| ## |
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 |
826 |
140 |
365891 |
◊ |
B |
x,y,z |
1_555 |
741 |
164 |
18360 |
7180.5 |
-133.4 |
0.715 |
161 |
0 |
0 |
0.128 |
2 |
|
0 |
750 |
141 |
365891 |
◊ |
M |
x,y,z |
1_555 |
613 |
135 |
12357 |
6263.0 |
-117.0 |
0.689 |
130 |
0 |
0 |
0.201 |
3 |
|
0 |
731 |
117 |
365891 |
◊ |
A |
x,y,z |
1_555 |
617 |
131 |
14203 |
6091.3 |
-115.2 |
0.570 |
131 |
0 |
0 |
0.238 |
4 |
|
0 |
647 |
109 |
365891 |
◊ |
C |
x,y,z |
1_555 |
521 |
129 |
14359 |
5409.1 |
-89.0 |
0.709 |
106 |
0 |
0 |
0.104 |
5 |
|
0 |
481 |
96 |
365891 |
◊ |
P |
x,y,z |
1_555 |
389 |
92 |
10705 |
4183.3 |
-81.8 |
0.573 |
98 |
0 |
0 |
0.108 |
6 |
|
0 |
520 |
108 |
365891 |
◊ |
L |
x,y,z |
1_555 |
382 |
82 |
11390 |
4065.5 |
-67.6 |
0.636 |
101 |
0 |
0 |
0.109 |
7 |
|
0 |
492 |
96 |
365891 |
◊ |
Y |
x,y,z |
1_555 |
386 |
87 |
10458 |
4047.8 |
-73.5 |
0.712 |
89 |
0 |
0 |
0.102 |
8 |
|
0 |
376 |
68 |
365891 |
◊ |
R |
x,y,z |
1_555 |
319 |
81 |
8426 |
3080.4 |
-53.9 |
0.582 |
68 |
0 |
0 |
0.088 |
9 |
|
0 |
359 |
60 |
365891 |
◊ |
3 |
x,y,z |
1_555 |
316 |
68 |
7736 |
3033.7 |
-60.1 |
0.356 |
57 |
0 |
0 |
0.086 |
10 |
|
0 |
376 |
79 |
365891 |
◊ |
1 |
x,y,z |
1_555 |
269 |
54 |
4871 |
2863.2 |
-58.7 |
0.577 |
56 |
0 |
0 |
0.092 |
11 |
|
0 |
341 |
60 |
365891 |
◊ |
T |
x,y,z |
1_555 |
273 |
68 |
8092 |
2791.6 |
-39.6 |
0.842 |
57 |
0 |
0 |
0.079 |
12 |
|
0 |
313 |
54 |
365891 |
◊ |
H |
x,y,z |
1_555 |
276 |
60 |
9308 |
2637.9 |
-49.5 |
0.480 |
47 |
0 |
0 |
0.086 |
13 |
|
0 |
296 |
59 |
365891 |
◊ |
Q |
x,y,z |
1_555 |
248 |
60 |
6601 |
2468.8 |
-52.4 |
0.534 |
63 |
0 |
0 |
0.092 |
14 |
|
0 |
274 |
47 |
365891 |
◊ |
J |
x,y,z |
1_555 |
250 |
66 |
8473 |
2398.5 |
-35.9 |
0.637 |
40 |
0 |
0 |
0.075 |
15 |
|
0 |
336 |
54 |
365891 |
◊ |
2 |
x,y,z |
1_555 |
224 |
43 |
5062 |
2392.0 |
-29.0 |
0.621 |
29 |
0 |
0 |
0.065 |
16 |
|
9 |
275 |
43 |
19936 |
◊ |
N |
x,y,z |
1_555 |
238 |
64 |
10950 |
2275.7 |
-36.9 |
0.875 |
54 |
0 |
0 |
0.867 |
17 |
|
0 |
240 |
39 |
365891 |
◊ |
W |
x,y,z |
1_555 |
203 |
54 |
8163 |
2039.0 |
-37.1 |
0.444 |
41 |
0 |
0 |
0.073 |
18 |
|
0 |
227 |
45 |
365891 |
◊ |
K |
x,y,z |
1_555 |
195 |
49 |
7215 |
1886.1 |
-33.2 |
0.644 |
53 |
0 |
0 |
0.071 |
19 |
|
0 |
211 |
31 |
365891 |
◊ |
O |
x,y,z |
1_555 |
186 |
50 |
6485 |
1837.2 |
-26.4 |
