |
1.000 |
24 |
|
0 |
117 |
19 |
364572 |
◊ |
D |
x,y,z |
1_555 |
120 |
40 |
9670 |
1118.1 |
-11.7 |
0.893 |
22 |
0 |
0 |
0.033 |
25 |
|
0 |
125 |
19 |
364572 |
◊ |
N |
x,y,z |
1_555 |
118 |
31 |
10835 |
1108.7 |
-8.2 |
0.406 |
13 |
0 |
0 |
0.017 |
26 |
|
9 |
122 |
22 |
19849 |
◊ |
0 |
x,y,z |
1_555 |
140 |
35 |
364572 |
1044.5 |
-25.2 |
0.959 |
12 |
0 |
0 |
0.047 |
27 |
|
Z |
107 |
30 |
5619 |
◊ |
A |
x,y,z |
1_555 |
113 |
36 |
14186 |
1019.5 |
-14.7 |
0.015 |
16 |
2 |
0 |
0.029 |
28 |
|
0 |
127 |
29 |
364572 |
◊ |
S |
x,y,z |
1_555 |
104 |
32 |
5152 |
996.9 |
-18.9 |
0.702 |
22 |
0 |
0 |
0.045 |
29 |
|
0 |
116 |
21 |
364572 |
◊ |
V |
x,y,z |
1_555 |
107 |
28 |
4563 |
990.5 |
-14.1 |
0.767 |
21 |
0 |
0 |
0.036 |
30 |
|
0 |
107 |
18 |
364572 |
◊ |
I |
x,y,z |
1_555 |
102 |
28 |
4396 |
937.0 |
-19.0 |
0.578 |
12 |
0 |
0 |
0.038 |
31 |
|
M |
79 |
21 |
12373 |
◊ |
F |
x,y,z |
1_555 |
73 |
18 |
6158 |
707.4 |
-8.5 |
0.050 |
9 |
4 |
0 |
0.015 |
32 |
|
0 |
85 |
16 |
364572 |
◊ |
U |
x,y,z |
1_555 |
71 |
18 |
3939 |
681.0 |
-9.1 |
0.805 |
8 |
0 |
0 |
0.015 |
33 |
|
5 |
57 |
4 |
1030 |
◊ |
0 |
x,y,z |
1_555 |
88 |
15 |
364572 |
642.6 |
-3.6 |
0.631 |
10 |
0 |
0 |
0.000 |
34 |
|
0 |
67 |
10 |
364572 |
◊ |
F |
x,y,z |
1_555 |
56 |
20 |
6158 |
609.3 |
-13.0 |
0.456 |
16 |
0 |
0 |
0.027 |
35 |
|
9 |
67 |
11 |
19849 |
◊ |
W |
x,y,z |
1_555 |
49 |
16 |
8100 |
534.1 |
-7.5 |
0.726 |
8 |
0 |
0 |
0.015 |
36 |
|
U |
54 |
15 |
3939 |
◊ |
K |
x,y,z |
1_555 |
50 |
16 |
7236 |
520.5 |
-7.5 |
0.074 |
6 |
1 |
0 |
0.000 |
37 |
|
Q |
53 |
12 |
6621 |
◊ |
N |
x,y,z |
1_555 |
65 |
18 |
10835 |
512.5 |
-8.5 |
0.056 |
2 |
0 |
0 |
0.000 |
38 |
|
0 |
51 |
9 |
364572 |
◊ |
G |
x,y,z |
1_555 |
49 |
13 |
2742 |
469.8 |
-6.0 |
0.766 |
8 |
0 |
0 |
0.000 |
39 |
|
V |
36 |
9 |
4563 |
◊ |
S |
x,y,z |
1_555 |
39 |
9 |
5152 |
344.3 |
-4.9 |
0.142 |
0 |
0 |
0 |
0.008 |
40 |
|
[1MA]0:628 |
23 |
1 |
501 |
cf |
0 |
x,y,z |
1_555 |
48 |
10 |
364572 |
327.8 |
-1.7 |
0.770 |
5 |
0 |
0 |
0.006 |
41 |
|
[OMG]0:2588 |
24 |
1 |
503 |
cf |
0 |
x,y,z |
1_555 |
48 |
7 |
364572 |
290.9 |
-2.1 |
0.792 |
1 |
0 |
0 |
0.004 |
42 |
|
K |
30 |
11 |
7236 |
◊ |
K |
-x+1,y,-z+1/2 |
3_655 |
30 |
11 |
7236 |
280.7 |
-0.7 |
0.416 |
0 |
2 |
0 |
0.000 |
43 |
|
[OMU]0:2587 |
21 |
1 |
455 |
cf |
0 |
x,y,z |
