| ## |
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 |
|
D |
118 |
37 |
9476 |
◊ |
C |
x,y,z |
1_555 |
107 |
37 |
9390 |
1063.7 |
-12.6 |
0.221 |
6 |
1 |
0 |
0.256 |
2 |
|
L |
116 |
35 |
9498 |
◊ |
K |
x,y,z |
1_555 |
104 |
35 |
9336 |
1031.0 |
-10.8 |
0.256 |
6 |
0 |
0 |
0.256 |
3 |
|
H |
117 |
34 |
9440 |
◊ |
G |
x,y,z |
1_555 |
102 |
33 |
9347 |
1027.3 |
-11.2 |
0.242 |
6 |
0 |
0 |
0.256 |
4 |
|
B |
113 |
37 |
9405 |
◊ |
A |
x,y,z |
1_555 |
101 |
35 |
9273 |
1010.6 |
-11.6 |
0.212 |
7 |
1 |
0 |
0.256 |
5 |
|
F |
108 |
33 |
9425 |
◊ |
E |
x,y,z |
1_555 |
105 |
35 |
9184 |
1000.5 |
-9.9 |
0.304 |
4 |
0 |
0 |
0.256 |
6 |
|
J |
119 |
36 |
9388 |
◊ |
I |
x,y,z |
1_555 |
101 |
32 |
9263 |
973.3 |
-11.7 |
0.224 |
6 |
0 |
0 |
0.256 |
7 |
|
N |
88 |
29 |
9115 |
◊ |
M |
x,y,z |
1_555 |
88 |
32 |
8918 |
848.2 |
-11.5 |
0.163 |
4 |
0 |
0 |
0.256 |
8 |
|
P |
87 |
28 |
9111 |
◊ |
O |
x,y,z |
1_555 |
85 |
28 |
9017 |
831.7 |
-11.0 |
0.196 |
5 |
1 |
0 |
0.256 |
| Average: |
973.3 |
-11.3 |
0.227 |
6 |
0 |
0 |
0.256 |
| 2 |
9 |
|
M |
72 |
22 |
8918 |
◊ |
F |
x,y,z |
1_555 |
71 |
22 |
9425 |
647.5 |
-7.2 |
0.325 |
6 |
4 |
0 |
0.020 |
10 |
|
G |
71 |
22 |
9347 |
◊ |
C |
-x,-y,z |
7_444 |
70 |
21 |
9390 |
644.8 |
-5.9 |
0.422 |
5 |
3 |
0 |
0.020 |
11 |
|
B |
70 |
22 |
9405 |
◊ |
D |
-y,x+1/2,z-3/4 |
2_554 |
68 |
22 |
9476 |
637.3 |
-7.5 |
0.300 |
5 |
4 |
0 |
0.020 |
12 |
|
L |
72 |
22 |
9498 |
◊ |
H |
x,y,z |
1_555 |
69 |
22 |
9440 |
634.2 |
-7.4 |
0.296 |
6 |
4 |
0 |
0.020 |
13 |
|
P |
65 |
19 |
9111 |
◊ |
K |
x,y,z |
1_555 |
68 |
20 |
9336 |
628.7 |
-7.2 |
0.319 |
5 |
3 |
0 |
0.020 |
14 |
|
N |
67 |
21 |
9115 |
◊ |
I |
x,y,z |
1_555 |
67 |
21 |
9263 |
620.2 |
-7.5 |
0.299 |
5 |
3 |
0 |
0.020 |
15 |
|
E |
68 |
21 |
9184 |
◊ |
A |
x,y,z |
1_555 |
68 |
21 |
9273 |
614.6 |
-6.6 |
0.347 |
5 |
3 |
0 |
0.020 |
16 |
|
O |
69 |
23 |
9017 |
◊ |
J |
-y+1/2,x,z-1/4 |
6_544 |
67 |
23 |
9388 |
611.8 |
-8.6 |
0.231 |
5 |
2 |
0 |
0.020 |
| Average: |
629.9 |
-7.3 |
0.318 |
5 |
3 |
0 |
0.020 |
| 3 |
17 |