0.721 |
39 |
0 |
0 |
0.068 |
20 |
|
0 |
210 |
39 |
365891 |
◊ |
X |
x,y,z |
1_555 |
167 |
38 |
5094 |
1676.8 |
-28.8 |
0.599 |
33 |
0 |
0 |
0.067 |
21 |
|
0 |
208 |
36 |
365891 |
◊ |
E |
x,y,z |
1_555 |
165 |
44 |
10196 |
1652.6 |
-24.5 |
0.424 |
22 |
0 |
0 |
0.053 |
22 |
|
9 |
149 |
20 |
19936 |
◊ |
D |
x,y,z |
1_555 |
121 |
32 |
9582 |
1262.6 |
-19.5 |
0.660 |
17 |
0 |
0 |
1.000 |
23 |
|
0 |
175 |
33 |
365891 |
◊ |
Z |
x,y,z |
1_555 |
121 |
33 |
5601 |
1249.3 |
-14.0 |
0.694 |
24 |
0 |
0 |
0.038 |
24 |
|
0 |
129 |
19 |
365891 |
◊ |
N |
x,y,z |
1_555 |
119 |
33 |
10950 |
1121.0 |
-8.9 |
0.332 |
12 |
0 |
0 |
0.018 |
25 |
|
0 |
116 |
20 |
365891 |
◊ |
D |
x,y,z |
1_555 |
120 |
40 |
9582 |
1083.9 |
-10.7 |
0.902 |
18 |
0 |
0 |
0.029 |
26 |
|
Z |
111 |
31 |
5601 |
◊ |
A |
x,y,z |
1_555 |
116 |
37 |
14203 |
1052.8 |
-14.6 |
0.018 |
15 |
2 |
0 |
0.030 |
27 |
|
9 |
118 |
23 |
19936 |
◊ |
0 |
x,y,z |
1_555 |
141 |
35 |
365891 |
1030.5 |
-23.9 |
0.960 |
11 |
0 |
0 |
0.045 |
28 |
|
0 |
124 |
27 |
365891 |
◊ |
S |
x,y,z |
1_555 |
95 |
32 |
5181 |
1003.0 |
-17.6 |
0.731 |
22 |
0 |
0 |
0.042 |
29 |
|
0 |
118 |
21 |
365891 |
◊ |
V |
x,y,z |
1_555 |
112 |
28 |
4555 |
990.6 |
-14.0 |
0.762 |
24 |
0 |
0 |
0.038 |
30 |
|
0 |
108 |
18 |
365891 |
◊ |
I |
x,y,z |
1_555 |
97 |
30 |
4449 |
939.2 |
-18.5 |
0.539 |
15 |
0 |
0 |
0.039 |
31 |
|
M |
75 |
20 |
12357 |
◊ |
F |
x,y,z |
1_555 |
72 |
18 |
6124 |
696.7 |
-9.5 |
0.032 |
9 |
4 |
0 |
0.016 |
32 |
|
0 |
86 |
15 |
365891 |
◊ |
U |
x,y,z |
1_555 |
71 |
18 |
3980 |
690.8 |
-9.8 |
0.781 |
10 |
0 |
0 |
0.020 |
33 |
|
0 |
70 |
10 |
365891 |
◊ |
F |
x,y,z |
1_555 |
57 |
20 |
6124 |
623.8 |
-13.2 |
0.494 |
15 |
0 |
0 |
0.027 |
34 |
|
4 |
56 |
4 |
1059 |
◊ |
0 |
x,y,z |
1_555 |
82 |
14 |
365891 |
606.3 |
-5.4 |
0.658 |
10 |
0 |
0 |
0.000 |
35 |
|
9 |
68 |
11 |
19936 |
◊ |
W |
x,y,z |
1_555 |
51 |
16 |
8163 |
546.3 |
-7.8 |
0.681 |
8 |
0 |
0 |
0.015 |
36 |
|
U |
48 |
15 |
3980 |
◊ |
K |
x,y,z |
1_555 |
53 |
16 |
7215 |
518.4 |
-7.9 |
0.054 |
6 |
1 |
0 |
0.000 |
37 |
|
Q |
54 |
13 |
6601 |
◊ |
N |
x,y,z |
1_555 |
61 |
17 |
10950 |
503.8 |
-7.5 |
0.070 |
3 |
0 |
0 |
0.000 |
38 |
|
0 |
54 |
9 |
365891 |
◊ |
G |
x,y,z |
1_555 |
45 |
13 |
2781 |
492.6 |
-6.0 |
0.783 |
9 |
0 |
0 |
0.000 |
39 |
|
K |
35 |
12 |
7215 |
◊ |
K |
-x+1,y,-z+1/2 |
3_655 |
