| ## |
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 |
72 |
22 |
10457 |
◊ |
A |
x,y,z |
1_555 |
75 |
22 |
10576 |
812.9 |
-5.8 |
0.304 |
10 |
2 |
0 |
0.000 |
2 |
|
D |
74 |
22 |
10405 |
◊ |
C |
x,y,z |
1_555 |
76 |
22 |
10491 |
806.9 |
-5.3 |
0.384 |
10 |
2 |
0 |
0.000 |
| Average: |
809.9 |
-5.5 |
0.344 |
10 |
2 |
0 |
0.000 |
| 2 |
3 |
|
C |
48 |
16 |
10491 |
◊ |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
51 |
17 |
10457 |
448.6 |
0.1 |
0.716 |
6 |
0 |
0 |
0.000 |
| 3 |
4 |
|
A |
36 |
8 |
10576 |
◊ |
B |
-x+3/2,y-1/2,-z+1 |
3_646 |
37 |
12 |
10457 |
296.0 |
-0.2 |
0.654 |
1 |
0 |
0 |
0.000 |
| 4 |
5 |
|
C |
30 |
10 |
10491 |
◊ |
B |
x,y,z |
1_555 |
28 |
11 |
10457 |
277.5 |
0.1 |
0.571 |
4 |
0 |
0 |
0.000 |
6 |
|
D |
26 |
11 |
10405 |
◊ |
A |
x,y,z |
1_555 |
32 |
10 |
10576 |
274.0 |
0.5 |
0.571 |
7 |
0 |
0 |
0.000 |
| Average: |
275.8 |
0.3 |
0.571 |
6 |
0 |
0 |
0.000 |
| 5 |
7 |
|
[GLA]C:400 |
11 |
1 |
294 |
f |
C |
x,y,z |
1_555 |
29 |
15 |
10491 |
178.0 |
2.9 |
0.402 |
5 |
0 |
0 |
0.000 |
8 |
|
[GLA]B:400 |
11 |
1 |
292 |
f |
B |
x,y,z |
1_555 |
26 |
13 |
10457 |
177.4 |
2.9 |
0.421 |
5 |
0 |
0 |
0.000 |
9 |
|
[GLA]A:400 |
11 |
1 |
293 |
f |
A |
x,y,z |
1_555 |
26 |
13 |
10576 |
177.3 |
2.9 |
0.412 |
4 |
0 |
0 |
0.000 |
10 |
|
[GLA]D:400 |
11 |
1 |
295 |
f |
D |
x,y,z |
1_555 |
31 |
15 |
10405 |
176.6 |
2.8 |
0.400 |
4 |
0 |
0 |
0.000 |
| Average: |
177.3 |
2.9 |
0.409 |
5 |
0 |
0 |
0.000 |
| 6 |
11 |
|
D |
20 |
10 |
10405 |
◊ |
D |
-x+1,-y,z |
2_655 |
20 |
10 |
10405 |
152.9 |
-0.2 |
0.672 |
4 |
0 |
0 |
0.000 |
| 7 |
12 |
|
[NAG]A:501 |
9 |
1 |
360 |
cf |
A |
x,y,z |
1_555 |
18 |
7 |
10576 |
132.0 |
3.2 |
0.496 |
0 |
0 |
0 |
0.000 |
13 |
|
[NAG]B:501 |
11 |
1 |
362 |
cf |
B |
x,y,z |
1_555 |
19 |
7 |
10457 |
129.8 |
3.1 |
0.430 |
0 |
0 |
0 |
0.000 |
14 |
|
[NAG]C:501 |
9 |
1 |
362 |
cf |
C |
x,y,z |
1_555 |
19 |
7 |
10491 |
129.0 |
3.0 |
0.497 |
0 |
0 |
0 |
0.000 |
15 |
|
[NAG]D:501 |
11 |
1 |
360 |
cf |
D |
x,y,z |
1_555 |
18 |
7 |
10405 |
124.8 |
2.9 |
0.437 |
0 |
0 |
0 |
0.000 |
| Average: |
128.9 |
3.0 |
0.465 |
0 |
0 |
0 |
0.000 |
| 8 |
16 |
|
A |
11 |
4 |
10576 |
◊ |
B |
x,y,z-1 |
1_554 |
16 |
4 |
10457 |
124.9 |
-2.0 |
0.204 |
0 |
0 |
