| ## |
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 |
507 |
121 |
49269 |
◊ |
A |
x,y,z |
1_555 |
520 |
127 |
32407 |
5050.4 |
-61.2 |
0.001 |
60 |
14 |
1 |
1.000 |
2 |
|
D |
498 |
118 |
49073 |
◊ |
C |
x,y,z |
1_555 |
518 |
123 |
32435 |
5045.0 |
-61.1 |
0.001 |
57 |
15 |
1 |
1.000 |
3 |
|
F |
507 |
121 |
48246 |
◊ |
E |
x,y,z |
1_555 |
519 |
126 |
32544 |
5026.7 |
-61.1 |
0.001 |
59 |
15 |
1 |
1.000 |
| Average: |
5040.7 |
-61.2 |
0.001 |
59 |
15 |
1 |
1.000 |
| 2 |
4 |
|
H |
487 |
118 |
48457 |
◊ |
G |
x,y,z |
1_555 |
494 |
122 |
32628 |
4807.9 |
-61.1 |
0.001 |
61 |
13 |
1 |
1.000 |
| 3 |
5 |
|
E |
147 |
48 |
32544 |
◊ |
C |
x,y,z |
1_555 |
142 |
48 |
32435 |
1362.1 |
-7.4 |
0.432 |
4 |
0 |
0 |
0.000 |
6 |
|
G |
108 |
39 |
32628 |
◊ |
A |
x,y,z |
1_555 |
104 |
38 |
32407 |
913.4 |
-4.7 |
0.495 |
0 |
0 |
0 |
0.000 |
| Average: |
1137.7 |
-6.0 |
0.464 |
2 |
0 |
0 |
0.000 |
| 4 |
7 |
|
N |
98 |
21 |
6209 |
◊ |
H |
x,y,z |
1_555 |
96 |
22 |
48457 |
909.0 |
-3.0 |
0.588 |
6 |
4 |
0 |
0.000 |
| 5 |
8 |
|
M |
96 |
20 |
6204 |
◊ |
F |
x,y,z |
1_555 |
96 |
22 |
48246 |
902.8 |
-3.2 |
0.574 |
4 |
4 |
0 |
0.000 |
9 |
|
Q |
95 |
21 |
6197 |
◊ |
B |
x,y,z |
1_555 |
101 |
23 |
49269 |
901.9 |
-2.9 |
0.593 |
5 |
4 |
0 |
0.000 |
10 |
|
P |
96 |
21 |
6201 |
◊ |
D |
x,y,z |
1_555 |
100 |
23 |
49073 |
899.7 |
-3.0 |
0.588 |
5 |
4 |
0 |
0.000 |
| Average: |
901.5 |
-3.0 |
0.585 |
5 |
4 |
0 |
0.000 |
| 6 |
11 |
|
N |
66 |
20 |
6209 |
◊ |
L |
x,y,z |
1_555 |
86 |
25 |
23633 |
712.9 |
-3.7 |
0.399 |
6 |
2 |
0 |
0.000 |
12 |
|
P |
66 |
21 |
6201 |
◊ |
K |
x,y,z |
1_555 |
83 |
24 |
23708 |
705.5 |
-3.4 |
0.402 |
5 |
3 |
0 |
0.000 |
13 |
|
M |
65 |
19 |
6204 |
◊ |
I |
x,y,z |
1_555 |
85 |
25 |
23655 |
700.8 |
-3.7 |
0.399 |
6 |
2 |
0 |
0.000 |
14 |
|
Q |
66 |
21 |
6197 |
◊ |
J |
x,y,z |
1_555 |
81 |
24 |
23706 |
696.5 |
-3.5 |
0.399 |
4 |
2 |
0 |
0.000 |
| Average: |
703.9 |
-3.6 |
0.400 |
5 |
2 |
0 |
0.000 |
| 7 |
15 |
|
L |
65 |
20 |
23633 |
◊ |
B |
x,y,z |
1_555 |
73 |
21 |
49269 |
610.9 |
-0.8 |
0.480 |
12 |
2 |
0 |
0.000 |
16 |
|
I |
68 |
21 |
23655 |
◊ |
D |
x,y,z |
1_555 |
70 |
21 |
49073 |
589.2 |
-0.5 |
0.511 |
12 |
1 |
0 |
0.000 |
17 |
|
K |
39 |
16 |
23708 |
◊ |
F |
x,y,z |
1_555 |
41 |
13 |
48246 |
311.7 |
-0.1 |
0.615 |
7 |
0 |
0 |
0.000 |
| Average: |
503.9 |
-0.5 |
0.535 |
10 |
1 |
0 |
0.000 |
| 8 |
18 |
|
N |
65 |
14 |
6209 |
◊ |
B |
x,y,z |
1_555 |
67 |
21 |
49269 |
599.6 |
-4.0 |
0.396 |
5 |
4 |
0 |
0.000 |
19 |
|
M |
63 |
13 |
6204 |
◊ |
D |
x,y,z |
1_555 |
69 |
22 |
49073 |
590.0 |
-3.8 |
0.425 |
5 |
4 |
0 |
0.000 |
20 |
|
P |
63 |
12 |
6201 |
◊ |
F |
x,y,z |
1_555 |
66 |
21 |
48246 |
583.3 |
-3.5 |
0.442 |
4 |
3 |
0 |
0.000 |
| Average: |
590.9 |
-3.8 |
0.421 |
5 |
4 |
0 |
0.000 |
| 9 |
21 |
|
Q |
63 |
12 |
6197 |
◊ |
H |
x,y,z |
1_555 |
65 |
21 |
48457 |
589.5 |
-3.5 |