36 |
12 |
7215 |
361.0 |
0.2 |
0.487 |
4 |
4 |
0 |
0.000 |
40 |
|
[SPS]4:9701 |
23 |
1 |
571 |
f |
0 |
x,y,z |
1_555 |
50 |
8 |
365891 |
343.9 |
-1.6 |
0.630 |
2 |
0 |
0 |
0.004 |
41 |
|
V |
35 |
10 |
4555 |
◊ |
S |
x,y,z |
1_555 |
37 |
11 |
5181 |
337.8 |
-4.5 |
0.164 |
1 |
1 |
0 |
0.008 |
42 |
|
[1MA]0:628 |
23 |
1 |
499 |
cf |
0 |
x,y,z |
1_555 |
49 |
10 |
365891 |
326.8 |
-1.8 |
0.768 |
5 |
0 |
0 |
0.006 |
43 |
|
[OMG]0:2588 |
24 |
1 |
503 |
cf |
0 |
x,y,z |
1_555 |
46 |
8 |
365891 |
291.7 |
-2.3 |
0.797 |
2 |
0 |
0 |
0.005 |
44 |
|
[UR3]0:2619 |
21 |
1 |
455 |
cf |
0 |
x,y,z |
1_555 |
42 |
7 |
365891 |
287.9 |
-1.1 |
0.832 |
0 |
0 |
0 |
0.002 |
45 |
|
K |
27 |
10 |
7215 |
◊ |
B |
x,y,z |
1_555 |
35 |
11 |
18360 |
282.6 |
-1.8 |
0.302 |
2 |
0 |
0 |
0.000 |
46 |
|
[OMU]0:2587 |
20 |
1 |
455 |
cf |
0 |
x,y,z |
1_555 |
47 |
11 |
365891 |
279.0 |
-1.0 |
0.837 |
1 |
0 |
0 |
0.002 |
47 |
|
J |
28 |
6 |
8473 |
◊ |
E |
x,y,z |
1_555 |
28 |
7 |
10196 |
273.8 |
-3.2 |
0.131 |
3 |
0 |
0 |
0.006 |
48 |
|
2 |
29 |
7 |
5062 |
◊ |
S |
x,y,z |
1_555 |
32 |
9 |
5181 |
267.1 |
-2.8 |
0.225 |
3 |
1 |
0 |
0.007 |
49 |
|
9 |
33 |
7 |
19936 |
◊ |
Q |
x,y,z |
1_555 |
26 |
6 |
6601 |
260.7 |
-2.9 |
0.742 |
5 |
0 |
0 |
0.000 |
50 |
|
[PSU]0:2621 |
18 |
1 |
429 |
cf |
0 |
x,y,z |
1_555 |
41 |
7 |
365891 |
250.2 |
-2.0 |
0.704 |
3 |
0 |
0 |
0.005 |
51 |
|
J |
29 |
10 |
8473 |
◊ |
B |
x,y,z |
1_555 |
28 |
8 |
18360 |
240.1 |
0.6 |
0.523 |
7 |
1 |
0 |
0.000 |
52 |
|
N |
30 |
9 |
10950 |
◊ |
D |
x,y,z |
1_555 |
21 |
5 |
9582 |
227.7 |
1.3 |
0.687 |
4 |
0 |
0 |
0.000 |
53 |
|
O |
17 |
4 |
6485 |
◊ |
C |
x,y,z |
1_555 |
16 |
5 |
14359 |
178.2 |
-1.3 |
0.264 |
0 |
0 |
0 |
0.000 |
54 |
|
0 |
25 |
6 |
365891 |
◊ |
V |
x,-y+1,-z |
4_565 |
16 |
6 |
4555 |
177.2 |
-3.6 |
0.451 |
3 |
0 |
0 |
0.000 |
55 |
|
U |
15 |
4 |
3980 |
◊ |
B |
x,y,z |
1_555 |
22 |
6 |
18360 |
171.6 |
-1.4 |
0.327 |
4 |
0 |
0 |
0.000 |
56 |
|
2 |
21 |
5 |
5062 |
◊ |
1 |
x,y,z |
1_555 |
20 |
7 |
4871 |
170.7 |
-2.5 |
0.248 |
0 |
0 |
0 |
0.003 |
57 |
|
1 |
15 |
4 |
4871 |
◊ |
C |
x,y,z |
1_555 |
20 |
6 |
14359 |
163.2 |
-1.1 |
0.368 |
3 |
3 |
0 |
0.002 |
58 |
|
3 |
14 |
4 |
7736 |
◊ |
M |
x,y,z |
1_555 |
24 |
7 |
12357 |
160.7 |
-2.3 |
0.155 |
0 |
0 |
0 |
0.002 |
59 |
|
[SPS]4:9701 |
18 |
1 |
571 |
◊ |
4 |
x,y,z |
1_555 |
