| ## |
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 |
|
H |
145 |
37 |
12341 |
◊ |
G |
x,y,z |
1_555 |
140 |
43 |
12426 |
1373.3 |
-23.8 |
0.156 |
13 |
5 |
2 |
1.000 |
2 |
|
D |
113 |
30 |
11111 |
◊ |
C |
x,y,z |
1_555 |
114 |
30 |
9571 |
1062.0 |
-12.8 |
0.341 |
5 |
4 |
0 |
1.000 |
| Average: |
1217.6 |
-18.3 |
0.248 |
9 |
5 |
1 |
1.000 |
| 2 |
3 |
|
F |
112 |
31 |
10093 |
◊ |
E |
x,y,z |
1_555 |
110 |
30 |
11407 |
1065.7 |
-12.9 |
0.423 |
6 |
5 |
0 |
0.674 |
4 |
|
B |
104 |
31 |
10546 |
◊ |
A |
x,y,z |
1_555 |
109 |
32 |
12501 |
994.8 |
-15.1 |
0.339 |
7 |
3 |
0 |
0.674 |
| Average: |
1030.2 |
-14.0 |
0.381 |
7 |
4 |
0 |
0.674 |
| 3 |
5 |
|
G |
90 |
29 |
12426 |
◊ |
D |
x,y,z |
1_555 |
79 |
22 |
11111 |
736.1 |
-5.6 |
0.675 |
6 |
3 |
0 |
0.208 |
6 |
|
E |
76 |
20 |
11407 |
◊ |
A |
-x,y-1/2,-z+2 |
2_547 |
88 |
24 |
12501 |
685.8 |
-2.5 |
0.860 |
7 |
2 |
0 |
0.208 |
7 |
|
B |
65 |
21 |
10546 |
◊ |
H |
x-1,y,z |
1_455 |
70 |
21 |
12341 |
587.5 |
-2.3 |
0.886 |
5 |
3 |
0 |
0.208 |
| Average: |
669.8 |
-3.4 |
0.807 |
6 |
3 |
0 |
0.208 |
| 4 |
8 |
|
C |
49 |
11 |
9571 |
◊ |
H |
x-1,y,z-1 |
1_454 |
44 |
17 |
12341 |
343.5 |
-3.6 |
0.454 |
3 |
0 |
0 |
0.000 |
| 5 |
9 |
|
C |
36 |
12 |
9571 |
◊ |
G |
x-1,y,z-1 |
1_454 |
36 |
15 |
12426 |
327.6 |
-4.8 |
0.355 |
1 |
0 |
0 |
0.008 |
10 |
|
F |
26 |
10 |
10093 |
◊ |
A |
-x+1,y-1/2,-z+3 |
2_648 |
29 |
14 |
12501 |
223.3 |
-4.3 |
0.314 |
0 |
0 |
0 |
0.008 |
| Average: |
275.5 |
-4.6 |
0.334 |
1 |
0 |
0 |
0.008 |
| 6 |
11 |
|
E |
43 |
15 |
11407 |
◊ |
D |
x,y,z |
1_555 |
35 |
11 |
11111 |
302.4 |
-1.0 |
0.783 |
2 |
0 |
0 |
0.000 |
| 7 |
12 |
|
G |
28 |
10 |
12426 |
◊ |
A |
-x+1,y-1/2,-z+3 |
2_648 |
35 |
10 |
12501 |
301.5 |
-5.8 |
0.218 |
1 |
0 |
0 |
0.044 |
| 8 |
13 |
|
G |
34 |
9 |
12426 |
◊ |
F |
x,y,z |
1_555 |
32 |
9 |
10093 |
288.8 |
-0.8 |
0.765 |
3 |
0 |
0 |
0.003 |
14 |
|
C |
31 |
9 |
9571 |
◊ |
A |
-x,y-1/2,-z+2 |
2_547 |
36 |
8 |
12501 |
271.4 |
-0.4 |
0.779 |
2 |
0 |
0 |
0.003 |
| Average: |
280.1 |
-0.6 |
0.772 |
3 |
0 |
0 |
0.003 |
| 9 |
15 |
|
E |
25 |
8 |
11407 |
◊ |
B |
-x,y-1/2,-z+3 |
2_548 |
29 |
10 |
10546 |
234.3 |
-1.3 |
0.711 |
0 |
0 |
0 |
0.001 |
| 10 |
16 |
|
E |
19 |
6 |
11407 |
◊ |
H |
-x+1,y-1/2,-z+3 |
2_648 |
21 |
6 |
12341 |
200.8 |
-1.9 |
0.533 |
3 |
0 |
0 |
0.003 |
| 11 |
17 |
|
C |
26 |
11 |
9571 |
◊ |
B |
x,y,z |
1_555 |