0 |
0.000 |
| 9 |
17 |
|
A |
14 |
6 |
10576 |
◊ |
D |
-x+3/2,y-1/2,-z |
3_645 |
18 |
9 |
10405 |
118.6 |
1.6 |
0.814 |
2 |
3 |
0 |
0.000 |
| 10 |
18 |
|
[NAG]C:601 |
10 |
1 |
363 |
cf |
C |
x,y,z |
1_555 |
13 |
4 |
10491 |
112.1 |
3.2 |
0.418 |
1 |
0 |
0 |
0.000 |
19 |
|
[NAG]D:601 |
10 |
1 |
362 |
cf |
D |
x,y,z |
1_555 |
13 |
4 |
10405 |
111.7 |
3.4 |
0.422 |
1 |
0 |
0 |
0.000 |
| Average: |
111.9 |
3.3 |
0.420 |
1 |
0 |
0 |
0.000 |
| 11 |
20 |
|
[NAG]B:601 |
8 |
1 |
365 |
cf |
B |
x,y,z |
1_555 |
13 |
5 |
10457 |
108.4 |
3.2 |
0.536 |
0 |
0 |
0 |
0.000 |
| 12 |
21 |
|
[NAG]A:601 |
10 |
1 |
363 |
cf |
A |
x,y,z |
1_555 |
12 |
5 |
10576 |
106.9 |
2.9 |
0.402 |
0 |
0 |
0 |
0.000 |
| 13 |
22 |
|
[GLA]C:401 |
9 |
1 |
302 |
f |
C |
x,y,z |
1_555 |
13 |
6 |
10491 |
105.5 |
0.3 |
0.183 |
1 |
0 |
0 |
0.002 |
23 |
|
[GLA]B:401 |
8 |
1 |
302 |
f |
B |
x,y,z |
1_555 |
13 |
6 |
10457 |
100.0 |
0.4 |
0.193 |
1 |
0 |
0 |
0.002 |
| Average: |
102.7 |
0.3 |
0.188 |
1 |
0 |
0 |
0.002 |
| 14 |
24 |
|
[GLA]A:401 |
8 |
1 |
304 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
10576 |
104.0 |
0.5 |
0.203 |
1 |
0 |
0 |
0.000 |
| 15 |
25 |
|
D |
7 |
3 |
10405 |
◊ |
B |
x,y,z-1 |
1_554 |
11 |
5 |
10457 |
99.5 |
-0.6 |
0.285 |
1 |
1 |
0 |
0.000 |
| 16 |
26 |
|
D |
14 |
4 |
10405 |
◊ |
C |
x,y,z-1 |
1_554 |
11 |
4 |
10491 |
97.9 |
-0.4 |
0.558 |
0 |
0 |
0 |
0.000 |
| 17 |
27 |
|
[GLA]D:401 |
10 |
1 |
302 |
f |
D |
x,y,z |
1_555 |
12 |
6 |
10405 |
85.3 |
0.4 |
0.141 |
0 |
0 |
0 |
0.000 |
| 18 |
28 |
|
[FUC]A:602 |
7 |
1 |
281 |
cf |
[NAG]A:601 |
x,y,z |
1_555 |
7 |
1 |
363 |
81.8 |
3.4 |
0.253 |
0 |
0 |
0 |
0.000 |
| 19 |
29 |
|
[NAG]C:603 |
8 |
1 |
362 |
cf |
[NAG]C:601 |
x,y,z |
1_555 |
7 |
1 |
363 |
77.2 |
1.9 |
0.108 |
1 |
0 |
0 |
0.000 |
| 20 |
30 |
|
[BMA]C:504 |
6 |
1 |
293 |
◊ |
B |
-x+1,-y+1,z |
2_665 |
10 |
5 |
10457 |
77.0 |
1.1 |
0.346 |
2 |
0 |
0 |
0.000 |
| 21 |
31 |
|
[NDG]B:603 |
8 |
1 |
362 |
cf |
[NAG]B:601 |
x,y,z |
1_555 |
7 |
1 |
365 |
77.0 |
2.2 |
0.111 |
2 |
0 |
0 |
0.000 |
| 22 |
32 |
|
D |
8 |
3 |
10405 |
◊ |
[FUC]B:602 |
x,y,z-1 |
1_554 |
7 |
1 |
281 |
74.7 |
-0.3 |
0.143 |
0 |
0 |
0 |
0.000 |
| 23 |
33 |
|
[FUC]D:602 |
8 |
1 |
281 |
◊ |
[NAG]D:603 |
x,y,z |