18 |
3 |
1059 |
159.3 |
1.7 |
0.720 |
1 |
0 |
0 |
0.000 |
60 |
|
9 |
26 |
3 |
19936 |
◊ |
0 |
x-1/2,y-1/2,z |
5_445 |
19 |
2 |
365891 |
155.8 |
0.3 |
0.930 |
1 |
0 |
0 |
0.000 |
61 |
|
0 |
16 |
2 |
365891 |
x |
0 |
x-1/2,y-1/2,z |
5_445 |
21 |
4 |
365891 |
152.3 |
-5.7 |
0.540 |
2 |
0 |
0 |
0.000 |
62 |
|
[K]0:9002 |
1 |
1 |
216 |
f |
0 |
x,y,z |
1_555 |
23 |
10 |
365891 |
132.0 |
-83.3 |
0.000 |
0 |
0 |
0 |
0.129 |
63 |
|
9 |
14 |
4 |
19936 |
◊ |
H |
x,y,z |
1_555 |
19 |
6 |
9308 |
128.9 |
0.5 |
0.743 |
2 |
0 |
0 |
0.000 |
64 |
|
[K]0:9001 |
1 |
1 |
216 |
f |
0 |
x,y,z |
1_555 |
19 |
9 |
365891 |
123.4 |
-102.8 |
0.000 |
0 |
0 |
0 |
0.160 |
65 |
|
O |
16 |
6 |
6485 |
◊ |
L |
x,y,z |
1_555 |
12 |
4 |
11390 |
119.4 |
-0.1 |
0.409 |
0 |
0 |
0 |
0.000 |
66 |
|
0 |
20 |
3 |
365891 |
◊ |
0 |
-x+1,y,-z+1/2 |
3_655 |
20 |
3 |
365891 |
117.7 |
1.5 |
0.957 |
2 |
0 |
0 |
0.000 |
67 |
|
N |
17 |
7 |
10950 |
◊ |
0 |
x-1/2,y-1/2,z |
5_445 |
16 |
2 |
365891 |
115.8 |
-2.6 |
0.444 |
0 |
0 |
0 |
0.000 |
68 |
|
[OMG]0:2588 |
14 |
1 |
503 |
cf |
[OMU]0:2587 |
x,y,z |
1_555 |
12 |
1 |
455 |
94.5 |
-0.7 |
0.533 |
0 |
0 |
0 |
0.001 |
69 |
|
0 |
16 |
6 |
365891 |
◊ |
E |
-x,y,-z+1/2 |
3_555 |
14 |
5 |
10196 |
87.8 |
0.0 |
0.743 |
0 |
0 |
0 |
0.000 |
70 |
|
[CL]0:9305 |
1 |
1 |
125 |
f |
0 |
x,y,z |
1_555 |
18 |
7 |
365891 |
85.1 |
-11.4 |
0.000 |
0 |
0 |
0 |
0.018 |
71 |
|
T |
16 |
5 |
8092 |
◊ |
C |
x,y,z |
1_555 |
12 |
5 |
14359 |
84.7 |
-1.2 |
0.286 |
0 |
0 |
0 |
0.000 |
72 |
|
[ACA]4:78 |
4 |
1 |
195 |
◊ |
0 |
x,y,z |
1_555 |
17 |
7 |
365891 |
83.3 |
2.8 |
0.086 |
1 |
0 |
0 |
0.000 |
73 |
|
[CL]R:9306 |
1 |
1 |
125 |
f |
R |
x,y,z |
1_555 |
9 |
4 |
8426 |
73.4 |
-9.6 |
0.000 |
0 |
0 |
0 |
0.100 |
74 |
|
[CL]M:9318 |
1 |
1 |
125 |
f |
M |
x,y,z |
1_555 |
10 |
7 |
12357 |
68.4 |
-12.5 |
0.000 |
0 |
0 |
0 |
0.100 |
75 |
|
[CL]0:9315 |
1 |
1 |
125 |
f |
0 |
x,y,z |
1_555 |
14 |
6 |
365891 |
68.1 |
-9.8 |
0.000 |
0 |
0 |
0 |
0.015 |
76 |
|
[CL]3:9304 |
1 |
1 |
125 |
f |
3 |
x,y,z |
1_555 |
13 |
6 |
7736 |
67.7 |
-10.3 |
0.000 |
0 |
0 |
0 |
0.100 |
77 |
|
[CL]0:9313 |
1 |
1 |
125 |
f |
0 |
x,y,z |
1_555 |
10 |
4 |
365891 |
66.7 |
-9.3 |
0.000 |
0 |
0 |
0 |
0.014 |
78 |
|
[1MA]0:628 |
8 |
1 |
499 |
◊ |
Y |
x,y,z |
1_555 |
6 |
3 |
10458 |
66.0 |
-2.3 |
0.212 |
0 |
0 |
0 |
0.002 |
79 |