16 |
5 |
10546 |
191.1 |
0.1 |
0.764 |
1 |
0 |
0 |
0.000 |
18 |
|
D |
17 |
6 |
11111 |
◊ |
A |
x,y,z |
1_555 |
22 |
8 |
12501 |
185.2 |
0.8 |
0.862 |
0 |
0 |
0 |
0.000 |
| Average: |
188.1 |
0.4 |
0.813 |
1 |
0 |
0 |
0.000 |
| 12 |
19 |
|
C |
23 |
11 |
9571 |
◊ |
A |
x,y,z |
1_555 |
28 |
8 |
12501 |
183.0 |
-1.1 |
0.592 |
0 |
0 |
0 |
0.000 |
| 13 |
20 |
|
[NAG]A:501 |
13 |
1 |
360 |
cf |
A |
x,y,z |
1_555 |
18 |
7 |
12501 |
157.2 |
3.7 |
0.356 |
1 |
0 |
0 |
0.000 |
| 14 |
21 |
|
[NAG]H:501 |
12 |
1 |
360 |
cf |
H |
x,y,z |
1_555 |
19 |
7 |
12341 |
149.3 |
3.5 |
0.410 |
2 |
0 |
0 |
0.000 |
22 |
|
[NAG]G:501 |
12 |
1 |
360 |
cf |
G |
x,y,z |
1_555 |
19 |
7 |
12426 |
142.4 |
3.1 |
0.376 |
1 |
0 |
0 |
0.000 |
| Average: |
145.8 |
3.3 |
0.393 |
2 |
0 |
0 |
0.000 |
| 15 |
23 |
|
[NAG]E:501 |
13 |
1 |
362 |
cf |
E |
x,y,z |
1_555 |
17 |
6 |
11407 |
144.0 |
3.1 |
0.311 |
1 |
0 |
0 |
0.000 |
| 16 |
24 |
|
[NAG]E:502 |
12 |
1 |
352 |
f |
E |
x,y,z |
1_555 |
23 |
7 |
11407 |
126.3 |
2.3 |
0.315 |
1 |
0 |
0 |
0.000 |
| 17 |
25 |
|
[NAG]A:502 |
11 |
1 |
357 |
f |
A |
x,y,z |
1_555 |
16 |
8 |
12501 |
120.7 |
2.4 |
0.308 |
1 |
0 |
0 |
0.000 |
| 18 |
26 |
|
[NAG]G:502 |
11 |
1 |
361 |
f |
G |
x,y,z |
1_555 |
22 |
8 |
12426 |
115.6 |
2.2 |
0.370 |
1 |
0 |
0 |
0.000 |
| 19 |
27 |
|
[NAG]H:502 |
12 |
1 |
351 |
f |
H |
x,y,z |
1_555 |
20 |
8 |
12341 |
107.0 |
2.4 |
0.367 |
1 |
0 |
0 |
0.000 |
| 20 |
28 |
|
[NAG]A:507 |
11 |
1 |
363 |
f |
A |
x,y,z |
1_555 |
17 |
7 |
12501 |
103.6 |
1.4 |
0.246 |
0 |
0 |
0 |
0.000 |
| 21 |
29 |
|
D |
13 |
4 |
11111 |
◊ |
H |
x-1,y,z |
1_455 |
11 |
3 |
12341 |
97.8 |
0.3 |
0.722 |
0 |
0 |
0 |
0.000 |
| 22 |
30 |
|
F |
12 |
4 |
10093 |
◊ |
G |
-x+1,y-1/2,-z+3 |
2_648 |
13 |
5 |
12426 |
94.0 |
-1.7 |
0.415 |
0 |
0 |
0 |
0.019 |
| 23 |
31 |
|
[K]D:504 |
1 |
1 |
216 |
◊ |
G |
x,y,z |
1_555 |
10 |
5 |
12426 |
94.0 |
-59.1 |
0.000 |
0 |
0 |
0 |
1.000 |
32 |
|
E |
10 |
4 |
11407 |
◊ |
[K]A:509 |
-x,y-1/2,-z+2 |
2_547 |
1 |
1 |
216 |
83.6 |
-51.1 |
0.000 |
0 |
0 |
0 |
1.000 |
33 |
|
[K]A:509 |
1 |
1 |
216 |
◊ |
A |
x,y,z |
1_555 |
12 |
4 |
12501 |
77.7 |
-44.1 |
0.000 |
0 |
0 |
0 |
1.000 |
34 |
|
[K]D:504 |
1 |
1 |
216 |
◊ |
D |
x,y,z |
1_555 |
11 |
5 |
11111 |
73.6 |
-46.8 |
0.000 |
0 |
0 |
0 |
1.000 |
| Average: |
82.2 |
-50.3 |
0.000 |
0 |
0 |
0 |
1.000 |
| 24 |
35 |
|
[NAG]H:507 |
8 |
1 |
362 |