1_555 |
9 |
1 |
360 |
74.6 |
3.6 |
0.150 |
0 |
0 |
0 |
0.000 |
34 |
|
[FUC]D:502 |
7 |
1 |
282 |
◊ |
[NAG]D:503 |
x,y,z |
1_555 |
7 |
1 |
361 |
63.9 |
2.9 |
0.197 |
0 |
0 |
0 |
0.000 |
| Average: |
69.2 |
3.2 |
0.173 |
0 |
0 |
0 |
0.000 |
| 24 |
35 |
|
[NAG]D:603 |
8 |
1 |
360 |
cf |
[NAG]D:601 |
x,y,z |
1_555 |
7 |
1 |
362 |
74.5 |
1.9 |
0.123 |
0 |
0 |
0 |
0.000 |
| 25 |
36 |
|
C |
9 |
4 |
10491 |
◊ |
C |
-x+1,-y+1,z |
2_665 |
8 |
4 |
10491 |
72.7 |
-0.4 |
0.536 |
0 |
0 |
0 |
0.000 |
| 26 |
37 |
|
[NAG]A:603 |
8 |
1 |
360 |
cf |
[NAG]A:601 |
x,y,z |
1_555 |
7 |
1 |
363 |
72.2 |
1.7 |
0.112 |
0 |
0 |
0 |
0.000 |
38 |
|
[NAG]B:503 |
8 |
1 |
362 |
cf |
[NAG]B:501 |
x,y,z |
1_555 |
7 |
1 |
362 |
66.6 |
1.1 |
0.094 |
0 |
0 |
0 |
0.000 |
39 |
|
[NAG]C:503 |
9 |
1 |
363 |
cf |
[NAG]C:501 |
x,y,z |
1_555 |
6 |
1 |
362 |
66.1 |
1.1 |
0.093 |
0 |
0 |
0 |
0.000 |
| Average: |
68.3 |
1.3 |
0.099 |
0 |
0 |
0 |
0.000 |
| 27 |
40 |
|
[FUC]B:602 |
7 |
1 |
281 |
cf |
[NAG]B:601 |
x,y,z |
1_555 |
8 |
1 |
365 |
72.0 |
2.7 |
0.171 |
0 |
0 |
0 |
0.000 |
| 28 |
41 |
|
[GLA]D:401 |
8 |
1 |
302 |
◊ |
D |
-x+1,-y,z |
2_655 |
11 |
4 |
10405 |
71.8 |
1.3 |
0.343 |
0 |
0 |
0 |
0.000 |
| 29 |
42 |
|
[FUC]D:602 |
8 |
1 |
281 |
c |
[NAG]D:601 |
x,y,z |
1_555 |
8 |
1 |
362 |
70.8 |
2.4 |
0.128 |
0 |
0 |
0 |
0.000 |
| 30 |
43 |
|
[BMA]D:604 |
6 |
1 |
292 |
◊ |
B |
x,y,z-1 |
1_554 |
8 |
4 |
10457 |
70.4 |
0.5 |
0.266 |
0 |
0 |
0 |
0.000 |
| 31 |
44 |
|
[FUC]A:502 |
7 |
1 |
280 |
c |
[NAG]A:501 |
x,y,z |
1_555 |
6 |
1 |
360 |
69.9 |
2.3 |
0.171 |
0 |
0 |
0 |
0.000 |
45 |
|
[FUC]D:502 |
7 |
1 |
282 |
c |
[NAG]D:501 |
x,y,z |
1_555 |
6 |
1 |
360 |
66.6 |
2.3 |
0.171 |
0 |
0 |
0 |
0.000 |
| Average: |
68.2 |
2.3 |
0.171 |
0 |
0 |
0 |
0.000 |
| 32 |
46 |
|
[FUC]C:502 |
7 |
1 |
280 |
c |
[NAG]C:501 |
x,y,z |
1_555 |
6 |
1 |
362 |
69.3 |
2.4 |
0.171 |
0 |
0 |
0 |
0.000 |
| 33 |
47 |
|
[FUC]B:502 |
7 |
1 |
281 |
cf |
[NAG]B:501 |
x,y,z |
1_555 |
7 |
1 |
362 |
67.4 |
2.4 |
0.161 |
0 |
0 |
0 |
0.000 |
| 34 |
48 |
|
[NAG]A:503 |
8 |
1 |
360 |
cf |
[NAG]A:501 |
x,y,z |
1_555 |
6 |
1 |
360 |
67.0 |
1.3 |
0.102 |
0 |
0 |
0 |
0.000 |
49 |
|
[NAG]D:503 |
7 |
1 |
361 |
cf |
[NAG]D:501 |
x,y,z |
1_555 |
6 |
1 |
360 |