|
B |
54 |
14 |
9405 |
◊ |
H |
-x-1/2,-y+1/2,z-1/2 |
3_454 |
53 |
14 |
9440 |
542.2 |
-7.9 |
0.182 |
2 |
1 |
0 |
0.069 |
18 |
|
L |
55 |
15 |
9498 |
◊ |
F |
-y,x+1/2,z+1/4 |
2_555 |
54 |
15 |
9425 |
531.4 |
-7.3 |
0.208 |
2 |
1 |
0 |
0.069 |
19 |
|
J |
50 |
13 |
9388 |
◊ |
D |
-y+1/2,x,z-1/4 |
6_544 |
52 |
15 |
9476 |
512.4 |
-8.6 |
0.129 |
2 |
1 |
0 |
0.069 |
| Average: |
528.7 |
-7.9 |
0.173 |
2 |
1 |
0 |
0.069 |
| 4 |
20 |
|
M |
28 |
12 |
8918 |
◊ |
L |
x,y,z |
1_555 |
28 |
11 |
9498 |
260.2 |
0.3 |
0.662 |
2 |
0 |
0 |
0.000 |
21 |
|
H |
28 |
9 |
9440 |
◊ |
D |
x,y,z |
1_555 |
27 |
11 |
9476 |
253.3 |
-1.1 |
0.536 |
3 |
0 |
0 |
0.000 |
22 |
|
O |
25 |
12 |
9017 |
◊ |
J |
x,y,z |
1_555 |
26 |
11 |
9388 |
235.1 |
-0.9 |
0.566 |
2 |
0 |
0 |
0.000 |
| Average: |
249.6 |
-0.6 |
0.588 |
2 |
0 |
0 |
0.000 |
| 5 |
23 |
|
[T99]O:701 |
26 |
1 |
655 |
f |
O |
x,y,z |
1_555 |
30 |
12 |
9017 |
254.8 |
-3.4 |
0.633 |
7 |
0 |
0 |
0.264 |
24 |
|
[T99]M:701 |
25 |
1 |
649 |
f |
M |
x,y,z |
1_555 |
30 |
12 |
8918 |
248.8 |
-3.0 |
0.617 |
8 |
0 |
0 |
0.264 |
25 |
|
[T99]P:701 |
25 |
1 |
654 |
f |
P |
x,y,z |
1_555 |
30 |
12 |
9111 |
248.5 |
-4.7 |
0.566 |
8 |
0 |
0 |
0.264 |
26 |
|
[T99]C:702 |
24 |
1 |
659 |
f |
C |
x,y,z |
1_555 |
29 |
12 |
9390 |
248.4 |
-3.4 |
0.635 |
7 |
0 |
0 |
0.264 |
27 |
|
[T99]N:701 |
25 |
1 |
653 |
f |
N |
x,y,z |
1_555 |
30 |
12 |
9115 |
248.3 |
-4.1 |
0.593 |
7 |
0 |
0 |
0.264 |
28 |
|
[T99]A:701 |
26 |
1 |
657 |
f |
A |
x,y,z |
1_555 |
30 |
12 |
9273 |
248.1 |
-4.8 |
0.548 |
7 |
0 |
0 |
0.264 |
29 |
|
[T99]D:701 |
26 |
1 |
647 |
f |
D |
x,y,z |
1_555 |
29 |
12 |
9476 |
247.3 |
-4.3 |
0.574 |
7 |
0 |
0 |
0.264 |
30 |
|
[T99]K:701 |
25 |
1 |
652 |
f |
K |
x,y,z |
1_555 |
31 |
12 |
9336 |
246.7 |
-3.0 |
0.632 |
7 |
0 |
0 |
0.264 |
31 |
|
[T99]H:701 |
25 |
1 |
652 |
f |
H |
x,y,z |
1_555 |
29 |
12 |
9440 |
246.3 |
-3.2 |
0.612 |
8 |
0 |
0 |
0.264 |
32 |
|
[T99]E:701 |
26 |
1 |
651 |
f |
E |
x,y,z |
1_555 |
30 |
12 |
9184 |
245.7 |
-3.3 |
0.628 |
8 |
0 |
0 |
0.264 |
33 |
|
