## |
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 |
|
B |
250 |
60 |
11973 |
◊ |
A |
x,y,z |
1_555 |
277 |
73 |
11394 |
2486.6 |
-23.6 |
0.141 |
43 |
9 |
0 |
1.000 |
2 |
|
E |
246 |
59 |
11811 |
◊ |
D |
x,y,z |
1_555 |
275 |
74 |
11585 |
2478.3 |
-24.0 |
0.141 |
41 |
9 |
0 |
1.000 |
Average: |
2482.4 |
-23.8 |
0.141 |
42 |
9 |
0 |
1.000 |
2 |
3 |
|
G |
213 |
60 |
11317 |
◊ |
H |
x,y,z |
1_555 |
195 |
55 |
11905 |
1785.0 |
-25.1 |
0.056 |
14 |
1 |
0 |
0.856 |
4 |
|
I |
199 |
53 |
11292 |
◊ |
J |
x,y,z |
1_555 |
173 |
49 |
11469 |
1662.8 |
-22.5 |
0.067 |
15 |
2 |
0 |
0.856 |
Average: |
1723.9 |
-23.8 |
0.062 |
15 |
2 |
0 |
0.856 |
3 |
5 |
|
C |
66 |
12 |
1716 |
◊ |
B |
x,y,z |
1_555 |
77 |
23 |
11973 |
631.7 |
-5.3 |
0.547 |
11 |
2 |
0 |
1.000 |
6 |
|
F |
68 |
12 |
1719 |
◊ |
E |
x,y,z |
1_555 |
77 |
23 |
11811 |
631.2 |
-5.9 |
0.515 |
10 |
3 |
0 |
1.000 |
Average: |
631.5 |
-5.6 |
0.531 |
11 |
3 |
0 |
1.000 |
4 |
7 |
|
E |
62 |
19 |
11811 |
◊ |
B |
x,y,z |
1_555 |
65 |
19 |
11973 |
608.1 |
-4.6 |
0.300 |
12 |
4 |
0 |
0.000 |
5 |
8 |
|
H |
51 |
14 |
11905 |
◊ |
A |
x,y,z |
1_555 |
61 |
16 |
11394 |
538.4 |
-5.2 |
0.387 |
5 |
1 |
0 |
0.098 |
9 |
|
J |
46 |
14 |
11469 |
◊ |
D |
x,y,z |
1_555 |
61 |
15 |
11585 |
534.7 |
-5.6 |
0.355 |
6 |
2 |
0 |
0.098 |
Average: |
536.6 |
-5.4 |
0.371 |
6 |
2 |
0 |
0.098 |
6 |
10 |
|
F |
53 |
13 |
1719 |
◊ |
D |
x,y,z |
1_555 |
69 |
21 |
11585 |
536.8 |
-7.1 |
0.565 |
8 |
0 |
0 |
0.344 |
11 |
|
C |
52 |
13 |
1716 |
◊ |
A |
x,y,z |
1_555 |
69 |
21 |
11394 |
531.0 |
-6.7 |
0.580 |
7 |
0 |
0 |
0.344 |
Average: |
533.9 |
-6.9 |
0.573 |
8 |
0 |
0 |
0.344 |
7 |
12 |
|
G |
47 |
15 |
11317 |
◊ |
E |
-x,y-1/2,-z-1/2 |
3_544 |
41 |
14 |
11811 |
404.6 |
3.1 |
0.815 |
8 |
5 |
0 |
0.000 |
13 |
|
B |
38 |
13 |
11973 |
◊ |
I |
-x,y-1/2,-z-1/2 |
3_544 |
44 |
13 |
11292 |
381.8 |
4.2 |
0.853 |
9 |
6 |
0 |
0.000 |
Average: |
393.2 |
3.7 |
0.834 |
9 |
6 |
0 |
0.000 |
8 |
14 |
|
H |
42 |
15 |
11905 |
◊ |
D |
x-1/2,-y-1/2,-z |
4_445 |
39 |
11 |
11585 |
383.7 |
-0.5 |