f |
H |
x,y,z |
1_555 |
16 |
6 |
12341 |
93.6 |
1.6 |
0.390 |
0 |
0 |
0 |
0.000 |
| 25 |
36 |
|
[NAG]G:507 |
8 |
1 |
363 |
f |
G |
x,y,z |
1_555 |
14 |
6 |
12426 |
93.0 |
1.3 |
0.333 |
0 |
0 |
0 |
0.000 |
| 26 |
37 |
|
F |
18 |
9 |
10093 |
◊ |
H |
-x+1,y-1/2,-z+3 |
2_648 |
15 |
7 |
12341 |
90.6 |
-0.4 |
0.732 |
0 |
0 |
0 |
0.005 |
| 27 |
38 |
|
[NAG]E:506 |
8 |
1 |
346 |
f |
E |
x,y,z |
1_555 |
13 |
5 |
11407 |
79.5 |
1.1 |
0.321 |
0 |
0 |
0 |
0.000 |
| 28 |
39 |
|
[NAG]G:502 |
9 |
1 |
361 |
cf |
[NAG]G:501 |
x,y,z |
1_555 |
7 |
1 |
360 |
78.8 |
2.2 |
0.127 |
1 |
0 |
0 |
0.000 |
| 29 |
40 |
|
[MAN]E:505 |
7 |
1 |
296 |
cf |
[NAG]E:506 |
x,y,z |
1_555 |
9 |
1 |
346 |
78.2 |
2.8 |
0.177 |
0 |
0 |
0 |
0.000 |
| 30 |
41 |
|
[FUC]A:508 |
7 |
1 |
280 |
f |
A |
x,y,z |
1_555 |
12 |
3 |
12501 |
77.8 |
1.1 |
0.337 |
0 |
0 |
0 |
0.000 |
| 31 |
42 |
|
[FUC]E:507 |
6 |
1 |
282 |
f |
E |
x,y,z |
1_555 |
13 |
4 |
11407 |
77.7 |
2.3 |
0.522 |
0 |
0 |
0 |
0.000 |
| 32 |
43 |
|
[NAG]D:503 |
8 |
1 |
357 |
f |
D |
x,y,z |
1_555 |
13 |
5 |
11111 |
77.0 |
1.4 |
0.338 |
1 |
0 |
0 |
0.000 |
| 33 |
44 |
|
[MAN]G:504 |
8 |
1 |
292 |
cf |
[NAG]G:505 |
x,y,z |
1_555 |
10 |
1 |
356 |
75.0 |
3.0 |
0.104 |
0 |
0 |
0 |
0.000 |
| 34 |
45 |
|
[MAN]A:504 |
8 |
1 |
291 |
cf |
[NAG]A:505 |
x,y,z |
1_555 |
7 |
1 |
352 |
74.3 |
3.0 |
0.197 |
0 |
0 |
0 |
0.000 |
| 35 |
46 |
|
[MAN]H:506 |
8 |
1 |
292 |
cf |
[NAG]H:507 |
x,y,z |
1_555 |
9 |
1 |
362 |
73.0 |
2.4 |
0.108 |
0 |
0 |
0 |
0.000 |
| 36 |
47 |
|
[NAG]A:502 |
8 |
1 |
357 |
cf |
[NAG]A:501 |
x,y,z |
1_555 |
5 |
1 |
360 |
72.2 |
1.9 |
0.136 |
1 |
0 |
0 |
0.000 |
48 |
|
[NAG]H:502 |
9 |
1 |
351 |
cf |
[NAG]H:501 |
x,y,z |
1_555 |
6 |
1 |
360 |
62.9 |
1.4 |
0.095 |
1 |
0 |
0 |
0.000 |
| Average: |
67.6 |
1.6 |
0.115 |
1 |
0 |
0 |
0.000 |
| 37 |
49 |
|
[MAN]G:506 |
8 |
1 |
290 |
cf |
[NAG]G:507 |
x,y,z |
1_555 |
8 |
1 |
363 |
71.7 |
2.5 |
0.119 |
0 |
0 |
0 |
0.000 |
| 38 |
50 |
|
[BMA]E:503 |
7 |
1 |
291 |
f |
E |
x,y,z |
1_555 |
9 |
2 |
11407 |
71.3 |
1.1 |
0.234 |
0 |
0 |
0 |
0.000 |
| 39 |
51 |
|
[MAN]A:506 |
7 |
1 |
292 |
cf |
[NAG]A:507 |
x,y,z |
1_555 |
9 |
1 |
363 |
68.6 |
2.4 |
0.119 |
0 |
0 |
0 |
0.000 |
| 40 |
52 |
|
[NAG]E:502 |
10 |
1 |
352 |
cf |
[NAG]E:501 |
x,y,z |
1_555 |
6 |
1 |
362 |
68.3 |
1.8 |
0.088 |
1 |
0 |
0 |
0.000 |
| 41 |
53 |
|
[MAN]H:504 |
7 |
1 |
294 |
cf |