0.440 |
4 |
4 |
0 |
0.000 |
| 10 |
22 |
|
J |
39 |
18 |
23706 |
◊ |
H |
-x,y-1/2,-z+1 |
2_546 |
42 |
14 |
48457 |
386.0 |
-4.2 |
0.223 |
2 |
1 |
0 |
0.000 |
| 11 |
23 |
|
F |
40 |
13 |
48246 |
◊ |
K |
-x+1,y-1/2,-z |
2_645 |
39 |
17 |
23708 |
383.5 |
-4.5 |
0.196 |
1 |
1 |
0 |
0.000 |
| 12 |
24 |
|
L |
42 |
16 |
23633 |
◊ |
F |
x,y,z |
1_555 |
44 |
13 |
48246 |
355.8 |
1.9 |
0.696 |
3 |
2 |
0 |
0.000 |
| 13 |
25 |
|
E |
32 |
10 |
32544 |
◊ |
D |
-x,y-1/2,-z |
2_545 |
49 |
19 |
49073 |
320.7 |
-3.5 |
0.318 |
0 |
0 |
0 |
0.000 |
26 |
|
B |
45 |
18 |
49269 |
◊ |
G |
-x+1,y-1/2,-z+1 |
2_646 |
28 |
8 |
32628 |
299.3 |
-2.8 |
0.362 |
0 |
0 |
0 |
0.000 |
| Average: |
310.0 |
-3.2 |
0.340 |
0 |
0 |
0 |
0.000 |
| 14 |
27 |
|
J |
44 |
16 |
23706 |
◊ |
H |
x,y,z |
1_555 |
37 |
13 |
48457 |
313.5 |
0.4 |
0.643 |
7 |
0 |
0 |
0.000 |
| 15 |
28 |
|
I |
19 |
10 |
23655 |
◊ |
H |
x,y,z-1 |
1_554 |
26 |
7 |
48457 |
218.2 |
1.6 |
0.772 |
0 |
0 |
0 |
0.000 |
| 16 |
29 |
|
A |
24 |
8 |
32407 |
◊ |
L |
-x+1,y-1/2,-z+1 |
2_646 |
29 |
12 |
23633 |
210.6 |
0.0 |
0.598 |
1 |
2 |
0 |
0.000 |
30 |
|
I |
31 |
11 |
23655 |
◊ |
C |
-x,y-1/2,-z |
2_545 |
23 |
8 |
32435 |
209.7 |
-0.2 |
0.568 |
1 |
2 |
0 |
0.000 |
| Average: |
210.1 |
-0.1 |
0.583 |
1 |
2 |
0 |
0.000 |
| 17 |
31 |
|
A |
22 |
9 |
32407 |
◊ |
L |
x,y-1,z |
1_545 |
25 |
12 |
23633 |
189.9 |
-0.3 |
0.575 |
0 |
0 |
0 |
0.000 |
32 |
|
I |
24 |
11 |
23655 |
◊ |
C |
x,y-1,z |
1_545 |
21 |
9 |
32435 |
183.9 |
-0.2 |
0.587 |
1 |
0 |
0 |
0.000 |
| Average: |
186.9 |
-0.3 |
0.581 |
1 |
0 |
0 |
0.000 |
| 18 |
33 |
|
B |
21 |
7 |
49269 |
◊ |
D |
-x,y-1/2,-z |
2_545 |
21 |
7 |
49073 |
179.9 |
0.5 |
0.647 |
1 |
0 |
0 |
0.000 |
| 19 |
34 |
|
H |
22 |
9 |
48457 |
◊ |
F |
-x+1,y-1/2,-z+1 |
2_646 |
18 |
5 |
48246 |
176.4 |
-1.3 |
0.433 |
0 |
0 |
0 |
0.000 |
| 20 |
35 |
|
F |
24 |
10 |
48246 |
◊ |
B |
x,y,z |
1_555 |
15 |
6 |
49269 |
170.8 |
-1.0 |
0.413 |
1 |
2 |
0 |
0.000 |
| 21 |
36 |
|
[NDG]I:1743 |
14 |
1 |
354 |
cf |
I |
x,y,z |
1_555 |
23 |
7 |
23655 |
164.6 |
4.2 |
0.315 |
2 |
0 |
0 |
0.000 |
37 |
|
[NDG]L:1743 |
13 |
1 |
351 |
cf |
L |
x,y,z |
1_555 |
24 |
8 |
23633 |
163.2 |
4.0 |
0.304 |
2 |
0 |
0 |
0.000 |
| Average: |
163.9 |
4.1 |
0.310 |
2 |
0 |
0 |
0.000 |
| 22 |
38 |
|
[NDG]K:1743 |
13 |
1 |
353 |
cf |
K |
x,y,z |
1_555 |
24 |
9 |
23708 |
164.1 |
4.1 |
0.338 |
0 |
0 |
0 |
0.000 |
| 23 |
39 |
|
[NDG]J:1743 |
14 |
1 |
355 |
cf |
J |
x,y,z |
1_555 |
22 |
7 |
23706 |
164.1 |
4.1 |
0.295 |
0 |
0 |
0 |
0.000 |
| 24 |
40 |
|
D |
22 |
7 |
49073 |
◊ |
H |
x,y,z-1 |
1_554 |
19 |
8 |
48457 |
162.4 |
-0.5 |
0.555 |
1 |
0 |
0 |
0.000 |
| 25 |
41 |
|
M |
20 |
7 |
6204 |
◊ |
C |
x,y,z |
1_555 |
21 |
5 |
32435 |
159.0 |
-0.3 |
0.611 |
2 |
0 |
0 |
0.000 |
42 |
|
N |
19 |
7 |
6209 |
◊ |
A |
x,y,z |
1_555 |
20 |
5 |
32407 |
150.1 |
-0.3 |
0.608 |
2 |
0 |
0 |
0.000 |