0.737 |
6 |
0 |
0 |
0.000 |
9 |
15 |
|
A |
33 |
8 |
11394 |
◊ |
J |
x-1/2,-y+1/2,-z |
4_455 |
40 |
15 |
11469 |
320.3 |
-0.5 |
0.681 |
4 |
1 |
0 |
0.000 |
10 |
16 |
|
H |
35 |
12 |
11905 |
◊ |
J |
-x,y-3/2,-z-1/2 |
3_534 |
23 |
6 |
11469 |
269.1 |
-3.5 |
0.361 |
1 |
0 |
0 |
0.000 |
11 |
17 |
|
G |
25 |
7 |
11317 |
◊ |
I |
x,y-1,z |
1_545 |
25 |
8 |
11292 |
249.3 |
2.0 |
0.823 |
4 |
0 |
0 |
0.000 |
12 |
18 |
|
G |
25 |
10 |
11317 |
◊ |
J |
x-1,y-1,z |
1_445 |
28 |
9 |
11469 |
241.3 |
-0.9 |
0.571 |
1 |
0 |
0 |
0.000 |
13 |
19 |
|
C |
19 |
7 |
1716 |
◊ |
H |
x,y,z |
1_555 |
25 |
8 |
11905 |
205.1 |
-4.1 |
0.273 |
1 |
0 |
0 |
0.050 |
20 |
|
F |
20 |
7 |
1719 |
◊ |
J |
x,y,z |
1_555 |
20 |
7 |
11469 |
197.7 |
-4.0 |
0.254 |
1 |
0 |
0 |
0.050 |
Average: |
201.4 |
-4.0 |
0.264 |
1 |
0 |
0 |
0.050 |
14 |
21 |
|
H |
17 |
6 |
11905 |
◊ |
B |
x,y,z |
1_555 |
23 |
5 |
11973 |
194.1 |
1.7 |
0.741 |
5 |
3 |
0 |
0.015 |
22 |
|
J |
17 |
6 |
11469 |
◊ |
E |
x,y,z |
1_555 |
21 |
5 |
11811 |
190.3 |
1.8 |
0.770 |
6 |
3 |
0 |
0.015 |
Average: |
192.2 |
1.8 |
0.755 |
6 |
3 |
0 |
0.015 |
15 |
23 |
|
H |
22 |
9 |
11905 |
◊ |
E |
x,y-1,z |
1_545 |
18 |
7 |
11811 |
179.5 |
0.9 |
0.737 |
1 |
2 |
0 |
0.000 |
16 |
24 |
|
I |
18 |
6 |
11292 |
◊ |
E |
x,y,z |
1_555 |
21 |
5 |
11811 |
172.0 |
0.4 |
0.624 |
2 |
4 |
0 |
0.012 |
17 |
25 |
|
G |
18 |
6 |
11317 |
◊ |
B |
x,y,z |
1_555 |
20 |
5 |
11973 |
162.6 |
0.1 |
0.585 |
2 |
4 |
0 |
0.015 |
18 |
26 |
|
[NAG]N:1 |
10 |
1 |
363 |
cf |
D |
x,y,z |
1_555 |
23 |
7 |
11585 |
146.4 |
4.8 |
0.603 |
0 |
0 |
0 |
0.000 |
19 |
27 |
|
D |
15 |
6 |
11585 |
◊ |
I |
-x+1,y-1/2,-z-1/2 |
3_644 |
16 |
4 |
11292 |
136.7 |
-0.5 |
0.402 |
1 |
0 |
0 |
0.000 |
20 |
28 |
|
[NAG]K:1 |
11 |
1 |
360 |
cf |
A |
x,y,z |
1_555 |
20 |
7 |
11394 |
135.8 |
4.6 |
0.550 |
0 |
0 |
0 |
0.000 |
21 |
29 |
|
[IPA]J:302 |
4 |
1 |
198 |
f |
J |
x,y,z |
1_555 |
25 |
14 |
11469 |
127.8 |
4.0 |
0.518 |
1 |
0 |
0 |
0.000 |
22 |
30 |
|
[IPA]H:303 |
4 |
1 |
198 |
f |
H |
x,y,z |
1_555 |
27 |
13 |
11905 |
127.1 |
3.9 |