[NAG]H:505 |
x,y,z |
1_555 |
6 |
1 |
351 |
68.1 |
2.7 |
0.180 |
0 |
0 |
0 |
0.000 |
| 42 |
54 |
|
[BMA]G:503 |
7 |
1 |
292 |
f |
G |
x,y,z |
1_555 |
9 |
2 |
12426 |
67.2 |
0.7 |
0.251 |
0 |
0 |
0 |
0.000 |
55 |
|
[BMA]A:503 |
8 |
1 |
290 |
f |
A |
x,y,z |
1_555 |
9 |
2 |
12501 |
66.2 |
1.2 |
0.226 |
0 |
0 |
0 |
0.000 |
| Average: |
66.7 |
0.9 |
0.238 |
0 |
0 |
0 |
0.000 |
| 43 |
56 |
|
[FUC]H:508 |
4 |
1 |
282 |
f |
H |
x,y,z |
1_555 |
10 |
3 |
12341 |
66.3 |
1.9 |
0.653 |
0 |
0 |
0 |
0.000 |
| 44 |
57 |
|
[MAN]C:502 |
8 |
1 |
292 |
cf |
[NAG]C:503 |
x,y,z |
1_555 |
8 |
1 |
357 |
65.5 |
2.7 |
0.138 |
0 |
0 |
0 |
0.000 |
| 45 |
58 |
|
[MAN]D:502 |
8 |
1 |
290 |
cf |
[NAG]D:503 |
x,y,z |
1_555 |
9 |
1 |
357 |
65.3 |
2.1 |
0.100 |
0 |
0 |
0 |
0.000 |
| 46 |
59 |
|
[BMA]H:503 |
8 |
1 |
296 |
f |
H |
x,y,z |
1_555 |
9 |
2 |
12341 |
63.1 |
0.7 |
0.207 |
0 |
0 |
0 |
0.000 |
| 47 |
60 |
|
[BMA]E:503 |
6 |
1 |
291 |
cf |
[NAG]E:502 |
x,y,z |
1_555 |
7 |
1 |
352 |
62.8 |
1.4 |
0.083 |
1 |
0 |
0 |
0.000 |
61 |
|
[BMA]A:503 |
6 |
1 |
290 |
cf |
[NAG]A:502 |
x,y,z |
1_555 |
5 |
1 |
357 |
60.4 |
1.5 |
0.148 |
1 |
0 |
0 |
0.000 |
| Average: |
61.6 |
1.4 |
0.116 |
1 |
0 |
0 |
0.000 |
| 48 |
62 |
|
[MAN]C:502 |
6 |
1 |
292 |
cf |
[BMA]C:501 |
x,y,z |
1_555 |
6 |
1 |
290 |
60.3 |
2.7 |
0.227 |
0 |
0 |
0 |
0.000 |
| 49 |
63 |
|
[MAN]B:502 |
5 |
1 |
292 |
f |
[NAG]B:503 |
x,y,z |
1_555 |
7 |
1 |
360 |
58.3 |
2.7 |
0.282 |
0 |
0 |
0 |
0.000 |
| 50 |
64 |
|
[FUC]H:508 |
6 |
1 |
282 |
cf |
[NAG]H:501 |
x,y,z |
1_555 |
6 |
1 |
360 |
57.6 |
2.0 |
0.152 |
0 |
0 |
0 |
0.000 |
| 51 |
65 |
|
[MAN]E:504 |
6 |
1 |
287 |
cf |
[BMA]E:503 |
x,y,z |
1_555 |
5 |
1 |
291 |
56.8 |
2.0 |
0.204 |
0 |
0 |
0 |
0.000 |
| 52 |
66 |
|
[MAN]A:504 |
6 |
1 |
291 |
cf |
[BMA]A:503 |
x,y,z |
1_555 |
5 |
1 |
290 |
56.4 |
2.4 |
0.243 |
0 |
0 |
0 |
0.000 |
| 53 |
67 |
|
[FUC]G:508 |
5 |
1 |
278 |
cf |
[NAG]G:501 |
x,y,z |
1_555 |
5 |
1 |
360 |
55.8 |
2.3 |
0.262 |
0 |
0 |
0 |
0.000 |
| 54 |
68 |
|
[FUC]E:507 |
5 |
1 |
282 |
cf |
[NAG]E:501 |
x,y,z |
1_555 |
4 |
1 |
362 |
55.0 |
2.3 |
0.313 |
0 |
0 |
0 |
0.000 |
| 55 |
69 |
|
[BMA]D:501 |
7 |
1 |
294 |
f |
D |
x,y,z |
1_555 |
3 |
2 |
11111 |
54.3 |
0.3 |
0.104 |
0 |
0 |
0 |
0.000 |
| 56 |
70 |
|
[FUC]G:508 |
4 |
1 |
278 |
f |
G |
x,y,z |
1_555 |
9 |
3 |
12426 |
54.2 |
1.2 |
0.452 |
0 |
0 |
0 |
0.000 |
| 57 |