43 |
|
P |
16 |
5 |
6201 |
◊ |
E |
x,y,z |
1_555 |
18 |
5 |
32544 |
136.4 |
-0.3 |
0.601 |
2 |
0 |
0 |
0.000 |
44 |
|
Q |
16 |
5 |
6197 |
◊ |
G |
x,y,z |
1_555 |
18 |
5 |
32628 |
129.6 |
-0.3 |
0.600 |
2 |
0 |
0 |
0.000 |
| Average: |
143.8 |
-0.3 |
0.605 |
2 |
0 |
0 |
0.000 |
| 26 |
45 |
|
F |
18 |
8 |
48246 |
◊ |
D |
-x,y-1/2,-z |
2_545 |
19 |
4 |
49073 |
158.9 |
1.3 |
0.777 |
1 |
1 |
0 |
0.000 |
| 27 |
46 |
|
[NDG]E:1646 |
10 |
1 |
353 |
cf |
E |
x,y,z |
1_555 |
20 |
9 |
32544 |
148.8 |
4.1 |
0.513 |
0 |
0 |
0 |
0.000 |
| 28 |
47 |
|
[NDG]C:1646 |
11 |
1 |
354 |
cf |
C |
x,y,z |
1_555 |
22 |
8 |
32435 |
144.5 |
4.2 |
0.462 |
0 |
0 |
0 |
0.000 |
| 29 |
48 |
|
[NDG]K:1749 |
9 |
1 |
357 |
cf |
K |
x,y,z |
1_555 |
18 |
8 |
23708 |
137.4 |
4.5 |
0.574 |
0 |
0 |
0 |
0.000 |
| 30 |
49 |
|
[NDG]A:1646 |
9 |
1 |
352 |
cf |
A |
x,y,z |
1_555 |
20 |
8 |
32407 |
137.2 |
4.0 |
0.544 |
1 |
0 |
0 |
0.000 |
| 31 |
50 |
|
[NDG]G:1646 |
10 |
1 |
353 |
cf |
G |
x,y,z |
1_555 |
18 |
8 |
32628 |
135.0 |
4.0 |
0.490 |
0 |
0 |
0 |
0.000 |
| 32 |
51 |
|
[NDG]L:1746 |
10 |
1 |
351 |
cf |
L |
x,y,z |
1_555 |
19 |
7 |
23633 |
125.9 |
5.0 |
0.490 |
0 |
0 |
0 |
0.000 |
| 33 |
52 |
|
[NDG]I:1746 |
10 |
1 |
354 |
cf |
I |
x,y,z |
1_555 |
16 |
7 |
23655 |
121.6 |
4.9 |
0.563 |
0 |
0 |
0 |
0.000 |
| 34 |
53 |
|
B |
10 |
3 |
49269 |
◊ |
H |
-x+1,y-1/2,-z+1 |
2_646 |
16 |
8 |
48457 |
104.0 |
1.5 |
0.816 |
0 |
0 |
0 |
0.000 |
| 35 |
54 |
|
[NDG]F:2642 |
10 |
1 |
349 |
cf |
F |
x,y,z |
1_555 |
15 |
4 |
48246 |
103.4 |
2.8 |
0.324 |
1 |
0 |
0 |
0.000 |
| 36 |
55 |
|
[NDG]B:2642 |
7 |
1 |
351 |
cf |
B |
x,y,z |
1_555 |
9 |
3 |
49269 |
94.0 |
2.8 |
0.537 |
0 |
0 |
0 |
0.000 |
| 37 |
56 |
|
[BMA]F:2647 |
7 |
1 |
285 |
◊ |
E |
x,y,z |
1_555 |
15 |
6 |
32544 |
83.7 |
1.4 |
0.338 |
1 |
0 |
0 |
0.000 |
| 38 |
57 |
|
[NDG]D:2642 |
7 |
1 |
355 |
cf |
D |
x,y,z |
1_555 |
9 |
3 |
49073 |
82.8 |
2.7 |
0.474 |
0 |
0 |
0 |
0.000 |
| 39 |
58 |
|
[NDG]H:2642 |
7 |
1 |
352 |
cf |
H |
x,y,z |
1_555 |
8 |
3 |
48457 |
82.2 |
2.4 |
0.399 |
0 |
0 |
0 |
0.000 |
| 40 |
59 |
|
[NAG]F:2643 |
9 |
1 |
349 |
cf |
[NDG]F:2642 |
x,y,z |
1_555 |
9 |
1 |
349 |
80.0 |
2.6 |
0.069 |
0 |
0 |
0 |
0.000 |
| 41 |
60 |
|
[NAG]K:1744 |
9 |
1 |
359 |
cf |
[NDG]K:1743 |
x,y,z |
1_555 |
7 |
1 |
353 |
78.7 |
2.3 |
0.101 |
0 |
0 |
0 |
0.000 |
61 |
|
[NAG]B:2643 |
10 |
1 |
353 |
cf |
[NDG]B:2642 |
x,y,z |
1_555 |
7 |
1 |
351 |
77.3 |
1.9 |
0.062 |
0 |
0 |
0 |
0.000 |
62 |
|
[NAG]L:1744 |
9 |
1 |
355 |
cf |
[NDG]L:1743 |
x,y,z |
1_555 |
7 |
1 |
351 |
72.8 |
1.9 |
0.059 |
0 |
0 |
0 |
0.000 |
63 |
|
[NAG]I:1747 |
10 |
1 |
352 |
cf |
[NDG]I:1746 |
x,y,z |
1_555 |
7 |
1 |
354 |
70.2 |
1.6 |
0.060 |
0 |
0 |
0 |
0.000 |
| Average: |
74.8 |
1.9 |
0.071 |
0 |
0 |
0 |
0.000 |
| 42 |
64 |
|
[NAG]D:2643 |
8 |
1 |
355 |
cf |
[NDG]D:2642 |
x,y,z |
1_555 |
7 |
1 |
355 |