63.1 |
1.1 |
0.115 |
0 |
0 |
0 |
0.000 |
| Average: |
65.0 |
1.2 |
0.109 |
0 |
0 |
0 |
0.000 |
| 35 |
50 |
|
[GLA]C:401 |
6 |
1 |
302 |
cf |
[GLA]C:400 |
x,y,z |
1_555 |
7 |
1 |
294 |
66.4 |
1.9 |
0.130 |
1 |
0 |
0 |
0.000 |
| 36 |
51 |
|
[BMA]C:504 |
6 |
1 |
293 |
cf |
[NAG]C:503 |
x,y,z |
1_555 |
7 |
1 |
363 |
66.3 |
1.5 |
0.137 |
0 |
0 |
0 |
0.000 |
| 37 |
52 |
|
[NAG]C:503 |
5 |
1 |
363 |
◊ |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
9 |
3 |
10457 |
66.0 |
1.8 |
0.510 |
1 |
0 |
0 |
0.000 |
| 38 |
53 |
|
[FUC]A:602 |
4 |
1 |
281 |
◊ |
D |
-x+3/2,y-1/2,-z |
3_645 |
8 |
2 |
10405 |
65.2 |
1.7 |
0.511 |
1 |
0 |
0 |
0.000 |
| 39 |
54 |
|
[NDG]B:603 |
8 |
1 |
362 |
f |
[FUC]B:602 |
x,y,z |
1_555 |
7 |
1 |
281 |
64.8 |
3.5 |
0.157 |
0 |
0 |
0 |
0.000 |
| 40 |
55 |
|
[BMA]A:504 |
7 |
1 |
292 |
cf |
[NAG]A:503 |
x,y,z |
1_555 |
7 |
1 |
360 |
63.7 |
1.1 |
0.075 |
1 |
0 |
0 |
0.000 |
| 41 |
56 |
|
[NAG]A:503 |
6 |
1 |
360 |
◊ |
D |
-x+3/2,y-1/2,-z |
3_645 |
8 |
3 |
10405 |
63.5 |
2.4 |
0.517 |
1 |
0 |
0 |
0.000 |
| 42 |
57 |
|
[GLA]D:401 |
6 |
1 |
302 |
cf |
[GLA]D:400 |
x,y,z |
1_555 |
6 |
1 |
295 |
63.4 |
1.7 |
0.132 |
1 |
0 |
0 |
0.000 |
| 43 |
58 |
|
[GLA]A:401 |
6 |
1 |
304 |
cf |
[GLA]A:400 |
x,y,z |
1_555 |
7 |
1 |
293 |
62.9 |
2.0 |
0.140 |
0 |
0 |
0 |
0.000 |
59 |
|
[GLA]B:401 |
6 |
1 |
302 |
cf |
[GLA]B:400 |
x,y,z |
1_555 |
7 |
1 |
292 |
62.6 |
2.0 |
0.152 |
0 |
0 |
0 |
0.000 |
| Average: |
62.8 |
2.0 |
0.146 |
0 |
0 |
0 |
0.000 |
| 44 |
60 |
|
[BMA]D:504 |
7 |
1 |
291 |
cf |
[NAG]D:503 |
x,y,z |
1_555 |
5 |
1 |
361 |
61.7 |
1.5 |
0.114 |
0 |
0 |
0 |
0.000 |
| 45 |
61 |
|
[BMA]D:604 |
7 |
1 |
292 |
cf |
[NAG]D:603 |
x,y,z |
1_555 |
5 |
1 |
360 |
61.3 |
0.8 |
0.096 |
0 |
0 |
0 |
0.000 |
| 46 |
62 |
|
[FUC]B:502 |
7 |
1 |
281 |
f |
[NAG]B:503 |
x,y,z |
1_555 |
7 |
1 |
362 |
61.2 |
2.5 |
0.148 |
0 |
0 |
0 |
0.000 |
| 47 |
63 |
|
C |
6 |
1 |
10491 |
◊ |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
6 |
3 |
10576 |
60.5 |
-0.0 |
0.515 |
0 |
0 |
0 |
0.000 |
| 48 |
64 |
|
[FUC]A:502 |
8 |
1 |
280 |
◊ |
[NAG]A:503 |
x,y,z |
1_555 |
7 |
1 |
360 |
60.5 |
2.7 |
0.155 |
0 |
0 |
0 |
0.000 |
65 |
|
[FUC]C:502 |
7 |
1 |
280 |
◊ |
[NAG]C:503 |
x,y,z |
1_555 |
6 |