71 |
|
[FUC]A:508 |
5 |
1 |
280 |
cf |
[NAG]A:501 |
x,y,z |
1_555 |
3 |
1 |
360 |
53.8 |
2.2 |
0.393 |
0 |
0 |
0 |
0.000 |
| 58 |
72 |
|
[MAN]G:506 |
5 |
1 |
290 |
f |
G |
x,y,z |
1_555 |
8 |
3 |
12426 |
53.1 |
1.6 |
0.481 |
1 |
0 |
0 |
0.000 |
| 59 |
73 |
|
[MAN]E:505 |
6 |
1 |
296 |
cf |
[BMA]E:503 |
x,y,z |
1_555 |
3 |
1 |
291 |
52.7 |
2.4 |
0.304 |
0 |
0 |
0 |
0.000 |
| 60 |
74 |
|
[MAN]D:502 |
6 |
1 |
290 |
cf |
[BMA]D:501 |
x,y,z |
1_555 |
4 |
1 |
294 |
52.6 |
2.4 |
0.288 |
0 |
0 |
0 |
0.000 |
75 |
|
[MAN]H:506 |
6 |
1 |
292 |
cf |
[BMA]H:503 |
x,y,z |
1_555 |
3 |
1 |
296 |
47.9 |
2.3 |
0.308 |
0 |
0 |
0 |
0.000 |
| Average: |
50.2 |
2.3 |
0.298 |
0 |
0 |
0 |
0.000 |
| 61 |
76 |
|
[FUC]G:508 |
4 |
1 |
278 |
f |
[NAG]G:502 |
x,y,z |
1_555 |
6 |
1 |
361 |
52.4 |
2.6 |
0.288 |
1 |
0 |
0 |
0.000 |
| 62 |
77 |
|
[MAN]G:504 |
6 |
1 |
292 |
cf |
[BMA]G:503 |
x,y,z |
1_555 |
6 |
1 |
292 |
51.8 |
2.3 |
0.223 |
0 |
0 |
0 |
0.000 |
| 63 |
78 |
|
[MAN]H:504 |
6 |
1 |
294 |
cf |
[BMA]H:503 |
x,y,z |
1_555 |
5 |
1 |
296 |
51.8 |
2.5 |
0.262 |
0 |
0 |
0 |
0.000 |
| 64 |
79 |
|
[BMA]G:503 |
7 |
1 |
292 |
cf |
[NAG]G:502 |
x,y,z |
1_555 |
6 |
1 |
361 |
51.7 |
0.6 |
0.081 |
1 |
0 |
0 |
0.000 |
| 65 |
80 |
|
[MAN]H:506 |
4 |
1 |
292 |
f |
H |
x,y,z |
1_555 |
4 |
2 |
12341 |
51.0 |
1.8 |
0.575 |
1 |
0 |
0 |
0.000 |
| 66 |
81 |
|
[MAN]H:504 |
6 |
1 |
294 |
◊ |
[MAN]G:504 |
x,y,z |
1_555 |
6 |
1 |
292 |
50.3 |
1.6 |
0.131 |
1 |
0 |
0 |
0.000 |
| 67 |
82 |
|
[BMA]H:503 |
7 |
1 |
296 |
cf |
[NAG]H:502 |
x,y,z |
1_555 |
7 |
1 |
351 |
50.1 |
1.1 |
0.078 |
1 |
0 |
0 |
0.000 |
| 68 |
83 |
|
[MAN]A:506 |
6 |
1 |
292 |
f |
A |
x,y,z |
1_555 |
8 |
3 |
12501 |
49.2 |
1.3 |
0.365 |
0 |
0 |
0 |
0.000 |
| 69 |
84 |
|
[MAN]G:506 |
6 |
1 |
290 |
f |
[NAG]G:502 |
x,y,z |
1_555 |
5 |
1 |
361 |
48.8 |
1.6 |
0.168 |
0 |
0 |
0 |
0.000 |
| 70 |
85 |
|
[MAN]A:506 |
4 |
1 |
292 |
cf |
[BMA]A:503 |
x,y,z |
1_555 |
3 |
1 |
290 |
47.5 |
2.3 |
0.385 |
0 |
0 |
0 |
0.000 |
| 71 |
86 |
|
[MAN]G:506 |
6 |
1 |
290 |
cf |
[BMA]G:503 |
x,y,z |
1_555 |
3 |
1 |
292 |
46.8 |
2.2 |
0.281 |
0 |
0 |
0 |
0.000 |
| 72 |
87 |
|
[MAN]A:506 |
6 |
1 |
292 |
f |
[NAG]A:502 |
x,y,z |
1_555 |
7 |
1 |
357 |
44.9 |
1.3 |
0.096 |
0 |
0 |
0 |
0.000 |
| 73 |
88 |
|
[MAN]D:502 |
5 |
1 |
290 |
f |
D |
x,y,z |
1_555 |
7 |
2 |
11111 |
44.2 |
0.7 |
0.307 |
0 |
0 |
0 |
0.000 |