77.2 |
2.1 |
0.084 |
0 |
0 |
0 |
0.000 |
65 |
|
[NAG]C:1647 |
10 |
1 |
355 |
cf |
[NDG]C:1646 |
x,y,z |
1_555 |
7 |
1 |
354 |
76.4 |
2.2 |
0.064 |
0 |
0 |
0 |
0.000 |
66 |
|
[NAG]I:1744 |
10 |
1 |
356 |
cf |
[NDG]I:1743 |
x,y,z |
1_555 |
7 |
1 |
354 |
75.7 |
2.1 |
0.065 |
0 |
0 |
0 |
0.000 |
67 |
|
[NAG]J:1744 |
10 |
1 |
354 |
cf |
[NDG]J:1743 |
x,y,z |
1_555 |
7 |
1 |
355 |
75.6 |
2.1 |
0.066 |
0 |
0 |
0 |
0.000 |
| Average: |
76.2 |
2.1 |
0.070 |
0 |
0 |
0 |
0.000 |
| 43 |
68 |
|
[NAG]E:1647 |
9 |
1 |
355 |
cf |
[NDG]E:1646 |
x,y,z |
1_555 |
6 |
1 |
353 |
77.1 |
2.2 |
0.084 |
0 |
0 |
0 |
0.000 |
| 44 |
69 |
|
[NAG]H:2643 |
10 |
1 |
351 |
cf |
[NDG]H:2642 |
x,y,z |
1_555 |
6 |
1 |
352 |
76.8 |
1.8 |
0.063 |
0 |
0 |
0 |
0.000 |
| 45 |
70 |
|
[NAG]A:1647 |
9 |
1 |
356 |
cf |
[NDG]A:1646 |
x,y,z |
1_555 |
8 |
1 |
352 |
74.5 |
2.0 |
0.064 |
0 |
0 |
0 |
0.000 |
| 46 |
71 |
|
[MAN]K:1748 |
6 |
1 |
287 |
cf |
[MAN]K:1745 |
x,y,z |
1_555 |
6 |
1 |
287 |
69.6 |
2.5 |
0.255 |
0 |
0 |
0 |
0.000 |
| 47 |
72 |
|
[NAG]G:1647 |
10 |
1 |
353 |
cf |
[NDG]G:1646 |
x,y,z |
1_555 |
6 |
1 |
353 |
68.1 |
1.4 |
0.044 |
0 |
0 |
0 |
0.000 |
| 48 |
73 |
|
[BMA]B:2644 |
7 |
1 |
291 |
cf |
[NAG]B:2643 |
x,y,z |
1_555 |
6 |
1 |
353 |
63.9 |
1.4 |
0.095 |
0 |
0 |
0 |
0.000 |
| 49 |
74 |
|
[BMA]G:1648 |
6 |
1 |
288 |
cf |
[NAG]G:1647 |
x,y,z |
1_555 |
6 |
1 |
353 |
63.0 |
1.4 |
0.144 |
0 |
0 |
0 |
0.000 |
| 50 |
75 |
|
L |
11 |
4 |
23633 |
◊ |
H |
x,y,z |
1_555 |
8 |
3 |
48457 |
62.6 |
1.7 |
0.828 |
0 |
0 |
0 |
0.000 |
| 51 |
76 |
|
[BMA]D:2644 |
8 |
1 |
291 |
cf |
[NAG]D:2643 |
x,y,z |
1_555 |
6 |
1 |
355 |
62.4 |
1.7 |
0.109 |
0 |
0 |
0 |
0.000 |
| 52 |
77 |
|
[BMA]A:1648 |
6 |
1 |
292 |
cf |
[NAG]A:1647 |
x,y,z |
1_555 |
6 |
1 |
356 |
62.4 |
1.9 |
0.146 |
0 |
0 |
0 |
0.000 |
| 53 |
78 |
|
[MAN]J:1745 |
6 |
1 |
291 |
cf |
[NAG]J:1744 |
x,y,z |
1_555 |
6 |
1 |
354 |
62.3 |
1.7 |
0.149 |
1 |
0 |
0 |
0.000 |
79 |
|
[MAN]I:1745 |
6 |
1 |
290 |
cf |
[NAG]I:1744 |
x,y,z |
1_555 |
6 |
1 |
356 |
62.2 |
1.7 |
0.130 |
1 |
0 |
0 |
0.000 |
| Average: |
62.3 |
1.7 |
0.140 |
1 |
0 |
0 |
0.000 |
| 54 |
80 |
|
[BMA]L:1745 |
6 |
1 |
290 |
cf |
[NAG]L:1744 |
x,y,z |
1_555 |
6 |
1 |
355 |
62.1 |
1.7 |
0.145 |
1 |
0 |
0 |
0.000 |
81 |
|
[BMA]C:1648 |
8 |
1 |
291 |
cf |
[NAG]C:1647 |
x,y,z |
1_555 |
6 |
1 |
355 |
61.2 |
1.8 |
0.114 |
0 |
0 |
0 |
0.000 |
82 |
|
[BMA]E:1648 |
8 |
1 |
287 |
cf |
[NAG]E:1647 |
x,y,z |
1_555 |
6 |
1 |
355 |
61.1 |
1.9 |
0.107 |
0 |
0 |
0 |
0.000 |
| Average: |
61.5 |
1.8 |
0.122 |
0 |
0 |
0 |
0.000 |
| 55 |
83 |
|
[MAN]H:2644 |
6 |
1 |
288 |
cf |
[NAG]H:2643 |
x,y,z |
1_555 |
6 |
1 |
351 |
61.4 |
1.5 |
0.136 |
0 |
0 |
0 |
0.000 |
| 56 |
84 |
|
[NDG]B:2642 |
6 |
1 |
351 |
◊ |
A |
x,y,z |
1_555 |
7 |
2 |
32407 |
61.4 |
1.9 |
0.415 |
0 |
0 |
0 |
0.000 |
| 57 |
85 |
|
[BMA]C:1649 |
6 |
1 |
288 |
f |