1_555 |
47 |
11 |
364572 |
280.2 |
-0.8 |
0.828 |
1 |
0 |
0 |
0.002 |
44 |
|
[UR3]0:2619 |
21 |
1 |
451 |
cf |
0 |
x,y,z |
1_555 |
40 |
6 |
364572 |
276.9 |
-1.6 |
0.828 |
1 |
0 |
0 |
0.003 |
45 |
|
J |
29 |
6 |
8435 |
◊ |
E |
x,y,z |
1_555 |
30 |
8 |
10148 |
274.8 |
-4.0 |
0.089 |
2 |
0 |
0 |
0.006 |
46 |
|
[5AA]4:76 |
22 |
1 |
530 |
◊ |
0 |
x,y,z |
1_555 |
41 |
11 |
364572 |
274.6 |
2.0 |
0.590 |
3 |
0 |
0 |
0.000 |
47 |
|
K |
27 |
9 |
7236 |
◊ |
B |
x,y,z |
1_555 |
37 |
11 |
18344 |
269.0 |
-1.9 |
0.298 |
3 |
0 |
0 |
0.000 |
48 |
|
2 |
29 |
7 |
5044 |
◊ |
S |
x,y,z |
1_555 |
31 |
9 |
5152 |
261.8 |
-2.4 |
0.233 |
3 |
2 |
0 |
0.006 |
49 |
|
9 |
34 |
7 |
19849 |
◊ |
Q |
x,y,z |
1_555 |
26 |
5 |
6621 |
256.6 |
-2.7 |
0.763 |
5 |
0 |
0 |
0.000 |
50 |
|
[PSU]0:2621 |
19 |
1 |
427 |
cf |
0 |
x,y,z |
1_555 |
42 |
7 |
364572 |
253.1 |
-1.9 |
0.711 |
4 |
0 |
0 |
0.006 |
51 |
|
J |
25 |
9 |
8435 |
◊ |
B |
x,y,z |
1_555 |
25 |
8 |
18344 |
232.8 |
0.8 |
0.572 |
7 |
1 |
0 |
0.000 |
52 |
|
N |
33 |
9 |
10835 |
◊ |
D |
x,y,z |
1_555 |
21 |
6 |
9670 |
211.2 |
0.9 |
0.670 |
2 |
0 |
0 |
0.000 |
53 |
|
U |
15 |
4 |
3939 |
◊ |
B |
x,y,z |
1_555 |
20 |
6 |
18344 |
175.0 |
-1.3 |
0.344 |
4 |
0 |
0 |
0.000 |
54 |
|
O |
16 |
4 |
6540 |
◊ |
C |
x,y,z |
1_555 |
16 |
5 |
14371 |
174.7 |
-1.2 |
0.281 |
0 |
0 |
0 |
0.000 |
55 |
|
2 |
20 |
5 |
5044 |
◊ |
1 |
x,y,z |
1_555 |
20 |
7 |
4832 |
172.7 |
-2.2 |
0.258 |
0 |
0 |
0 |
0.003 |
56 |
|
9 |
25 |
3 |
19849 |
◊ |
0 |
x-1/2,y-1/2,z |
5_445 |
21 |
2 |
364572 |
171.1 |
0.3 |
0.934 |
0 |
0 |
0 |
0.000 |
57 |
|
0 |
23 |
5 |
364572 |
◊ |
V |
x,-y+1,-z |
4_565 |
15 |
6 |
4563 |
167.7 |
-3.3 |
0.471 |
1 |
0 |
0 |
0.000 |
58 |
|
1 |
16 |
4 |
4832 |
◊ |
C |
x,y,z |
1_555 |
20 |
6 |
14371 |
159.7 |
-0.8 |
0.424 |
3 |
3 |
0 |
0.002 |
59 |
|
0 |
24 |
7 |
364572 |
◊ |
E |
-x,y,-z+1/2 |
3_555 |
21 |
8 |
10148 |
155.8 |
-1.2 |
0.778 |
1 |
0 |
0 |
0.000 |
60 |
|
3 |
12 |
4 |
7792 |
◊ |
M |
x,y,z |
1_555 |
22 |
6 |
12373 |
154.4 |
-2.9 |
0.105 |
1 |
0 |
0 |
0.002 |
61 |
|
[ACA]5:78 |
8 |
1 |
292 |
◊ |
0 |
x,y,z |
1_555 |
24 |
6 |
364572 |
147.4 |
5.0 |
0.004 |
1 |
0 |
0 |
0.000 |
62 |
|
0 |
16 |
2 |
364572 |
x |
0 |
x-1/2,y-1/2,z |
5_445 |
19 |
4 |
364572 |
144.5 |
-5.2 |
0.545 |
1 |
0 |
0 |
0.000 |
63 |
|
0 |
18 |
3 |
364572 |
◊ |
0 |