| 74 |
89 |
|
[MAN]H:506 |
6 |
1 |
292 |
f |
[NAG]H:502 |
x,y,z |
1_555 |
6 |
1 |
351 |
43.8 |
1.5 |
0.133 |
0 |
0 |
0 |
0.000 |
| 75 |
90 |
|
[MAN]E:505 |
5 |
1 |
296 |
f |
[NAG]E:502 |
x,y,z |
1_555 |
6 |
1 |
352 |
43.6 |
1.4 |
0.143 |
0 |
0 |
0 |
0.000 |
| 76 |
91 |
|
[MAN]E:505 |
4 |
1 |
296 |
f |
E |
x,y,z |
1_555 |
8 |
3 |
11407 |
43.2 |
1.1 |
0.439 |
0 |
0 |
0 |
0.000 |
| 77 |
92 |
|
[MAN]H:504 |
4 |
1 |
294 |
◊ |
[BMA]G:503 |
x,y,z |
1_555 |
4 |
1 |
292 |
42.4 |
0.5 |
0.141 |
0 |
0 |
0 |
0.000 |
| 78 |
93 |
|
[NAG]B:503 |
6 |
1 |
360 |
f |
B |
x,y,z |
1_555 |
5 |
3 |
10546 |
40.5 |
0.5 |
0.299 |
1 |
0 |
0 |
0.000 |
| 79 |
94 |
|
C |
4 |
3 |
9571 |
◊ |
F |
x-1,y,z-1 |
1_454 |
8 |
5 |
10093 |
40.2 |
-0.3 |
0.552 |
0 |
0 |
0 |
0.000 |
| 80 |
95 |
|
[MAN]G:504 |
4 |
1 |
292 |
◊ |
[NAG]H:502 |
x,y,z |
1_555 |
4 |
1 |
351 |
38.4 |
0.4 |
0.156 |
0 |
0 |
0 |
0.000 |
| 81 |
96 |
|
[NAG]G:501 |
3 |
1 |
360 |
◊ |
H |
x,y,z |
1_555 |
3 |
2 |
12341 |
37.8 |
0.8 |
0.354 |
0 |
0 |
0 |
0.000 |
| 82 |
97 |
|
[BMA]C:501 |
4 |
1 |
290 |
◊ |
C |
x,y,z |
1_555 |
3 |
2 |
9571 |
35.9 |
0.5 |
0.255 |
0 |
0 |
0 |
0.000 |
| 83 |
98 |
|
[BMA]H:503 |
3 |
1 |
296 |
f |
[NAG]H:505 |
x,y,z |
1_555 |
5 |
1 |
351 |
35.8 |
1.6 |
0.268 |
0 |
0 |
0 |
0.000 |
| 84 |
99 |
|
[MAN]E:504 |
4 |
1 |
287 |
f |
E |
x,y,z |
1_555 |
3 |
1 |
11407 |
35.4 |
-0.5 |
0.139 |
0 |
0 |
0 |
0.010 |
100 |
|
[MAN]G:504 |
4 |
1 |
292 |
f |
G |
x,y,z |
1_555 |
3 |
1 |
12426 |
32.4 |
0.1 |
0.232 |
0 |
0 |
0 |
0.010 |
| Average: |
33.9 |
-0.2 |
0.185 |
0 |
0 |
0 |
0.010 |
| 85 |
101 |
|
[FUC]E:507 |
3 |
1 |
282 |
f |
[NAG]E:502 |
x,y,z |
1_555 |
5 |
1 |
352 |
34.8 |
1.5 |
0.224 |
0 |
0 |
0 |
0.000 |
| 86 |
102 |
|
F |
4 |
2 |
10093 |
◊ |
[FUC]H:508 |
-x+1,y-1/2,-z+3 |
2_648 |
2 |
1 |
282 |
34.7 |
0.6 |
0.489 |
0 |
0 |
0 |
0.000 |
| 87 |
103 |
|
[NAG]A:505 |
5 |
1 |
352 |
f |
A |
x,y,z |
1_555 |
4 |
3 |
12501 |
34.4 |
0.4 |
0.239 |
0 |
0 |
0 |
0.000 |
| 88 |
104 |
|
[NAG]C:503 |
3 |
1 |
357 |
◊ |
C |
x,y,z |
1_555 |
5 |
2 |
9571 |
33.3 |
0.8 |
0.503 |
0 |
0 |
0 |
0.000 |
| 89 |
105 |
|
[MAN]A:504 |
5 |
1 |
291 |
f |
A |
x,y,z |
1_555 |
3 |
1 |
12501 |
32.2 |
-0.2 |
0.142 |
0 |
0 |
0 |
0.005 |
| 90 |
106 |
|
[NAG]H:505 |
2 |
1 |
351 |
f |
H |
x,y,z |
1_555 |
4 |
2 |
12341 |
31.7 |
0.9 |
0.476 |
0 |
0 |
0 |
0.000 |
| 91 |
107 |
|
[FUC]A:508 |
3 |
1 |
280 |