[NAG]C:1647 |
x,y,z |
1_555 |
7 |
1 |
355 |
60.8 |
1.5 |
0.121 |
0 |
0 |
0 |
0.000 |
| 58 |
86 |
|
[NDG]H:2642 |
6 |
1 |
352 |
◊ |
G |
x,y,z |
1_555 |
8 |
2 |
32628 |
60.3 |
1.8 |
0.314 |
0 |
0 |
0 |
0.000 |
| 59 |
87 |
|
[MAN]K:1745 |
7 |
1 |
287 |
cf |
[NAG]K:1744 |
x,y,z |
1_555 |
6 |
1 |
359 |
60.0 |
1.5 |
0.136 |
0 |
0 |
0 |
0.000 |
| 60 |
88 |
|
[BMA]F:2646 |
7 |
1 |
292 |
cf |
[BMA]F:2645 |
x,y,z |
1_555 |
6 |
1 |
289 |
59.7 |
2.1 |
0.162 |
0 |
0 |
0 |
0.000 |
| 61 |
89 |
|
[BMA]C:1650 |
7 |
1 |
289 |
cf |
[BMA]C:1649 |
x,y,z |
1_555 |
5 |
1 |
288 |
59.7 |
2.2 |
0.224 |
0 |
0 |
0 |
0.000 |
| 62 |
90 |
|
[BMA]F:2644 |
6 |
1 |
289 |
cf |
[NAG]F:2643 |
x,y,z |
1_555 |
6 |
1 |
349 |
59.3 |
1.2 |
0.137 |
0 |
0 |
0 |
0.000 |
| 63 |
91 |
|
[BMA]G:1649 |
7 |
1 |
290 |
cf |
[BMA]G:1648 |
x,y,z |
1_555 |
6 |
1 |
288 |
59.1 |
2.0 |
0.195 |
0 |
0 |
0 |
0.000 |
| 64 |
92 |
|
[BMA]B:2645 |
6 |
1 |
280 |
cf |
[BMA]B:2644 |
x,y,z |
1_555 |
5 |
1 |
291 |
58.6 |
2.1 |
0.223 |
0 |
0 |
0 |
0.000 |
| 65 |
93 |
|
[BMA]D:2645 |
6 |
1 |
287 |
f |
[NAG]D:2643 |
x,y,z |
1_555 |
8 |
1 |
355 |
58.2 |
2.0 |
0.136 |
0 |
0 |
0 |
0.000 |
| 66 |
94 |
|
[NDG]F:2642 |
6 |
1 |
349 |
◊ |
E |
x,y,z |
1_555 |
9 |
3 |
32544 |
57.1 |
1.7 |
0.383 |
0 |
0 |
0 |
0.000 |
| 67 |
95 |
|
[BMA]F:2645 |
4 |
1 |
289 |
cf |
[BMA]F:2644 |
x,y,z |
1_555 |
6 |
1 |
289 |
56.9 |
2.4 |
0.291 |
0 |
0 |
0 |
0.000 |
| 68 |
96 |
|
[BMA]D:2645 |
6 |
1 |
287 |
cf |
[BMA]D:2644 |
x,y,z |
1_555 |
5 |
1 |
291 |
56.3 |
1.6 |
0.169 |
0 |
0 |
0 |
0.000 |
| 69 |
97 |
|
[BMA]E:1649 |
5 |
1 |
287 |
cf |
[BMA]E:1648 |
x,y,z |
1_555 |
5 |
1 |
287 |
56.3 |
2.7 |
0.300 |
0 |
0 |
0 |
0.000 |
| 70 |
98 |
|
[BMA]F:2647 |
3 |
1 |
285 |
cf |
[BMA]F:2645 |
x,y,z |
1_555 |
5 |
1 |
289 |
55.7 |
2.8 |
0.430 |
0 |
0 |
0 |
0.000 |
| 71 |
99 |
|
[BMA]C:1649 |
6 |
1 |
288 |
cf |
[BMA]C:1648 |
x,y,z |
1_555 |
5 |
1 |
291 |
54.8 |
1.9 |
0.213 |
0 |
0 |
0 |
0.000 |
| 72 |
100 |
|
[BMA]G:1650 |
6 |
1 |
287 |
cf |
[BMA]G:1649 |
x,y,z |
1_555 |
3 |
1 |
290 |
54.5 |
1.8 |
0.266 |
0 |
0 |
0 |
0.000 |
| 73 |
101 |
|
[BMA]A:1649 |
6 |
1 |
286 |
cf |
[BMA]A:1648 |
x,y,z |
1_555 |
5 |
1 |
292 |
54.2 |
1.5 |
0.165 |
0 |
0 |
0 |
0.000 |
| 74 |
102 |
|
[MAN]H:2645 |
5 |
1 |
287 |
cf |
[MAN]H:2644 |
x,y,z |
1_555 |
4 |
1 |
288 |
53.9 |
2.4 |
0.303 |
0 |
0 |
0 |
0.000 |
| 75 |
103 |
|
[MAN]K:1746 |
5 |
1 |
287 |
cf |
[MAN]K:1745 |
x,y,z |
1_555 |
5 |
1 |
287 |
53.3 |
2.5 |
0.330 |
0 |
0 |
0 |
0.000 |
| 76 |
104 |
|
I |
11 |
4 |
23655 |
◊ |
F |
x,y,z |
1_555 |
6 |
3 |
48246 |
50.9 |
1.4 |
0.803 |
0 |
0 |
0 |
0.000 |
105 |
|
J |
8 |
3 |
23706 |
◊ |
B |
x,y,z |
1_555 |
4 |
3 |
49269 |
40.2 |
0.9 |
0.801 |
0 |
0 |
0 |
0.000 |
106 |
|
K |
6 |
3 |
23708 |
◊ |
D |
x,y,z |
1_555 |
3 |
2 |
49073 |
22.7 |
0.5 |
0.744 |
0 |
0 |
0 |
0.000 |
| Average: |
37.9 |
0.9 |
0.783 |
0 |
0 |
0 |