1 |
363 |
57.9 |
2.6 |
0.215 |
0 |
0 |
0 |
0.000 |
| Average: |
59.2 |
2.7 |
0.185 |
0 |
0 |
0 |
0.000 |
| 49 |
66 |
|
[BMA]B:504 |
7 |
1 |
292 |
cf |
[NAG]B:503 |
x,y,z |
1_555 |
6 |
1 |
362 |
60.1 |
1.3 |
0.102 |
0 |
0 |
0 |
0.000 |
| 50 |
67 |
|
[MN]C:3300 |
1 |
1 |
123 |
f |
C |
x,y,z |
1_555 |
12 |
9 |
10491 |
59.5 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.716 |
68 |
|
[MN]A:1300 |
1 |
1 |
123 |
f |
A |
x,y,z |
1_555 |
12 |
10 |
10576 |
58.8 |
-6.8 |
0.000 |
0 |
0 |
0 |
0.716 |
69 |
|
[MN]D:4300 |
1 |
1 |
123 |
f |
D |
x,y,z |
1_555 |
13 |
10 |
10405 |
58.8 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.716 |
70 |
|
[MN]B:2300 |
1 |
1 |
123 |
f |
B |
x,y,z |
1_555 |
12 |
10 |
10457 |
58.6 |
-6.8 |
0.000 |
0 |
0 |
0 |
0.716 |
| Average: |
58.9 |
-6.8 |
0.000 |
0 |
0 |
0 |
0.716 |
| 51 |
71 |
|
[FUC]D:502 |
6 |
1 |
282 |
◊ |
D |
-x+1,-y,z |
2_655 |
6 |
2 |
10405 |
59.2 |
0.3 |
0.200 |
0 |
0 |
0 |
0.000 |
| 52 |
72 |
|
[NAG]D:501 |
6 |
1 |
360 |
◊ |
D |
-x+1,-y,z |
2_655 |
7 |
3 |
10405 |
56.4 |
1.3 |
0.428 |
0 |
0 |
0 |
0.000 |
| 53 |
73 |
|
[FUC]A:602 |
5 |
1 |
281 |
f |
[NAG]A:603 |
x,y,z |
1_555 |
7 |
1 |
360 |
56.0 |
1.9 |
0.171 |
0 |
0 |
0 |
0.000 |
| 54 |
74 |
|
D |
7 |
2 |
10405 |
f |
[FUC]A:502 |
x-1/2,-y+1/2,-z |
4_455 |
4 |
1 |
280 |
52.1 |
0.2 |
0.280 |
0 |
0 |
0 |
0.000 |
| 55 |
75 |
|
D |
8 |
2 |
10405 |
◊ |
[NAG]B:601 |
x,y,z-1 |
1_554 |
4 |
1 |
365 |
51.4 |
1.4 |
0.467 |
0 |
0 |
0 |
0.000 |
| 56 |
76 |
|
C |
6 |
2 |
10491 |
◊ |
C |
-x+1,-y,z |
2_655 |
6 |
2 |
10491 |
46.9 |
0.6 |
0.774 |
1 |
0 |
0 |
0.000 |
| 57 |
77 |
|
D |
8 |
4 |
10405 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
3 |
1 |
10576 |
46.5 |
1.0 |
0.741 |
1 |
0 |
0 |
0.000 |
| 58 |
78 |
|
[BMA]D:504 |
3 |
1 |
291 |
◊ |
B |
-x+1,-y,z-1 |
2_654 |
6 |
2 |
10457 |
46.2 |
0.7 |
0.444 |
1 |
0 |
0 |
0.000 |
| 59 |
79 |
|
D |
5 |
3 |
10405 |
◊ |
[BMA]A:504 |
x-1/2,-y+1/2,-z |
4_455 |
5 |
1 |
292 |
45.3 |
0.7 |
0.294 |
0 |
0 |
0 |
0.000 |
| 60 |
80 |
|
A |
5 |
2 |
10576 |
◊ |
[NAG]B:501 |
x,y,z-1 |
1_554 |
4 |
1 |
362 |
43.8 |
0.6 |
0.319 |
0 |
0 |
0 |
0.000 |
| 61 |
81 |
|
[CA]A:1303 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
12 |
7 |
10576 |
40.2 |
-11.0 |