|
W |
9 |
2 |
8163 |
◊ |
0 |
x-1/2,y-1/2,z |
5_445 |
12 |
1 |
365891 |
65.7 |
-1.1 |
0.301 |
0 |
0 |
0 |
0.000 |
80 |
|
[CD]O:9205 |
1 |
1 |
112 |
f |
O |
x,y,z |
1_555 |
16 |
6 |
6485 |
65.6 |
-7.3 |
0.000 |
0 |
0 |
0 |
0.050 |
81 |
|
[ACA]4:78 |
4 |
1 |
195 |
cf |
4 |
x,y,z |
1_555 |
9 |
1 |
1059 |
65.0 |
2.1 |
0.069 |
0 |
0 |
0 |
0.000 |
82 |
|
[CL]J:9302 |
1 |
1 |
125 |
f |
J |
x,y,z |
1_555 |
9 |
4 |
8473 |
64.0 |
-9.9 |
0.000 |
0 |
0 |
0 |
0.036 |
83 |
|
[CL]Y:9320 |
1 |
1 |
125 |
f |
0 |
x,y,z |
1_555 |
15 |
5 |
365891 |
63.2 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.009 |
84 |
|
[CL]0:9322 |
1 |
1 |
125 |
f |
0 |
x,y,z |
1_555 |
10 |
3 |
365891 |
63.0 |
-9.3 |
0.000 |
0 |
0 |
0 |
0.014 |
85 |
|
[CL]J:9301 |
1 |
1 |
125 |
f |
J |
x,y,z |
1_555 |
13 |
5 |
8473 |
62.8 |
-8.9 |
0.000 |
0 |
0 |
0 |
0.033 |
86 |
|
[CL]0:9314 |
1 |
1 |
125 |
f |
L |
x,y,z |
1_555 |
13 |
4 |
11390 |
61.6 |
-6.8 |
0.000 |
0 |
0 |
0 |
0.045 |
87 |
|
[CL]O:9308 |
1 |
1 |
125 |
f |
O |
x,y,z |
1_555 |
11 |
4 |
6485 |
61.4 |
-7.3 |
0.000 |
0 |
0 |
0 |
0.050 |
88 |
|
[CL]A:9309 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
14203 |
59.9 |
-8.4 |
0.000 |
0 |
0 |
0 |
0.100 |
89 |
|
[CL]N:9307 |
1 |
1 |
125 |
f |
N |
x,y,z |
1_555 |
10 |
4 |
10950 |
59.1 |
-8.3 |
0.000 |
0 |
0 |
0 |
0.118 |
90 |
|
[CL]0:9303 |
1 |
1 |
125 |
f |
0 |
x,y,z |
1_555 |
11 |
5 |
365891 |
58.9 |
-7.4 |
0.000 |
0 |
0 |
0 |
0.012 |
91 |
|
[CL]L:9310 |
1 |
1 |
125 |
f |
L |
x,y,z |
1_555 |
12 |
4 |
11390 |
58.9 |
-8.2 |
0.000 |
0 |
0 |
0 |
0.055 |
92 |
|
[CL]0:9311 |
1 |
1 |
125 |
f |
Q |
x,y,z |
1_555 |
12 |
6 |
6601 |
58.8 |
-8.9 |
0.000 |
0 |
0 |
0 |
0.100 |
93 |
|
[CL]J:9321 |
1 |
1 |
125 |
f |
J |
x,y,z |
1_555 |
11 |
6 |
8473 |
58.1 |
-8.4 |
0.000 |
0 |
0 |
0 |
0.031 |
94 |
|
[CL]B:9319 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
18360 |
58.1 |
-8.5 |
0.000 |
0 |
0 |
0 |
0.100 |
95 |
|
Y |
7 |
1 |
10458 |
◊ |
L |
x,y,z |
1_555 |
9 |
4 |
11390 |
56.1 |
0.7 |
0.635 |
0 |
0 |
0 |
0.000 |
96 |
|
[CL]0:9317 |
1 |
1 |
125 |
◊ |
Y |
x,y,z |
1_555 |
7 |
3 |
10458 |
55.3 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.006 |
97 |
|
[CL]0:9316 |
1 |
1 |
125 |
◊ |
J |
x,y,z |
1_555 |
6 |
3 |
8473 |
53.1 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.007 |
98 |
|
[CL]0:9316 |