0.383 |
1 |
0 |
0 |
0.000 |
23 |
31 |
|
I |
19 |
5 |
11292 |
◊ |
D |
x,y,z |
1_555 |
13 |
4 |
11585 |
123.7 |
-1.8 |
0.295 |
1 |
0 |
0 |
0.025 |
24 |
32 |
|
G |
21 |
5 |
11317 |
◊ |
A |
x,y,z |
1_555 |
13 |
4 |
11394 |
123.6 |
-1.7 |
0.313 |
1 |
0 |
0 |
0.023 |
25 |
33 |
|
[BMA]L:5 |
9 |
1 |
294 |
◊ |
E |
-x,y-1/2,-z-1/2 |
3_544 |
14 |
6 |
11811 |
121.6 |
2.7 |
0.466 |
0 |
0 |
0 |
0.000 |
34 |
|
B |
13 |
5 |
11973 |
◊ |
[BMA]O:4 |
-x,y-1/2,-z-1/2 |
3_544 |
9 |
1 |
297 |
115.8 |
2.0 |
0.371 |
0 |
0 |
0 |
0.000 |
Average: |
118.7 |
2.3 |
0.419 |
0 |
0 |
0 |
0.000 |
26 |
35 |
|
[IPA]G:301 |
4 |
1 |
198 |
f |
G |
x,y,z |
1_555 |
21 |
8 |
11317 |
119.7 |
4.5 |
0.506 |
1 |
0 |
0 |
0.000 |
27 |
36 |
|
[IPA]H:301 |
4 |
1 |
199 |
◊ |
H |
x,y,z |
1_555 |
17 |
10 |
11905 |
102.3 |
3.1 |
0.467 |
1 |
0 |
0 |
0.000 |
28 |
37 |
|
[IPA]J:301 |
4 |
1 |
197 |
◊ |
J |
x,y,z |
1_555 |
18 |
10 |
11469 |
101.5 |
2.9 |
0.469 |
1 |
0 |
0 |
0.000 |
29 |
38 |
|
[IPA]D:205 |
4 |
1 |
199 |
f |
D |
x,y,z |
1_555 |
17 |
7 |
11585 |
91.1 |
3.4 |
0.290 |
0 |
0 |
0 |
0.000 |
30 |
39 |
|
[IPA]B:1008 |
4 |
1 |
197 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
11973 |
88.5 |
2.9 |
0.282 |
3 |
0 |
0 |
0.000 |
31 |
40 |
|
[IPA]D:206 |
3 |
1 |
199 |
◊ |
D |
x,y,z |
1_555 |
14 |
5 |
11585 |
87.4 |
2.4 |
0.259 |
1 |
0 |
0 |
0.000 |
32 |
41 |
|
[NAG]O:1 |
10 |
1 |
363 |
cf |
E |
x,y,z |
1_555 |
11 |
2 |
11811 |
83.5 |
2.0 |
0.263 |
0 |
0 |
0 |
0.000 |
33 |
42 |
|
C |
10 |
5 |
1716 |
◊ |
G |
x,y,z |
1_555 |
10 |
4 |
11317 |
83.5 |
-0.4 |
0.566 |
1 |
0 |
0 |
0.009 |
34 |
43 |
|
[IPA]A:1005 |
4 |
1 |
198 |
◊ |
A |
x,y,z |
1_555 |
13 |
5 |
11394 |
82.7 |
1.9 |
0.250 |
1 |
0 |
0 |
0.000 |
35 |
44 |
|
[NAG]L:1 |
12 |
1 |
360 |
cf |
B |
x,y,z |
1_555 |
10 |
2 |
11973 |
81.4 |
2.1 |
0.190 |
0 |
0 |
0 |
0.000 |
36 |
45 |
|
F |
12 |
5 |
1719 |
◊ |
I |
x,y,z |
1_555 |
10 |
4 |
11292 |
81.0 |
-0.4 |
0.573 |
1 |
0 |
0 |
0.009 |
37 |
46 |
|
E |
10 |
4 |
11811 |
◊ |
A |
x,y,z |
1_555 |
10 |
3 |
11394 |
80.0 |
-0.0 |
0.587 |
0 |
0 |
0 |