0.000 |
0 |
0 |
0 |
1.000 |
82 |
|
[CA]B:2303 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
10 |
6 |
10457 |
39.5 |
-11.0 |
0.000 |
0 |
0 |
0 |
1.000 |
83 |
|
[CA]C:3303 |
1 |
1 |
85 |
f |
C |
x,y,z |
1_555 |
10 |
6 |
10491 |
39.1 |
-11.0 |
0.000 |
0 |
0 |
0 |
1.000 |
84 |
|
[CA]D:4303 |
1 |
1 |
85 |
f |
D |
x,y,z |
1_555 |
10 |
6 |
10405 |
38.9 |
-10.9 |
0.000 |
0 |
0 |
0 |
1.000 |
| Average: |
39.4 |
-11.0 |
0.000 |
0 |
0 |
0 |
1.000 |
| 62 |
85 |
|
[NAG]A:601 |
4 |
1 |
363 |
◊ |
D |
-x+3/2,y-1/2,-z |
3_645 |
7 |
2 |
10405 |
37.5 |
0.8 |
0.388 |
0 |
0 |
0 |
0.000 |
| 63 |
86 |
|
[GLA]D:401 |
5 |
1 |
302 |
◊ |
[NAG]D:501 |
-x+1,-y,z |
2_655 |
5 |
1 |
360 |
36.7 |
0.8 |
0.165 |
1 |
0 |
0 |
0.000 |
| 64 |
87 |
|
D |
2 |
1 |
10405 |
◊ |
[NAG]C:603 |
x,y,z-1 |
1_554 |
4 |
1 |
362 |
35.6 |
0.4 |
0.281 |
1 |
0 |
0 |
0.000 |
| 65 |
88 |
|
D |
3 |
1 |
10405 |
◊ |
D |
-x+1,-y+1,z |
2_665 |
3 |
1 |
10405 |
35.4 |
0.7 |
0.865 |
0 |
0 |
0 |
0.000 |
| 66 |
89 |
|
A |
5 |
3 |
10576 |
◊ |
[FUC]B:502 |
x,y,z-1 |
1_554 |
2 |
1 |
281 |
35.1 |
1.1 |
0.611 |
0 |
0 |
0 |
0.000 |
| 67 |
90 |
|
C |
5 |
3 |
10491 |
◊ |
A |
-x+1,-y,z |
2_655 |
4 |
2 |
10576 |
31.0 |
0.3 |
0.604 |
0 |
0 |
0 |
0.000 |
| 68 |
91 |
|
[NAG]C:503 |
3 |
1 |
363 |
◊ |
B |
-x+1,-y+1,z |
2_665 |
5 |
2 |
10457 |
29.4 |
0.9 |
0.434 |
1 |
0 |
0 |
0.000 |
| 69 |
92 |
|
[FUC]C:502 |
3 |
1 |
280 |
f |
B |
-x+1,-y+1,z |
2_665 |
7 |
4 |
10457 |
28.9 |
-0.3 |
0.199 |
0 |
0 |
0 |
0.000 |
| 70 |
93 |
|
A |
3 |
2 |
10576 |
◊ |
[NDG]B:603 |
-x+3/2,y-1/2,-z+1 |
3_646 |
4 |
1 |
362 |
28.1 |
0.3 |
0.266 |
1 |
0 |
0 |
0.000 |
| 71 |
94 |
|
A |
4 |
2 |
10576 |
◊ |
[NAG]B:503 |
x,y,z-1 |
1_554 |
4 |
1 |
362 |
26.3 |
0.5 |
0.378 |
0 |
0 |
0 |
0.000 |
| 72 |
95 |
|
[GLA]D:401 |
5 |
1 |
302 |
◊ |
[FUC]D:502 |
-x+1,-y,z |
2_655 |
3 |
1 |
282 |
24.3 |
0.4 |
0.173 |
0 |
0 |
0 |
0.000 |
| 73 |
96 |
|
D |
2 |
2 |
10405 |
◊ |
B |
x,y,z |
1_555 |
2 |
2 |
10457 |
22.5 |
1.6 |
0.966 |
0 |
0 |
0 |
0.000 |
| 74 |
97 |
|
D |
2 |
2 |
10405 |
◊ |
[NAG]A:503 |
x-1/2,-y+1/2,-z |
4_455 |
4 |
1 |
360 |
20.6 |
0.0 |
0.196 |
0 |
0 |
0 |
0.000 |
| 75 |
98 |
|
A |
2 |
1 |
10576 |
◊ |
[NAG]B:601 |
-x+3/2,y-1/2,-z+1 |
3_646 |
2 |
1 |
365 |
20.1 |
0.1 |