f |
[NAG]A:502 |
x,y,z |
1_555 |
4 |
1 |
357 |
30.9 |
1.0 |
0.237 |
0 |
0 |
0 |
0.000 |
| 92 |
108 |
|
[FUC]H:508 |
3 |
1 |
282 |
f |
[NAG]H:502 |
x,y,z |
1_555 |
5 |
1 |
351 |
30.2 |
1.4 |
0.224 |
0 |
0 |
0 |
0.000 |
| 93 |
109 |
|
[MAN]H:504 |
5 |
1 |
294 |
f |
[NAG]H:502 |
x,y,z |
1_555 |
3 |
1 |
351 |
30.1 |
0.9 |
0.175 |
0 |
0 |
0 |
0.000 |
| 94 |
110 |
|
[FUC]H:508 |
3 |
1 |
282 |
◊ |
[NAG]G:505 |
x,y,z |
1_555 |
2 |
1 |
356 |
29.8 |
1.4 |
0.441 |
0 |
0 |
0 |
0.000 |
| 95 |
111 |
|
[BMA]E:503 |
2 |
1 |
291 |
f |
[NAG]E:506 |
x,y,z |
1_555 |
4 |
1 |
346 |
29.7 |
1.6 |
0.295 |
0 |
0 |
0 |
0.000 |
112 |
|
[BMA]G:503 |
2 |
1 |
292 |
f |
[NAG]G:507 |
x,y,z |
1_555 |
4 |
1 |
363 |
18.4 |
1.0 |
0.249 |
0 |
0 |
0 |
0.000 |
| Average: |
24.0 |
1.3 |
0.272 |
0 |
0 |
0 |
0.000 |
| 96 |
113 |
|
[BMA]G:503 |
3 |
1 |
292 |
f |
[NAG]G:505 |
x,y,z |
1_555 |
5 |
1 |
356 |
29.5 |
0.5 |
0.108 |
1 |
0 |
0 |
0.000 |
| 97 |
114 |
|
[MAN]H:504 |
4 |
1 |
294 |
f |
H |
x,y,z |
1_555 |
3 |
1 |
12341 |
27.9 |
0.0 |
0.170 |
0 |
0 |
0 |
0.000 |
| 98 |
115 |
|
D |
5 |
3 |
11111 |
◊ |
B |
x,y,z |
1_555 |
4 |
3 |
10546 |
26.3 |
-0.5 |
0.494 |
0 |
0 |
0 |
0.000 |
| 99 |
116 |
|
[BMA]A:503 |
2 |
1 |
290 |
f |
[NAG]A:507 |
x,y,z |
1_555 |
4 |
1 |
363 |
25.6 |
1.5 |
0.352 |
0 |
0 |
0 |
0.000 |
| 100 |
117 |
|
[MAN]C:502 |
4 |
1 |
292 |
f |
[BMA]D:501 |
x,y,z |
1_555 |
3 |
1 |
294 |
24.6 |
0.2 |
0.147 |
0 |
0 |
0 |
0.000 |
| 101 |
118 |
|
[BMA]A:503 |
3 |
1 |
290 |
f |
[NAG]A:505 |
x,y,z |
1_555 |
5 |
1 |
352 |
23.6 |
0.9 |
0.206 |
0 |
0 |
0 |
0.000 |
| 102 |
119 |
|
[MAN]B:502 |
3 |
1 |
292 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
10546 |
23.6 |
-0.4 |
0.148 |
0 |
0 |
0 |
0.009 |
| 103 |
120 |
|
[BMA]C:501 |
3 |
1 |
290 |
f |
[NAG]C:503 |
x,y,z |
1_555 |
5 |
1 |
357 |
22.5 |
0.8 |
0.195 |
0 |
0 |
0 |
0.000 |
| 104 |
121 |
|
[BMA]H:503 |
2 |
1 |
296 |
f |
[NAG]H:507 |
x,y,z |
1_555 |
4 |
1 |
362 |
21.8 |
1.1 |
0.262 |
0 |
0 |
0 |
0.000 |
| 105 |
122 |
|
H |
2 |
1 |
12341 |
◊ |
A |
-x+1,y-1/2,-z+3 |
2_648 |
1 |
1 |
12501 |
20.9 |
-0.7 |
0.182 |
0 |
0 |
0 |
0.005 |
| 106 |
123 |
|
G |
2 |
1 |
12426 |
◊ |
[FUC]A:508 |
-x+1,y-1/2,-z+3 |
2_648 |
1 |
1 |
280 |
18.9 |
0.4 |
0.461 |
0 |
0 |
0 |
0.000 |
| 107 |
124 |
|
[NAG]H:502 |
4 |
1 |
351 |
◊ |
[NAG]G:505 |
x,y,z |
1_555 |
2 |
1 |
356 |
18.6 |
1.2 |
0.348 |
0 |
0 |
0 |