0.000 |
38 |
47 |
|
[CL]H:305 |
1 |
1 |
125 |
f |
H |
x,y,z |
1_555 |
17 |
8 |
11905 |
77.6 |
-9.7 |
0.000 |
0 |
0 |
0 |
0.196 |
39 |
48 |
|
[NAG]M:2 |
10 |
1 |
362 |
cf |
[NAG]M:1 |
x,y,z |
1_555 |
5 |
1 |
359 |
76.6 |
2.3 |
0.149 |
1 |
0 |
0 |
0.000 |
40 |
49 |
|
[FUC]L:7 |
8 |
1 |
283 |
f |
B |
x,y,z |
1_555 |
16 |
4 |
11973 |
76.1 |
2.1 |
0.399 |
0 |
0 |
0 |
0.000 |
41 |
50 |
|
[IPA]A:1004 |
4 |
1 |
197 |
f |
A |
x,y,z |
1_555 |
15 |
7 |
11394 |
75.8 |
2.1 |
0.283 |
2 |
0 |
0 |
0.000 |
42 |
51 |
|
B |
8 |
3 |
11973 |
◊ |
D |
x,y,z |
1_555 |
9 |
3 |
11585 |
74.6 |
-0.2 |
0.515 |
2 |
0 |
0 |
0.000 |
43 |
52 |
|
[NAG]N:2 |
9 |
1 |
357 |
cf |
[NAG]N:1 |
x,y,z |
1_555 |
5 |
1 |
363 |
72.6 |
1.6 |
0.093 |
0 |
0 |
0 |
0.000 |
44 |
53 |
|
[FUC]L:6 |
5 |
1 |
280 |
cf |
[NAG]L:1 |
x,y,z |
1_555 |
8 |
1 |
360 |
72.1 |
2.4 |
0.159 |
0 |
0 |
0 |
0.000 |
45 |
54 |
|
[NAG]L:2 |
9 |
1 |
363 |
cf |
[NAG]L:1 |
x,y,z |
1_555 |
7 |
1 |
360 |
71.6 |
1.5 |
0.084 |
0 |
0 |
0 |
0.000 |
46 |
55 |
|
[NAG]K:2 |
8 |
1 |
362 |
cf |
[NAG]K:1 |
x,y,z |
1_555 |
7 |
1 |
360 |
70.8 |
1.7 |
0.112 |
0 |
0 |
0 |
0.000 |
56 |
|
[NAG]O:2 |
9 |
1 |
362 |
cf |
[NAG]O:1 |
x,y,z |
1_555 |
7 |
1 |
363 |
70.4 |
1.7 |
0.086 |
0 |
0 |
0 |
0.000 |
Average: |
70.6 |
1.7 |
0.099 |
0 |
0 |
0 |
0.000 |
47 |
57 |
|
H |
8 |
3 |
11905 |
◊ |
[BMA]L:4 |
-x,y-1/2,-z-1/2 |
3_544 |
7 |
1 |
293 |
70.7 |
1.3 |
0.313 |
2 |
0 |
0 |
0.000 |
48 |
58 |
|
[CL]H:304 |
1 |
1 |
125 |
f |
H |
x,y,z |
1_555 |
13 |
7 |
11905 |
69.9 |
-12.1 |
0.000 |
0 |
0 |
0 |
0.353 |
59 |
|
[CL]J:304 |
1 |
1 |
125 |
f |
J |
x,y,z |
1_555 |
12 |
6 |
11469 |
68.9 |
-12.1 |
0.000 |
0 |
0 |
0 |
0.353 |
Average: |
69.4 |
-12.1 |
0.000 |
0 |
0 |
0 |
0.353 |
49 |
60 |
|
[FUC]L:6 |
7 |
1 |
280 |
f |
[NAG]L:2 |
x,y,z |
1_555 |
9 |
1 |
363 |
66.4 |
1.9 |
0.100 |
1 |
0 |
0 |
0.000 |
50 |
61 |
|
[BMA]L:3 |
7 |
1 |
293 |
cf |
[NAG]L:2 |
x,y,z |
1_555 |
5 |
1 |
363 |
62.8 |
1.2 |
0.110 |
1 |
0 |
0 |
0.000 |
51 |
62 |
|
[BMA]O:3 |
7 |
1 |
294 |
cf |
[NAG]O:2 |
x,y,z |
1_555 |
5 |
1 |