0.000 |
| 77 |
107 |
|
[BMA]E:1649 |
6 |
1 |
287 |
f |
[NAG]E:1647 |
x,y,z |
1_555 |
6 |
1 |
355 |
49.9 |
1.6 |
0.145 |
0 |
0 |
0 |
0.000 |
| 78 |
108 |
|
[BMA]G:1649 |
5 |
1 |
290 |
f |
[NAG]G:1647 |
x,y,z |
1_555 |
7 |
1 |
353 |
49.5 |
1.9 |
0.173 |
1 |
0 |
0 |
0.000 |
| 79 |
109 |
|
I |
6 |
3 |
23655 |
◊ |
K |
x,y-1,z |
1_545 |
5 |
2 |
23708 |
49.5 |
-0.5 |
0.388 |
0 |
0 |
0 |
0.000 |
110 |
|
J |
5 |
2 |
23706 |
◊ |
L |
x,y-1,z |
1_545 |
4 |
2 |
23633 |
28.7 |
-0.5 |
0.395 |
0 |
0 |
0 |
0.000 |
| Average: |
39.1 |
-0.5 |
0.391 |
0 |
0 |
0 |
0.000 |
| 80 |
111 |
|
J |
8 |
4 |
23706 |
x |
J |
-x,y-1/2,-z+1 |
2_546 |
6 |
2 |
23706 |
49.3 |
0.5 |
0.707 |
0 |
0 |
0 |
0.000 |
112 |
|
K |
6 |
2 |
23708 |
x |
K |
-x+1,y-1/2,-z |
2_645 |
7 |
3 |
23708 |
42.3 |
0.2 |
0.657 |
0 |
0 |
0 |
0.000 |
| Average: |
45.8 |
0.4 |
0.682 |
0 |
0 |
0 |
0.000 |
| 81 |
113 |
|
[MAN]G:1651 |
7 |
1 |
282 |
◊ |
[BMA]G:1648 |
x,y,z |
1_555 |
6 |
1 |
288 |
49.1 |
2.2 |
0.217 |
0 |
0 |
0 |
0.000 |
| 82 |
114 |
|
[NDG]D:2642 |
6 |
1 |
355 |
◊ |
C |
x,y,z |
1_555 |
7 |
2 |
32435 |
48.6 |
1.8 |
0.367 |
0 |
0 |
0 |
0.000 |
| 83 |
115 |
|
[MAN]H:2645 |
6 |
1 |
287 |
f |
[NAG]H:2643 |
x,y,z |
1_555 |
7 |
1 |
351 |
48.6 |
1.8 |
0.133 |
0 |
0 |
0 |
0.000 |
| 84 |
116 |
|
[NAG]H:2643 |
3 |
1 |
351 |
◊ |
G |
x,y,z |
1_555 |
10 |
4 |
32628 |
47.4 |
0.8 |
0.514 |
0 |
0 |
0 |
0.000 |
| 85 |
117 |
|
[BMA]F:2645 |
7 |
1 |
289 |
f |
[NAG]F:2643 |
x,y,z |
1_555 |
6 |
1 |
349 |
44.8 |
1.5 |
0.134 |
0 |
0 |
0 |
0.000 |
| 86 |
118 |
|
[MAN]K:1746 |
4 |
1 |
287 |
f |
[BMA]K:1747 |
x,y,z |
1_555 |
4 |
1 |
291 |
39.3 |
2.0 |
0.329 |
0 |
0 |
0 |
0.000 |
| 87 |
119 |
|
[BMA]B:2646 |
4 |
1 |
290 |
f |
[BMA]B:2645 |
x,y,z |
1_555 |
3 |
1 |
280 |
39.0 |
1.2 |
0.289 |
0 |
0 |
0 |
0.000 |
| 88 |
120 |
|
[MG]K:1742 |
1 |
1 |
98 |
f |
K |
x,y,z |
1_555 |
6 |
5 |
23708 |
38.8 |
-6.6 |
0.000 |
0 |
0 |
0 |
0.000 |
121 |
|
[MG]I:1742 |
1 |
1 |
98 |
f |
I |
x,y,z |
1_555 |
8 |
6 |
23655 |
38.5 |
-6.5 |
0.000 |
0 |
0 |
0 |
0.000 |
122 |
|
[MG]L:1742 |
1 |
1 |
98 |
f |
L |
x,y,z |
1_555 |
7 |
5 |
23633 |
38.5 |
-6.5 |
0.000 |
0 |
0 |
0 |
0.000 |
123 |
|
[MG]J:1742 |
1 |
1 |
98 |
f |
J |
x,y,z |
1_555 |
6 |
5 |
23706 |
37.3 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.000 |
| Average: |
38.3 |
-6.5 |
0.000 |
0 |
0 |
0 |
0.000 |
| 89 |
124 |
|
[NAG]I:1747 |
4 |
1 |
352 |
f |
I |
x,y,z |
1_555 |
6 |
3 |
23655 |
37.2 |
0.8 |
0.412 |
0 |
0 |
0 |
0.000 |
| 90 |
125 |
|
[BMA]F:2646 |
4 |
1 |
292 |
f |
[BMA]F:2644 |
x,y,z |
1_555 |
6 |
1 |
289 |
34.5 |
0.4 |
0.118 |
1 |
0 |
0 |
0.001 |
| 91 |
126 |
|
[BMA]C:1650 |
4 |
1 |
289 |
f |
[NAG]C:1647 |
x,y,z |
1_555 |
4 |
1 |
355 |
33.9 |
1.5 |
0.245 |
0 |
0 |
0 |
0.000 |
| 92 |
127 |
|
[MAN]G:1651 |
4 |
1 |
282 |
◊ |
[NAG]G:1647 |
x,y,z |
1_555 |
3 |
1 |
353 |
33.5 |
0.6 |
0.166 |
1 |
0 |
0 |