-x+1,y,-z+1/2 |
3_655 |
18 |
3 |
364572 |
143.2 |
2.5 |
0.969 |
4 |
0 |
0 |
0.000 |
64 |
|
[K]0:9002 |
1 |
1 |
216 |
f |
0 |
x,y,z |
1_555 |
25 |
12 |
364572 |
130.1 |
-89.0 |
0.000 |
0 |
0 |
0 |
0.138 |
65 |
|
[K]0:9001 |
1 |
1 |
216 |
f |
0 |
x,y,z |
1_555 |
15 |
8 |
364572 |
120.4 |
-102.5 |
0.000 |
0 |
0 |
0 |
0.159 |
66 |
|
O |
14 |
6 |
6540 |
◊ |
L |
x,y,z |
1_555 |
12 |
4 |
11403 |
118.9 |
0.2 |
0.481 |
0 |
0 |
0 |
0.000 |
67 |
|
[BTN]5:79 |
4 |
1 |
192 |
◊ |
0 |
x,y,z |
1_555 |
21 |
6 |
364572 |
113.3 |
2.9 |
0.634 |
0 |
0 |
0 |
0.000 |
68 |
|
N |
13 |
6 |
10835 |
◊ |
0 |
x-1/2,y-1/2,z |
5_445 |
15 |
2 |
364572 |
106.5 |
-2.2 |
0.453 |
0 |
0 |
0 |
0.000 |
69 |
|
9 |
14 |
4 |
19849 |
◊ |
H |
x,y,z |
1_555 |
16 |
5 |
9246 |
92.9 |
0.1 |
0.728 |
2 |
0 |
0 |
0.000 |
70 |
|
[5AA]4:76 |
13 |
1 |
530 |
◊ |
[UR3]0:2619 |
x,y,z |
1_555 |
11 |
1 |
451 |
90.1 |
1.5 |
0.515 |
0 |
0 |
0 |
0.000 |
71 |
|
[OMG]0:2588 |
14 |
1 |
503 |
cf |
[OMU]0:2587 |
x,y,z |
1_555 |
12 |
1 |
455 |
90.0 |
-0.5 |
0.517 |
0 |
0 |
0 |
0.000 |
72 |
|
[CL]0:9305 |
1 |
1 |
125 |
f |
0 |
x,y,z |
1_555 |
20 |
7 |
364572 |
87.0 |
-11.3 |
0.000 |
0 |
0 |
0 |
0.018 |
73 |
|
T |
17 |
5 |
8061 |
◊ |
C |
x,y,z |
1_555 |
11 |
5 |
14371 |
85.8 |
-1.0 |
0.313 |
0 |
0 |
0 |
0.000 |
74 |
|
[CL]R:9306 |
1 |
1 |
125 |
f |
R |
x,y,z |
1_555 |
10 |
4 |
8440 |
74.4 |
-9.7 |
0.000 |
0 |
0 |
0 |
0.100 |
75 |
|
[CL]3:9304 |
1 |
1 |
125 |
f |
3 |
x,y,z |
1_555 |
13 |
6 |
7792 |
69.4 |
-10.7 |
0.000 |
0 |
0 |
0 |
0.100 |
76 |
|
[CL]M:9318 |
1 |
1 |
125 |
f |
M |
x,y,z |
1_555 |
12 |
7 |
12373 |
68.9 |
-12.5 |
0.000 |
0 |
0 |
0 |
0.100 |
77 |
|
[1MA]0:628 |
8 |
1 |
501 |
◊ |
Y |
x,y,z |
1_555 |
6 |
3 |
10482 |
67.2 |
-2.4 |
0.199 |
0 |
0 |
0 |
0.002 |
78 |
|
[CL]0:9313 |
1 |
1 |
125 |
f |
0 |
x,y,z |
1_555 |
11 |
5 |
364572 |
67.0 |
-9.5 |
0.000 |
0 |
0 |
0 |
0.015 |
79 |
|
[CL]0:9315 |
1 |
1 |
125 |
f |
0 |
x,y,z |
1_555 |
14 |
6 |
364572 |
66.6 |
-9.7 |
0.000 |
0 |
0 |
0 |
0.015 |
80 |
|
[CD]O:9205 |
1 |
1 |
112 |
f |
O |
x,y,z |
1_555 |
18 |
6 |
6540 |
65.1 |
-7.0 |
0.000 |
0 |
0 |
0 |
0.049 |
81 |
|
[ACA]5:78 |
4 |
1 |
292 |
cf |
5 |
x,y,z |
1_555 |
7 |
2 |
1030 |
64.4 |
2.0 |
0.048 |
0 |
0 |
0 |
0.000 |
82 |
|
[CL]J:9302 |
1 |
1 |
125 |
f |
J |
x,y,z |
1_555 |
9 |
4 |
8435 |
62.6 |