0.266 |
0 |
0 |
0 |
0.000 |
| 76 |
99 |
|
[FUC]A:502 |
1 |
1 |
280 |
◊ |
D |
-x+3/2,y-1/2,-z |
3_645 |
3 |
1 |
10405 |
19.8 |
0.7 |
0.707 |
0 |
0 |
0 |
0.000 |
| 77 |
100 |
|
[NAG]A:503 |
1 |
1 |
360 |
f |
A |
x,y,z |
1_555 |
2 |
1 |
10576 |
18.9 |
0.0 |
0.297 |
0 |
0 |
0 |
0.000 |
| 78 |
101 |
|
[NAG]C:603 |
1 |
1 |
362 |
f |
C |
x,y,z |
1_555 |
3 |
1 |
10491 |
15.3 |
0.9 |
0.833 |
0 |
0 |
0 |
0.000 |
102 |
|
[NAG]A:603 |
1 |
1 |
360 |
f |
A |
x,y,z |
1_555 |
2 |
1 |
10576 |
10.7 |
0.7 |
0.798 |
0 |
0 |
0 |
0.000 |
| Average: |
13.0 |
0.8 |
0.815 |
0 |
0 |
0 |
0.000 |
| 79 |
103 |
|
[BMA]D:504 |
2 |
1 |
291 |
◊ |
[NAG]B:501 |
-x+1,-y,z-1 |
2_654 |
1 |
1 |
362 |
15.1 |
0.8 |
0.456 |
0 |
0 |
0 |
0.000 |
| 80 |
104 |
|
[BMA]A:504 |
5 |
1 |
292 |
◊ |
D |
-x+3/2,y-1/2,-z |
3_645 |
3 |
2 |
10405 |
15.0 |
0.7 |
0.296 |
0 |
0 |
0 |
0.000 |
| 81 |
105 |
|
[FUC]D:602 |
1 |
1 |
281 |
f |
[GLA]B:401 |
x,y,z-1 |
1_554 |
1 |
1 |
302 |
13.8 |
0.6 |
0.365 |
0 |
0 |
0 |
0.000 |
| 82 |
106 |
|
[FUC]D:602 |
1 |
1 |
281 |
f |
B |
x,y,z-1 |
1_554 |
2 |
1 |
10457 |
13.5 |
-0.5 |
0.245 |
0 |
0 |
0 |
0.000 |
| 83 |
107 |
|
[MN]D:4300 |
1 |
1 |
123 |
f |
[CA]D:4303 |
x,y,z |
1_555 |
1 |
1 |
85 |
12.0 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.042 |
| 84 |
108 |
|
[MN]B:2300 |
1 |
1 |
123 |
f |
[CA]B:2303 |
x,y,z |
1_555 |
1 |
1 |
85 |
11.6 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.000 |
| 85 |
109 |
|
[MN]A:1300 |
1 |
1 |
123 |
f |
[CA]A:1303 |
x,y,z |
1_555 |
1 |
1 |
85 |
11.6 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.245 |
| 86 |
110 |
|
[MN]C:3300 |
1 |
1 |
123 |
f |
[CA]C:3303 |
x,y,z |
1_555 |
1 |
1 |
85 |
11.5 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.032 |
| 87 |
111 |
|
[FUC]C:502 |
2 |
1 |
280 |
◊ |
C |
x,y,z |
1_555 |
2 |
2 |
10491 |
11.1 |
0.3 |
0.426 |
0 |
0 |
0 |
0.000 |
| 88 |
112 |
|
[BMA]C:504 |
2 |
1 |
293 |
◊ |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
2 |
1 |
10457 |
9.2 |
0.1 |
0.399 |
0 |
0 |
0 |
0.000 |
| 89 |
113 |
|
C |
1 |
1 |
10491 |
◊ |
B |
-x+1,-y,z |
2_655 |
1 |
1 |
10457 |
9.0 |
0.2 |
0.815 |
0 |
0 |
0 |
0.000 |
| 90 |
114 |
|
[FUC]A:502 |
2 |
1 |
280 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