1 |
1 |
125 |
f |
0 |
x,y,z |
1_555 |
9 |
3 |
365891 |
53.1 |
-6.6 |
0.000 |
0 |
0 |
0 |
0.010 |
99 |
|
[K]0:9002 |
1 |
1 |
216 |
◊ |
M |
x,y,z |
1_555 |
8 |
1 |
12357 |
52.5 |
-28.7 |
0.000 |
0 |
0 |
0 |
0.033 |
100 |
|
[CL]K:9312 |
1 |
1 |
125 |
f |
K |
x,y,z |
1_555 |
9 |
4 |
7215 |
51.0 |
-6.9 |
0.000 |
0 |
0 |
0 |
0.100 |
101 |
|
[CL]0:9317 |
1 |
1 |
125 |
f |
0 |
x,y,z |
1_555 |
10 |
3 |
365891 |
50.9 |
-6.9 |
0.000 |
0 |
0 |
0 |
0.011 |
102 |
|
[CL]K:9312 |
1 |
1 |
125 |
◊ |
0 |
x,y,z |
1_555 |
11 |
4 |
365891 |
47.8 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.007 |
103 |
|
9 |
7 |
2 |
19936 |
◊ |
B |
-x+1/2,y-1/2,-z+1/2 |
7_545 |
5 |
2 |
18360 |
45.8 |
0.1 |
0.709 |
2 |
0 |
0 |
0.000 |
104 |
|
[CL]Y:9320 |
1 |
1 |
125 |
◊ |
Y |
x,y,z |
1_555 |
6 |
3 |
10458 |
44.5 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.004 |
105 |
|
[CL]0:9314 |
1 |
1 |
125 |
◊ |
0 |
x,y,z |
1_555 |
9 |
1 |
365891 |
43.2 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.005 |
106 |
|
[CL]O:9308 |
1 |
1 |
125 |
◊ |
0 |
x,y,z |
1_555 |
10 |
2 |
365891 |
42.4 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.007 |
107 |
|
[CL]B:9319 |
1 |
1 |
125 |
◊ |
0 |
x,y,z |
1_555 |
4 |
3 |
365891 |
39.2 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.003 |
108 |
|
[SPS]4:9701 |
5 |
1 |
571 |
f |
[UR3]0:2619 |
x,y,z |
1_555 |
3 |
1 |
455 |
38.0 |
-1.3 |
0.355 |
0 |
0 |
0 |
0.002 |
109 |
|
[CL]0:9311 |
1 |
1 |
125 |
◊ |
0 |
x,y,z |
1_555 |
6 |
2 |
365891 |
34.9 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.005 |
110 |
|
[CL]L:9310 |
1 |
1 |
125 |
◊ |
0 |
x,y,z |
1_555 |
6 |
2 |
365891 |
34.8 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.004 |
111 |
|
0 |
6 |
2 |
365891 |
◊ |
F |
x,-y+1,-z |
4_565 |
4 |
1 |
6124 |
33.6 |
-2.0 |
0.346 |
0 |
0 |
0 |
0.000 |
112 |
|
[CL]N:9307 |
1 |
1 |
125 |
◊ |
D |
x,y,z |
1_555 |
3 |
1 |
9582 |
31.8 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.004 |
113 |
|
[CL]J:9321 |
1 |
1 |
125 |
◊ |
0 |
x,y,z |
1_555 |
6 |
2 |
365891 |
31.2 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.005 |
114 |
|
[SPS]4:9701 |
4 |
1 |
571 |
◊ |
[ACA]4:78 |
x,y,z |
1_555 |
3 |
1 |
195 |
30.0 |
0.3 |
0.588 |
0 |
0 |
0 |
0.000 |
115 |
|
D |
6 |
1 |
9582 |
◊ |
B |
-x+1/2,y-1/2,-z+1/2 |
7_545 |
2 |
1 |
18360 |
28.6 |
-0.3 |
0.530 |