-9.7 |
0.000 |
0 |
0 |
0 |
0.037 |
83 |
|
[CL]J:9301 |
1 |
1 |
125 |
f |
J |
x,y,z |
1_555 |
13 |
4 |
8435 |
62.2 |
-8.9 |
0.000 |
0 |
0 |
0 |
0.034 |
84 |
|
[CL]O:9308 |
1 |
1 |
125 |
f |
O |
x,y,z |
1_555 |
12 |
5 |
6540 |
62.0 |
-7.4 |
0.000 |
0 |
0 |
0 |
0.051 |
85 |
|
[CL]0:9322 |
1 |
1 |
125 |
f |
0 |
x,y,z |
1_555 |
10 |
3 |
364572 |
61.9 |
-8.9 |
0.000 |
0 |
0 |
0 |
0.014 |
86 |
|
[CL]Y:9320 |
1 |
1 |
125 |
f |
0 |
x,y,z |
1_555 |
14 |
5 |
364572 |
61.6 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.009 |
87 |
|
[CL]A:9309 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
14186 |
61.2 |
-8.2 |
0.000 |
0 |
0 |
0 |
0.100 |
88 |
|
[CL]N:9307 |
1 |
1 |
125 |
f |
N |
x,y,z |
1_555 |
12 |
4 |
10835 |
60.4 |
-8.5 |
0.000 |
0 |
0 |
0 |
0.122 |
89 |
|
[CL]0:9314 |
1 |
1 |
125 |
f |
L |
x,y,z |
1_555 |
13 |
4 |
11403 |
60.2 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.045 |
90 |
|
[CL]0:9303 |
1 |
1 |
125 |
f |
0 |
x,y,z |
1_555 |
11 |
5 |
364572 |
58.4 |
-7.3 |
0.000 |
0 |
0 |
0 |
0.011 |
91 |
|
[CL]L:9310 |
1 |
1 |
125 |
f |
L |
x,y,z |
1_555 |
13 |
4 |
11403 |
58.4 |
-8.1 |
0.000 |
0 |
0 |
0 |
0.055 |
92 |
|
[CL]0:9311 |
1 |
1 |
125 |
f |
Q |
x,y,z |
1_555 |
10 |
5 |
6621 |
58.3 |
-8.7 |
0.000 |
0 |
0 |
0 |
0.100 |
93 |
|
[CL]B:9319 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
11 |
5 |
18344 |
58.2 |
-8.6 |
0.000 |
0 |
0 |
0 |
0.100 |
94 |
|
[CL]Y:9317 |
1 |
1 |
125 |
f |
Y |
x,y,z |
1_555 |
8 |
4 |
10482 |
57.1 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.100 |
95 |
|
[CL]J:9321 |
1 |
1 |
125 |
f |
J |
x,y,z |
1_555 |
12 |
6 |
8435 |
56.6 |
-7.9 |
0.000 |
0 |
0 |
0 |
0.030 |
96 |
|
Y |
5 |
1 |
10482 |
◊ |
L |
x,y,z |
1_555 |
8 |
3 |
11403 |
54.6 |
0.4 |
0.628 |
0 |
0 |
0 |
0.000 |
97 |
|
[CL]0:9316 |
1 |
1 |
125 |
◊ |
J |
x,y,z |
1_555 |
8 |
3 |
8435 |
53.7 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.007 |
98 |
|
[CL]0:9316 |
1 |
1 |
125 |
f |
0 |
x,y,z |
1_555 |
8 |
3 |
364572 |
52.2 |
-6.6 |
0.000 |
0 |
0 |
0 |
0.010 |
99 |
|
9 |
7 |
2 |
19849 |
◊ |
B |
-x+1/2,y-1/2,-z+1/2 |
7_545 |
5 |
1 |
18344 |
51.3 |
-0.4 |
0.668 |
2 |
0 |
0 |
0.000 |
100 |
|
[CL]K:9312 |
1 |
1 |
125 |
f |
K |
x,y,z |
1_555 |
9 |
4 |
7236 |
51.3 |
-6.5 |
0.000 |
0 |
0 |
0 |
0.100 |
101 |
|
[BTN]5:79 |
4 |
1 |
192 |
cf |