0.000 |
| 108 |
125 |
|
[NAG]H:501 |
4 |
1 |
360 |
◊ |
[NAG]G:505 |
x,y,z |
1_555 |
1 |
1 |
356 |
17.2 |
1.0 |
0.391 |
0 |
0 |
0 |
0.000 |
| 109 |
126 |
|
[MAN]G:504 |
3 |
1 |
292 |
◊ |
[BMA]H:503 |
x,y,z |
1_555 |
2 |
1 |
296 |
16.9 |
0.6 |
0.261 |
0 |
0 |
0 |
0.000 |
| 110 |
127 |
|
[FUC]H:508 |
3 |
1 |
282 |
f |
[MAN]H:506 |
x,y,z |
1_555 |
3 |
1 |
292 |
14.7 |
-0.1 |
0.146 |
0 |
0 |
0 |
0.002 |
| 111 |
128 |
|
E |
3 |
1 |
11407 |
◊ |
B |
-x,y-1/2,-z+2 |
2_547 |
1 |
1 |
10546 |
14.4 |
-0.2 |
0.353 |
0 |
0 |
0 |
0.003 |
| 112 |
129 |
|
[FUC]G:508 |
3 |
1 |
278 |
f |
[MAN]G:506 |
x,y,z |
1_555 |
3 |
1 |
290 |
13.3 |
0.1 |
0.151 |
0 |
0 |
0 |
0.000 |
| 113 |
130 |
|
[MAN]A:504 |
3 |
1 |
291 |
f |
[NAG]A:502 |
x,y,z |
1_555 |
2 |
1 |
357 |
12.0 |
0.5 |
0.220 |
0 |
0 |
0 |
0.000 |
| 114 |
131 |
|
[MAN]H:504 |
3 |
1 |
294 |
◊ |
[NAG]G:502 |
x,y,z |
1_555 |
2 |
1 |
361 |
11.8 |
-0.0 |
0.191 |
0 |
0 |
0 |
0.000 |
| 115 |
132 |
|
[FUC]A:508 |
2 |
1 |
280 |
f |
[MAN]A:506 |
x,y,z |
1_555 |
2 |
1 |
292 |
11.6 |
0.0 |
0.215 |
0 |
0 |
0 |
0.000 |
| 116 |
133 |
|
[BMA]D:501 |
1 |
1 |
294 |
f |
[NAG]D:503 |
x,y,z |
1_555 |
1 |
1 |
357 |
11.6 |
0.5 |
0.378 |
0 |
0 |
0 |
0.000 |
| 117 |
134 |
|
[FUC]E:507 |
3 |
1 |
282 |
f |
[MAN]E:505 |
x,y,z |
1_555 |
1 |
1 |
296 |
10.3 |
-0.0 |
0.237 |
0 |
0 |
0 |
0.000 |
| 118 |
135 |
|
D |
1 |
1 |
11111 |
◊ |
H |
x-1,y,z-1 |
1_454 |
3 |
1 |
12341 |
9.5 |
-0.0 |
0.417 |
0 |
0 |
0 |
0.000 |
| 119 |
136 |
|
G |
1 |
1 |
12426 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
10546 |
6.8 |
-0.0 |
0.479 |
0 |
0 |
0 |
0.000 |
| 120 |
137 |
|
[MAN]E:504 |
3 |
1 |
287 |
f |
[NAG]E:502 |
x,y,z |
1_555 |
2 |
1 |
352 |
4.6 |
-0.1 |
0.159 |
0 |
0 |
0 |
0.003 |
| 121 |
138 |
|
[MAN]B:502 |
1 |
1 |
292 |
◊ |
[MAN]A:504 |
x,y,z |
1_555 |
1 |
1 |
291 |
4.3 |
0.0 |
0.182 |
0 |
0 |
0 |
0.000 |
| 122 |
139 |
|
[MAN]G:504 |
1 |
1 |
292 |
◊ |
[NAG]H:501 |
x,y,z |
1_555 |
1 |
1 |
360 |
2.3 |
-0.0 |
0.161 |
0 |
0 |
0 |
0.000 |
| 123 |
140 |
|
[NAG]G:505 |
1 |
1 |
356 |
f |
G |
x,y,z |
1_555 |
1 |
1 |
12426 |
1.7 |
0.1 |
0.316 |
0 |
0 |
0 |
0.000 |
| 124 |
141 |
|
[MAN]G:504 |
2 |
1 |
292 |
f |
[NAG]G:502 |
x,y,z |
1_555 |
1 |
1 |
361 |
1.4 |
0.0 |
0.194 |
0 |
0 |
0 |
0.000 |
| 125 |
142 |
|
[NAG]G:502 |
1 |
1 |
361 |
◊ |
H |
x,y,z |
1_555 |
1 |
1 |
12341 |
1.1 |
-0.0 |
0.276 |
0 |
0 |
0 |
0.000 |
|