0.000 |
| 93 |
128 |
|
F |
5 |
3 |
48246 |
◊ |
C |
x,y,z |
1_555 |
5 |
3 |
32435 |
33.2 |
0.6 |
0.774 |
0 |
0 |
0 |
0.000 |
129 |
|
D |
3 |
3 |
49073 |
◊ |
E |
x,y,z |
1_555 |
4 |
3 |
32544 |
14.5 |
0.3 |
0.725 |
0 |
0 |
0 |
0.000 |
130 |
|
B |
3 |
3 |
49269 |
◊ |
G |
x,y,z |
1_555 |
5 |
3 |
32628 |
11.9 |
0.2 |
0.697 |
0 |
0 |
0 |
0.000 |
| Average: |
19.8 |
0.4 |
0.732 |
0 |
0 |
0 |
0.000 |
| 94 |
131 |
|
[MG]J:1742 |
1 |
1 |
98 |
◊ |
H |
x,y,z |
1_555 |
6 |
1 |
48457 |
31.1 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.000 |
| 95 |
132 |
|
[MG]L:1742 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
6 |
1 |
49269 |
30.5 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.000 |
133 |
|
[MG]I:1742 |
1 |
1 |
98 |
◊ |
D |
x,y,z |
1_555 |
6 |
1 |
49073 |
30.2 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.000 |
134 |
|
[MG]K:1742 |
1 |
1 |
98 |
◊ |
F |
x,y,z |
1_555 |
3 |
1 |
48246 |
30.0 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.000 |
| Average: |
30.2 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.000 |
| 96 |
135 |
|
[NAG]F:2643 |
3 |
1 |
349 |
◊ |
E |
x,y,z |
1_555 |
3 |
3 |
32544 |
29.4 |
0.6 |
0.389 |
0 |
0 |
0 |
0.000 |
| 97 |
136 |
|
[NAG]K:1744 |
5 |
1 |
359 |
f |
K |
x,y,z |
1_555 |
4 |
3 |
23708 |
26.7 |
0.8 |
0.353 |
0 |
0 |
0 |
0.000 |
| 98 |
137 |
|
[BMA]G:1650 |
5 |
1 |
287 |
◊ |
L |
x,y-1,z |
1_545 |
5 |
3 |
23633 |
24.1 |
0.3 |
0.261 |
0 |
0 |
0 |
0.000 |
| 99 |
138 |
|
[MAN]G:1651 |
2 |
1 |
282 |
f |
A |
x,y,z |
1_555 |
2 |
2 |
32407 |
22.9 |
0.0 |
0.459 |
0 |
0 |
0 |
0.000 |
| 100 |
139 |
|
H |
4 |
3 |
48457 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
32407 |
22.5 |
0.4 |
0.736 |
0 |
0 |
0 |
0.000 |
| 101 |
140 |
|
[BMA]F:2645 |
2 |
1 |
289 |
◊ |
E |
x,y,z |
1_555 |
5 |
4 |
32544 |
22.5 |
-0.2 |
0.327 |
0 |
0 |
0 |
0.004 |
| 102 |
141 |
|
[MAN]H:2645 |
2 |
1 |
287 |
◊ |
G |
x,y,z |
1_555 |
5 |
2 |
32628 |
20.3 |
0.1 |
0.372 |
0 |
0 |
0 |
0.000 |
| 103 |
142 |
|
[BMA]A:1649 |
4 |
1 |
286 |
f |
[NAG]A:1647 |
x,y,z |
1_555 |
4 |
1 |
356 |
19.8 |
0.9 |
0.210 |
0 |
0 |
0 |
0.000 |
| 104 |
143 |
|
[NAG]B:2643 |
2 |
1 |
353 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
32407 |
18.0 |
0.5 |
0.471 |
0 |
0 |
0 |
0.000 |
| 105 |
144 |
|
B |
3 |
1 |
49269 |
◊ |
D |
-x+1,y-1/2,-z |
2_645 |
2 |
1 |
49073 |
16.6 |
0.4 |
0.782 |
0 |
0 |
0 |
0.000 |
| 106 |
145 |
|
[MAN]K:1748 |
1 |
1 |
287 |
f |
[NAG]K:1744 |
x,y,z |
1_555 |
3 |
1 |
359 |
13.6 |
0.3 |
0.262 |
0 |
0 |
0 |
0.000 |
| 107 |
146 |
|
[BMA]C:1650 |
3 |
1 |
289 |
f |
[BMA]C:1648 |
x,y,z |
1_555 |
1 |
1 |
291 |
12.4 |
0.1 |
0.150 |
0 |
0 |
0 |
0.000 |
| 108 |
147 |
|
A |
1 |
1 |
32407 |
◊ |
[BMA]A:1649 |
-x+1,y-1/2,-z+1 |
2_646 |
1 |
1 |
286 |
11.4 |
0.6 |
0.509 |
0 |
0 |
0 |
0.000 |
| 109 |
148 |
|
[BMA]B:2645 |
2 |
1 |
280 |
f |
[NAG]B:2643 |
x,y,z |
1_555 |
1 |