[ACA]5:78 |
x,y,z |
1_555 |
2 |
1 |
292 |
51.1 |
1.4 |
0.104 |
0 |
0 |
0 |
0.000 |
102 |
|
W |
6 |
1 |
8100 |
◊ |
0 |
x-1/2,y-1/2,z |
5_445 |
10 |
1 |
364572 |
50.1 |
-0.8 |
0.301 |
0 |
0 |
0 |
0.000 |
103 |
|
[CL]K:9312 |
1 |
1 |
125 |
◊ |
0 |
x,y,z |
1_555 |
10 |
4 |
364572 |
48.9 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.008 |
104 |
|
[5AA]4:76 |
5 |
1 |
530 |
◊ |
[OMG]0:2588 |
x,y,z |
1_555 |
5 |
1 |
503 |
48.6 |
1.9 |
0.585 |
0 |
0 |
0 |
0.000 |
105 |
|
[CL]Y:9317 |
1 |
1 |
125 |
◊ |
0 |
x,y,z |
1_555 |
11 |
3 |
364572 |
48.5 |
-6.4 |
0.000 |
0 |
0 |
0 |
0.006 |
106 |
|
[CL]Y:9320 |
1 |
1 |
125 |
◊ |
Y |
x,y,z |
1_555 |
6 |
3 |
10482 |
44.9 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.004 |
107 |
|
[CL]0:9314 |
1 |
1 |
125 |
◊ |
0 |
x,y,z |
1_555 |
9 |
1 |
364572 |
43.3 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.005 |
108 |
|
[K]0:9002 |
1 |
1 |
216 |
◊ |
M |
x,y,z |
1_555 |
7 |
1 |
12373 |
42.6 |
-22.8 |
0.000 |
0 |
0 |
0 |
0.026 |
109 |
|
[CL]O:9308 |
1 |
1 |
125 |
◊ |
0 |
x,y,z |
1_555 |
10 |
2 |
364572 |
42.0 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.007 |
110 |
|
D |
6 |
1 |
9670 |
◊ |
B |
-x+1/2,y-1/2,-z+1/2 |
7_545 |
3 |
1 |
18344 |
40.7 |
-0.5 |
0.456 |
0 |
0 |
0 |
0.000 |
111 |
|
[CL]B:9319 |
1 |
1 |
125 |
◊ |
0 |
x,y,z |
1_555 |
5 |
3 |
364572 |
39.0 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.003 |
112 |
|
[CL]L:9310 |
1 |
1 |
125 |
◊ |
0 |
x,y,z |
1_555 |
6 |
2 |
364572 |
37.9 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.004 |
113 |
|
[CL]0:9311 |
1 |
1 |
125 |
◊ |
0 |
x,y,z |
1_555 |
5 |
2 |
364572 |
36.0 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.005 |
114 |
|
[CL]N:9307 |
1 |
1 |
125 |
◊ |
D |
x,y,z |
1_555 |
3 |
1 |
9670 |
31.8 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.004 |
115 |
|
[CL]J:9321 |
1 |
1 |
125 |
◊ |
0 |
x,y,z |
1_555 |
6 |
2 |
364572 |
29.9 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.005 |
116 |
|
3 |
3 |
1 |
7792 |
◊ |
L |
x,y,z |
1_555 |
2 |
1 |
11403 |
29.6 |
0.7 |
0.465 |
0 |
0 |
0 |
0.000 |
117 |
|
[CL]0:9303 |
1 |
1 |
125 |
◊ |
2 |
x,y,z |
1_555 |
3 |
1 |
5044 |
29.3 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.005 |
118 |
|
[CL]A:9309 |
1 |
1 |
125 |
◊ |
0 |
x,y,z |
1_555 |
5 |
3 |
364572 |