362 |
62.2 |
1.1 |
0.103 |
1 |
0 |
0 |
0.000 |
52 |
63 |
|
[BMA]L:4 |
6 |
1 |
293 |
cf |
[BMA]L:3 |
x,y,z |
1_555 |
7 |
1 |
293 |
61.3 |
2.6 |
0.186 |
0 |
0 |
0 |
0.000 |
53 |
64 |
|
[IPA]H:302 |
4 |
1 |
199 |
◊ |
H |
x,y,z |
1_555 |
7 |
3 |
11905 |
58.3 |
1.7 |
0.191 |
0 |
0 |
0 |
0.000 |
54 |
65 |
|
[CL]G:302 |
1 |
1 |
125 |
f |
G |
x,y,z |
1_555 |
9 |
5 |
11317 |
57.2 |
-6.8 |
0.000 |
0 |
0 |
0 |
0.338 |
55 |
66 |
|
[FUC]L:7 |
6 |
1 |
283 |
cf |
[NAG]L:1 |
x,y,z |
1_555 |
4 |
1 |
360 |
55.8 |
2.0 |
0.206 |
0 |
0 |
0 |
0.000 |
56 |
67 |
|
[NAG]M:1 |
7 |
1 |
359 |
cf |
D |
x,y,z |
1_555 |
5 |
1 |
11585 |
55.8 |
1.7 |
0.377 |
0 |
0 |
0 |
0.000 |
57 |
68 |
|
[NAG]A:1003 |
6 |
1 |
354 |
cf |
A |
x,y,z |
1_555 |
4 |
2 |
11394 |
55.3 |
1.7 |
0.400 |
0 |
0 |
0 |
0.000 |
58 |
69 |
|
[BMA]O:4 |
7 |
1 |
297 |
f |
[NAG]O:2 |
x,y,z |
1_555 |
6 |
1 |
362 |
55.3 |
1.7 |
0.151 |
0 |
0 |
0 |
0.000 |
59 |
70 |
|
[IPA]J:303 |
4 |
1 |
198 |
f |
J |
x,y,z |
1_555 |
7 |
2 |
11469 |
55.0 |
0.8 |
0.539 |
1 |
0 |
0 |
0.000 |
60 |
71 |
|
[IPA]B:1008 |
3 |
1 |
197 |
◊ |
E |
x,y,z |
1_555 |
9 |
5 |
11811 |
54.9 |
1.8 |
0.257 |
0 |
0 |
0 |
0.000 |
61 |
72 |
|
B |
11 |
4 |
11973 |
◊ |
[BMA]O:3 |
-x,y-1/2,-z-1/2 |
3_544 |
3 |
1 |
294 |
53.9 |
0.2 |
0.371 |
0 |
0 |
0 |
0.000 |
62 |
73 |
|
[BMA]L:5 |
5 |
1 |
294 |
f |
[NAG]L:2 |
x,y,z |
1_555 |
5 |
1 |
363 |
52.8 |
1.4 |
0.179 |
0 |
0 |
0 |
0.000 |
63 |
74 |
|
[BMA]L:3 |
3 |
1 |
293 |
◊ |
E |
-x,y-1/2,-z-1/2 |
3_544 |
12 |
5 |
11811 |
51.3 |
0.2 |
0.360 |
0 |
0 |
0 |
0.000 |
64 |
75 |
|
[BMA]L:5 |
5 |
1 |
294 |
cf |
[BMA]L:3 |
x,y,z |
1_555 |
3 |
1 |
293 |
51.1 |
1.8 |
0.296 |
0 |
0 |
0 |
0.000 |
65 |
76 |
|
[BMA]O:4 |
5 |
1 |
297 |
cf |
[BMA]O:3 |
x,y,z |
1_555 |
4 |
1 |
294 |
51.0 |
2.1 |
0.317 |
0 |
0 |
0 |
0.000 |
66 |
77 |
|
G |
4 |
1 |
11317 |
◊ |
[FUC]L:6 |
-x,y-1/2,-z-1/2 |
3_544 |
7 |
1 |
280 |
45.0 |
1.2 |
0.311 |
1 |
0 |
0 |
0.000 |
67 |
78 |
|
A |
4 |
1 |
11394 |
◊ |
[NAG]A:1003 |
x-1/2,-y-1/2,-z |
4_445 |
6 |
1 |
354 |
44.8 |
1.7 |
0.320 |
2 |
0 |
0 |
0.000 |