1 |
353 |
11.3 |
0.5 |
0.275 |
0 |
0 |
0 |
0.000 |
| 110 |
149 |
|
[MAN]K:1745 |
1 |
1 |
287 |
f |
[BMA]K:1747 |
x,y,z |
1_555 |
3 |
1 |
291 |
11.1 |
0.7 |
0.463 |
0 |
0 |
0 |
0.000 |
| 111 |
150 |
|
[MAN]K:1746 |
3 |
1 |
287 |
f |
[NAG]K:1744 |
x,y,z |
1_555 |
2 |
1 |
359 |
10.4 |
0.4 |
0.228 |
0 |
0 |
0 |
0.000 |
| 112 |
151 |
|
[NAG]I:1744 |
3 |
1 |
356 |
f |
I |
x,y,z |
1_555 |
4 |
4 |
23655 |
9.8 |
0.2 |
0.323 |
0 |
0 |
0 |
0.000 |
152 |
|
[NAG]L:1744 |
2 |
1 |
355 |
f |
L |
x,y,z |
1_555 |
2 |
2 |
23633 |
3.4 |
0.1 |
0.318 |
0 |
0 |
0 |
0.000 |
| Average: |
6.6 |
0.1 |
0.321 |
0 |
0 |
0 |
0.000 |
| 113 |
153 |
|
[NAG]A:1647 |
2 |
1 |
356 |
f |
A |
x,y,z |
1_555 |
2 |
1 |
32407 |
8.6 |
-0.0 |
0.281 |
0 |
0 |
0 |
0.000 |
| 114 |
154 |
|
Q |
2 |
1 |
6197 |
◊ |
N |
x,y,z |
1_555 |
2 |
1 |
6209 |
8.1 |
-0.0 |
0.618 |
0 |
0 |
0 |
0.000 |
155 |
|
P |
2 |
1 |
6201 |
◊ |
M |
x,y,z |
1_555 |
2 |
1 |
6204 |
7.5 |
-0.1 |
0.612 |
0 |
0 |
0 |
0.000 |
| Average: |
7.8 |
-0.0 |
0.615 |
0 |
0 |
0 |
0.000 |
| 115 |
156 |
|
[NAG]J:1744 |
4 |
1 |
354 |
f |
J |
x,y,z |
1_555 |
4 |
4 |
23706 |
7.9 |
0.2 |
0.280 |
0 |
0 |
0 |
0.000 |
| 116 |
157 |
|
[BMA]F:2646 |
2 |
1 |
292 |
◊ |
E |
x,y,z |
1_555 |
3 |
3 |
32544 |
7.6 |
0.3 |
0.446 |
0 |
0 |
0 |
0.000 |
| 117 |
158 |
|
[BMA]B:2646 |
3 |
1 |
290 |
f |
[BMA]B:2644 |
x,y,z |
1_555 |
2 |
1 |
291 |
7.6 |
0.4 |
0.245 |
0 |
0 |
0 |
0.000 |
| 118 |
159 |
|
C |
2 |
2 |
32435 |
◊ |
E |
-x,y-1/2,-z |
2_545 |
1 |
1 |
32544 |
6.3 |
-0.1 |
0.445 |
0 |
0 |
0 |
0.000 |
| 119 |
160 |
|
[BMA]B:2646 |
1 |
1 |
290 |
f |
[NAG]B:2643 |
x,y,z |
1_555 |
3 |
1 |
353 |
5.4 |
0.2 |
0.176 |
0 |
0 |
0 |
0.000 |
| 120 |
161 |
|
[NAG]B:2643 |
1 |
1 |
353 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
49269 |
4.9 |
0.2 |
0.470 |
0 |
0 |
0 |
0.000 |
| 121 |
162 |
|
[BMA]G:1649 |
1 |
1 |
290 |
f |
[NDG]G:1646 |
x,y,z |
1_555 |
2 |
1 |
353 |
4.7 |
-0.0 |
0.140 |
0 |
0 |
0 |
0.000 |
| 122 |
163 |
|
[BMA]G:1650 |
1 |
1 |
287 |
f |
[BMA]G:1648 |
x,y,z |
1_555 |
1 |
1 |
288 |
4.5 |
0.2 |
0.182 |
0 |
0 |
0 |
0.000 |
| 123 |
164 |
|
[BMA]F:2644 |
1 |
1 |
289 |
f |
[NDG]F:2642 |
x,y,z |
1_555 |
1 |
1 |
349 |
4.3 |
0.0 |
0.114 |
0 |
0 |
0 |
0.000 |
| 124 |
165 |
|
[MAN]K:1748 |
1 |
1 |
287 |
f |
[MAN]K:1746 |
x,y,z |
1_555 |
1 |
1 |
287 |
3.3 |
0.1 |
0.223 |
0 |
0 |
0 |
0.000 |
| 125 |
166 |
|
[NAG]E:1647 |
1 |
1 |
355 |
f |
E |
x,y,z |
1_555 |
1 |
1 |
32544 |
1.8 |
0.1 |
0.319 |
0 |
0 |
0 |
0.000 |
| 126 |
167 |
|
[BMA]F:2646 |
1 |
1 |
292 |
f |
[NAG]F:2643 |
x,y,z |
1_555 |
1 |
1 |
349 |
1.8 |
-0.1 |
0.161 |
0 |
0 |
0 |
0.001 |
| 127 |
168 |
|
[BMA]G:1648 |
2 |
1 |
288 |
◊ |
L |
x,y-1,z |
1_545 |
1 |
1 |
23633 |
1.6 |
0.0 |
0.437 |
0 |
0 |
0 |
0.000 |
| 128 |
169 |
|
[NAG]F:2643 |
1 |
1 |
349 |
f |
F |
x,y,z |
1_555 |
1 |
1 |
48246 |
0.9 |
0.0 |
0.315 |
0 |
0 |
0 |
0.000 |
|