25.0 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.005 |
119 |
|
[CL]J:9301 |
1 |
1 |
125 |
◊ |
E |
x,y,z |
1_555 |
2 |
1 |
10148 |
24.8 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.004 |
120 |
|
[PSU]0:2621 |
4 |
1 |
427 |
◊ |
5 |
x,y,z |
1_555 |
2 |
1 |
1030 |
19.8 |
-0.1 |
0.459 |
0 |
0 |
0 |
0.000 |
121 |
|
0 |
4 |
2 |
364572 |
◊ |
F |
x,-y+1,-z |
4_565 |
4 |
1 |
6158 |
19.7 |
-1.3 |
0.385 |
0 |
0 |
0 |
0.000 |
122 |
|
[CL]0:9322 |
1 |
1 |
125 |
◊ |
W |
x,y,z |
1_555 |
1 |
1 |
8100 |
15.2 |
-1.3 |
0.000 |
0 |
0 |
0 |
0.002 |
123 |
|
[5AA]4:76 |
1 |
1 |
530 |
f |
5 |
x,y,z |
1_555 |
2 |
2 |
1030 |
11.8 |
0.3 |
0.474 |
0 |
0 |
0 |
0.000 |
124 |
|
[CL]R:9306 |
1 |
1 |
125 |
◊ |
0 |
x,y,z |
1_555 |
3 |
1 |
364572 |
9.9 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.000 |
125 |
|
G |
3 |
2 |
2742 |
◊ |
0 |
-x+1/2,y-1/2,-z+1/2 |
7_545 |
3 |
1 |
364572 |
9.7 |
0.2 |
0.668 |
0 |
0 |
0 |
0.000 |
126 |
|
[CL]0:9313 |
1 |
1 |
125 |
◊ |
Y |
x,y,z |
1_555 |
1 |
1 |
10482 |
9.6 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.000 |
127 |
|
[UR3]0:2619 |
3 |
1 |
451 |
◊ |
5 |
x,y,z |
1_555 |
1 |
1 |
1030 |
6.9 |
0.0 |
0.618 |
0 |
0 |
0 |
0.000 |
128 |
|
[BTN]5:79 |
2 |
1 |
192 |
◊ |
[K]0:9001 |
x,y,z |
1_555 |
1 |
1 |
216 |
6.9 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.000 |
129 |
|
[CL]Y:9320 |
1 |
1 |
125 |
f |
[CL]0:9313 |
x,y,z |
1_555 |
1 |
1 |
125 |
6.6 |
-1.3 |
0.000 |
0 |
0 |
0 |
0.002 |
130 |
|
[CL]N:9307 |
1 |
1 |
125 |
◊ |
9 |
x,y,z |
1_555 |
2 |
2 |
19849 |
5.4 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.012 |
131 |
|
M |
1 |
1 |
12373 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
14186 |
4.0 |
0.1 |
0.567 |
0 |
0 |
0 |
0.000 |
132 |
|
[ACA]5:78 |
1 |
1 |
292 |
◊ |
[K]0:9001 |
x,y,z |
1_555 |
1 |
1 |
216 |
3.9 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.000 |
133 |
|
[CL]J:9301 |
1 |
1 |
125 |
◊ |
0 |
x,y,z |
1_555 |
1 |
1 |
364572 |
2.3 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.000 |
134 |
|
[CL]J:9302 |
1 |
1 |
125 |
◊ |
0 |
x,y,z |
1_555 |
1 |
1 |
364572 |
1.7 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.000 |
135 |
|
[CD]O:9205 |
1 |
1 |
112 |
◊ |
0 |
x,y,z |
1_555 |
1 |
1 |
364572 |
1.0 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.000 |
|