68 |
79 |
|
[NAG]N:2 |
4 |
1 |
357 |
f |
D |
x,y,z |
1_555 |
4 |
2 |
11585 |
42.0 |
1.5 |
0.557 |
0 |
0 |
0 |
0.000 |
69 |
80 |
|
[IPA]J:303 |
3 |
1 |
198 |
◊ |
F |
x,y,z |
1_555 |
5 |
2 |
1719 |
40.4 |
1.3 |
0.289 |
0 |
0 |
0 |
0.000 |
70 |
81 |
|
[IPA]J:303 |
3 |
1 |
198 |
◊ |
E |
x,y,z |
1_555 |
8 |
1 |
11811 |
39.6 |
0.9 |
0.000 |
0 |
0 |
0 |
0.000 |
71 |
82 |
|
[IPA]J:301 |
2 |
1 |
197 |
◊ |
D |
x,y,z |
1_555 |
5 |
2 |
11585 |
37.9 |
1.5 |
0.603 |
0 |
0 |
0 |
0.000 |
72 |
83 |
|
[IPA]H:301 |
3 |
1 |
199 |
◊ |
A |
x,y,z |
1_555 |
5 |
2 |
11394 |
37.3 |
1.5 |
0.302 |
0 |
0 |
0 |
0.000 |
73 |
84 |
|
[IPA]H:302 |
4 |
1 |
199 |
◊ |
B |
x,y,z |
1_555 |
8 |
1 |
11973 |
37.0 |
0.8 |
0.608 |
0 |
0 |
0 |
0.000 |
74 |
85 |
|
[IPA]D:206 |
2 |
1 |
199 |
f |
E |
x,y,z |
1_555 |
6 |
1 |
11811 |
36.7 |
1.2 |
0.523 |
0 |
0 |
0 |
0.000 |
75 |
86 |
|
[FUC]L:7 |
3 |
1 |
283 |
f |
[NAG]L:2 |
x,y,z |
1_555 |
6 |
1 |
363 |
36.6 |
1.9 |
0.258 |
0 |
0 |
0 |
0.000 |
76 |
87 |
|
G |
6 |
3 |
11317 |
◊ |
D |
x-1/2,-y-1/2,-z |
4_445 |
3 |
1 |
11585 |
36.4 |
-0.0 |
0.617 |
1 |
0 |
0 |
0.000 |
77 |
88 |
|
[NAG]M:2 |
4 |
1 |
362 |
◊ |
D |
x-1/2,-y+1/2,-z |
4_455 |
4 |
1 |
11585 |
35.7 |
0.6 |
0.423 |
1 |
0 |
0 |
0.000 |
78 |
89 |
|
[IPA]J:301 |
3 |
1 |
197 |
f |
I |
x,y,z |
1_555 |
6 |
1 |
11292 |
34.4 |
0.7 |
0.686 |
0 |
0 |
0 |
0.000 |
79 |
90 |
|
[IPA]H:301 |
3 |
1 |
199 |
f |
G |
x,y,z |
1_555 |
5 |
1 |
11317 |
33.4 |
0.7 |
0.660 |
0 |
0 |
0 |
0.000 |
80 |
91 |
|
[IPA]H:302 |
3 |
1 |
199 |
f |
C |
x,y,z |
1_555 |
4 |
2 |
1716 |
33.0 |
0.4 |
0.811 |
1 |
0 |
0 |
0.100 |
81 |
92 |
|
[IPA]A:1005 |
2 |
1 |
198 |
f |
B |
x,y,z |
1_555 |
5 |
1 |
11973 |
29.9 |
0.9 |
0.481 |
0 |
0 |
0 |
0.000 |
82 |
93 |
|
[NAG]N:2 |
2 |
1 |
357 |
◊ |
E |
x,y,z |
1_555 |
3 |
1 |
11811 |
27.9 |
0.4 |
0.364 |
0 |
0 |
0 |
0.000 |
83 |
94 |
|
[BMA]L:4 |
4 |
1 |
293 |
f |
[NAG]L:2 |
x,y,z |
1_555 |
2 |
1 |
363 |
25.4 |
0.6 |
0.162 |
0 |
0 |
0 |
0.000 |
84 |
95 |
|
H |
2 |
2 |
11905 |
◊ |
J |
x,y-1,z |
1_545 |
1 |
1 |
11469 |
14.5 |
0.3 |