10576 |
8.9 |
0.3 |
0.423 |
0 |
0 |
0 |
0.000 |
115 |
|
[FUC]D:502 |
1 |
1 |
282 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
10405 |
6.5 |
0.3 |
0.401 |
0 |
0 |
0 |
0.000 |
| Average: |
7.7 |
0.3 |
0.412 |
0 |
0 |
0 |
0.000 |
| 91 |
116 |
|
[FUC]A:602 |
3 |
1 |
281 |
f |
A |
x,y,z |
1_555 |
1 |
1 |
10576 |
8.1 |
0.3 |
0.499 |
0 |
0 |
0 |
0.000 |
| 92 |
117 |
|
[GLA]D:401 |
2 |
1 |
302 |
◊ |
[NAG]D:503 |
-x+1,-y,z |
2_655 |
2 |
1 |
361 |
7.7 |
0.3 |
0.238 |
0 |
0 |
0 |
0.000 |
| 93 |
118 |
|
[FUC]B:502 |
1 |
1 |
281 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
10457 |
6.5 |
0.3 |
0.401 |
0 |
0 |
0 |
0.000 |
| 94 |
119 |
|
[NAG]A:603 |
2 |
1 |
360 |
◊ |
[BMA]B:504 |
x,y,z-1 |
1_554 |
2 |
1 |
292 |
6.2 |
0.2 |
0.225 |
0 |
0 |
0 |
0.000 |
| 95 |
120 |
|
D |
2 |
2 |
10405 |
◊ |
A |
-x+1,-y,z |
2_655 |
2 |
2 |
10576 |
5.8 |
0.2 |
0.735 |
0 |
0 |
0 |
0.000 |
| 96 |
121 |
|
[FUC]B:602 |
1 |
1 |
281 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
10457 |
5.2 |
0.2 |
0.395 |
0 |
0 |
0 |
0.000 |
| 97 |
122 |
|
[NAG]D:603 |
1 |
1 |
360 |
f |
D |
x,y,z |
1_555 |
1 |
1 |
10405 |
4.6 |
0.3 |
0.498 |
0 |
0 |
0 |
0.000 |
| 98 |
123 |
|
[FUC]D:602 |
1 |
1 |
281 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
10405 |
3.8 |
0.2 |
0.390 |
0 |
0 |
0 |
0.000 |
| 99 |
124 |
|
[FUC]A:602 |
1 |
1 |
281 |
◊ |
B |
-x+3/2,y-1/2,-z |
3_645 |
2 |
1 |
10457 |
3.6 |
0.1 |
0.367 |
0 |
0 |
0 |
0.000 |
| 100 |
125 |
|
[NAG]D:603 |
1 |
1 |
360 |
◊ |
[GLA]B:401 |
x,y,z-1 |
1_554 |
1 |
1 |
302 |
3.4 |
0.1 |
0.154 |
0 |
0 |
0 |
0.000 |
| 101 |
126 |
|
[NAG]A:603 |
1 |
1 |
360 |
◊ |
D |
-x+3/2,y-1/2,-z |
3_645 |
1 |
1 |
10405 |
3.3 |
0.1 |
0.329 |
0 |
0 |
0 |
0.000 |
| 102 |
127 |
|
C |
2 |
1 |
10491 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
10576 |
3.3 |
-0.0 |
0.584 |
0 |
0 |
0 |
0.000 |
| 103 |
128 |
|
[GLA]A:401 |
1 |
1 |
304 |
◊ |
B |
x,y,z-1 |
1_554 |
1 |
1 |
10457 |
3.2 |
0.1 |
0.353 |
0 |
0 |
0 |
0.000 |
| 104 |
129 |
|
[BMA]D:504 |
1 |
1 |
291 |
◊ |
[FUC]D:502 |
x,y,z |
1_555 |
2 |
1 |
282 |
2.9 |
0.2 |
0.226 |
0 |
0 |
0 |
0.000 |
| 105 |
130 |
|
[NAG]D:503 |
1 |
1 |
361 |
f |
D |
x,y,z |
1_555 |
1 |
1 |
10405 |
1.9 |
-0.0 |
0.242 |
0 |
0 |
0 |
0.000 |
|