0 |
0 |
0 |
0.000 |
116 |
|
[CL]0:9303 |
1 |
1 |
125 |
◊ |
2 |
x,y,z |
1_555 |
2 |
1 |
5062 |
28.4 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.005 |
117 |
|
3 |
4 |
1 |
7736 |
◊ |
L |
x,y,z |
1_555 |
2 |
1 |
11390 |
26.6 |
0.6 |
0.544 |
0 |
0 |
0 |
0.000 |
118 |
|
[CL]J:9301 |
1 |
1 |
125 |
◊ |
E |
x,y,z |
1_555 |
2 |
1 |
10196 |
26.0 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.004 |
119 |
|
G |
5 |
2 |
2781 |
◊ |
0 |
-x+1/2,y-1/2,-z+1/2 |
7_545 |
4 |
1 |
365891 |
21.9 |
0.3 |
0.699 |
0 |
0 |
0 |
0.000 |
120 |
|
[CL]A:9309 |
1 |
1 |
125 |
◊ |
0 |
x,y,z |
1_555 |
5 |
3 |
365891 |
17.9 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.004 |
121 |
|
[CL]0:9313 |
1 |
1 |
125 |
◊ |
Y |
x,y,z |
1_555 |
1 |
1 |
10458 |
13.8 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.000 |
122 |
|
[CL]R:9306 |
1 |
1 |
125 |
◊ |
0 |
x,y,z |
1_555 |
4 |
1 |
365891 |
11.9 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.001 |
123 |
|
[CL]Y:9320 |
1 |
1 |
125 |
f |
[CL]0:9313 |
x,y,z |
1_555 |
1 |
1 |
125 |
7.4 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.002 |
124 |
|
[CL]N:9307 |
1 |
1 |
125 |
◊ |
9 |
x,y,z |
1_555 |
2 |
2 |
19936 |
6.9 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.015 |
125 |
|
[CL]0:9322 |
1 |
1 |
125 |
◊ |
W |
x,y,z |
1_555 |
2 |
1 |
8163 |
6.8 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.000 |
126 |
|
N |
1 |
1 |
10950 |
◊ |
P |
x-1/2,y-1/2,z |
5_445 |
1 |
1 |
10705 |
4.9 |
-0.0 |
0.480 |
0 |
0 |
0 |
0.000 |
127 |
|
[UR3]0:2619 |
2 |
1 |
455 |
◊ |
4 |
x,y,z |
1_555 |
1 |
1 |
1059 |
4.6 |
-0.1 |
0.555 |
0 |
0 |
0 |
0.000 |
128 |
|
[CL]J:9301 |
1 |
1 |
125 |
◊ |
0 |
x,y,z |
1_555 |
1 |
1 |
365891 |
3.6 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.000 |
129 |
|
[CD]O:9205 |
1 |
1 |
112 |
◊ |
0 |
x,y,z |
1_555 |
1 |
1 |
365891 |
3.5 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.000 |
130 |
|
[CL]J:9302 |
1 |
1 |
125 |
◊ |
0 |
x,y,z |
1_555 |
1 |
1 |
365891 |
2.5 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.000 |
131 |
|
M |
1 |
1 |
12357 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
14203 |
1.8 |
0.0 |
0.594 |
0 |
0 |
0 |
0.000 |
132 |
|
[CD]Z:9203 |
1 |
1 |
112 |
f |
0 |
x,y,z |
1_555 |
1 |
1 |
365891 |
1.1 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.000 |
|