0.826 |
0 |
0 |
0 |
0.000 |
85 |
96 |
|
[CL]G:302 |
1 |
1 |
125 |
◊ |
[BMA]O:4 |
-x,y-1/2,-z-1/2 |
3_544 |
2 |
1 |
297 |
13.2 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.000 |
86 |
97 |
|
[CL]G:302 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
3 |
2 |
11973 |
12.7 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.016 |
87 |
98 |
|
G |
1 |
1 |
11317 |
◊ |
[NAG]L:2 |
-x,y-1/2,-z-1/2 |
3_544 |
1 |
1 |
363 |
12.4 |
0.6 |
0.523 |
0 |
0 |
0 |
0.000 |
88 |
99 |
|
[NAG]L:2 |
3 |
1 |
363 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
11973 |
8.8 |
0.3 |
0.432 |
0 |
0 |
0 |
0.000 |
89 |
100 |
|
H |
1 |
1 |
11905 |
◊ |
[BMA]L:3 |
-x,y-1/2,-z-1/2 |
3_544 |
1 |
1 |
293 |
6.8 |
0.2 |
0.381 |
0 |
0 |
0 |
0.000 |
90 |
101 |
|
[FUC]L:6 |
2 |
1 |
280 |
f |
[BMA]L:3 |
x,y,z |
1_555 |
1 |
1 |
293 |
6.7 |
0.4 |
0.226 |
0 |
0 |
0 |
0.000 |
91 |
102 |
|
[NAG]A:1003 |
1 |
1 |
354 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
11973 |
6.6 |
0.1 |
0.260 |
0 |
0 |
0 |
0.000 |
92 |
103 |
|
G |
1 |
1 |
11317 |
◊ |
[NAG]L:1 |
-x,y-1/2,-z-1/2 |
3_544 |
1 |
1 |
360 |
6.6 |
0.3 |
0.357 |
0 |
0 |
0 |
0.000 |
93 |
104 |
|
[FUC]L:6 |
1 |
1 |
280 |
f |
B |
x,y,z |
1_555 |
2 |
2 |
11973 |
6.1 |
0.3 |
0.374 |
0 |
0 |
0 |
0.000 |
94 |
105 |
|
[CL]H:305 |
1 |
1 |
125 |
f |
[IPA]H:303 |
x,y,z |
1_555 |
1 |
1 |
198 |
5.8 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.008 |
95 |
106 |
|
[NAG]O:2 |
1 |
1 |
362 |
f |
E |
x,y,z |
1_555 |
1 |
1 |
11811 |
5.1 |
0.3 |
0.474 |
0 |
0 |
0 |
0.000 |
96 |
107 |
|
[BMA]L:4 |
1 |
1 |
293 |
◊ |
E |
-x,y-1/2,-z-1/2 |
3_544 |
1 |
1 |
11811 |
4.3 |
0.1 |
0.368 |
0 |
0 |
0 |
0.000 |
97 |
108 |
|
B |
1 |
1 |
11973 |
◊ |
[NAG]O:2 |
-x,y-1/2,-z-1/2 |
3_544 |
1 |
1 |
362 |
2.6 |
0.1 |
0.324 |
0 |
0 |
0 |
0.000 |
98 |
109 |
|
[FUC]L:6 |
1 |
1 |
280 |
f |
[BMA]L:5 |
x,y,z |
1_555 |
1 |
1 |
294 |
2.2 |
0.1 |
0.234 |
0 |
0 |
0 |
0.000 |
99 |
110 |
|
G |
1 |
1 |
11317 |
◊ |
[BMA]O:4 |
-x,y-1/2,-z-1/2 |
3_544 |
1 |
1 |
297 |
0.1 |
0.0 |
0.336 |
0 |
0 |
0 |
0.000 |
|