[T99]G:701 |
24 |
1 |
662 |
f |
G |
x,y,z |
1_555 |
31 |
12 |
9347 |
245.6 |
-5.0 |
0.547 |
7 |
0 |
0 |
0.264 |
34 |
|
[T99]L:702 |
26 |
1 |
645 |
f |
L |
x,y,z |
1_555 |
28 |
12 |
9498 |
244.5 |
-4.8 |
0.534 |
8 |
0 |
0 |
0.264 |
35 |
|
[T99]B:701 |
24 |
1 |
653 |
f |
B |
x,y,z |
1_555 |
29 |
12 |
9405 |
243.8 |
-3.0 |
0.619 |
8 |
0 |
0 |
0.264 |
36 |
|
[T99]I:702 |
23 |
1 |
657 |
f |
I |
x,y,z |
1_555 |
27 |
12 |
9263 |
241.2 |
-3.4 |
0.606 |
7 |
0 |
0 |
0.264 |
37 |
|
[T99]J:703 |
26 |
1 |
656 |
f |
J |
x,y,z |
1_555 |
29 |
12 |
9388 |
241.2 |
-4.9 |
0.562 |
7 |
0 |
0 |
0.264 |
38 |
|
[T99]F:702 |
25 |
1 |
651 |
f |
F |
x,y,z |
1_555 |
30 |
11 |
9425 |
241.0 |
-4.7 |
0.586 |
9 |
0 |
0 |
0.264 |
| Average: |
246.3 |
-3.9 |
0.593 |
8 |
0 |
0 |
0.264 |
| 6 |
39 |
|
[T99]J:703 |
23 |
1 |
656 |
◊ |
I |
x,y,z |
1_555 |
33 |
13 |
9263 |
250.4 |
1.1 |
0.839 |
4 |
0 |
0 |
0.014 |
40 |
|
[T99]G:701 |
23 |
1 |
662 |
◊ |
H |
x,y,z |
1_555 |
32 |
13 |
9440 |
250.1 |
2.1 |
0.869 |
3 |
0 |
0 |
0.014 |
41 |
|
[T99]I:702 |
23 |
1 |
657 |
◊ |
J |
x,y,z |
1_555 |
34 |
13 |
9388 |
250.0 |
2.1 |
0.860 |
4 |
0 |
0 |
0.014 |
42 |
|
[T99]L:702 |
25 |
1 |
645 |
◊ |
K |
x,y,z |
1_555 |
32 |
13 |
9336 |
249.7 |
1.2 |
0.828 |
4 |
0 |
0 |
0.014 |
43 |
|
[T99]F:702 |
24 |
1 |
651 |
◊ |
E |
x,y,z |
1_555 |
35 |
13 |
9184 |
249.2 |
1.0 |
0.819 |
4 |
0 |
0 |
0.014 |
44 |
|
[T99]E:701 |
25 |
1 |
651 |
◊ |
F |
x,y,z |
1_555 |
35 |
13 |
9425 |
248.9 |
1.4 |
0.847 |
3 |
0 |
0 |
0.014 |
45 |
|
[T99]H:701 |
24 |
1 |
652 |
◊ |
G |
x,y,z |
1_555 |
32 |
13 |
9347 |
248.2 |
1.5 |
0.848 |
4 |
0 |
0 |
0.014 |
46 |
|
[T99]N:701 |
23 |
1 |
653 |
◊ |
M |
x,y,z |
1_555 |
34 |
15 |
8918 |
248.0 |
1.5 |
0.851 |
5 |
0 |
0 |
0.014 |
47 |
|
[T99]P:701 |
24 |
1 |
654 |
◊ |
O |
x,y,z |
1_555 |
32 |
13 |
9017 |
248.0 |
1.6 |
0.832 |
3 |
0 |
0 |
0.014 |
48 |
|
[T99]K:701 |
22 |
1 |
652 |
◊ |
L |
x,y,z |
1_555 |
34 |
13 |
9498 |
247.4 |
1.6 |
0.835 |
4 |
0 |
0 |
0.014 |
49 |
|
[T99]C:702 |
23 |
1 |
659 |
◊ |
D |
x,y,z |
1_555 |
33 |
13 |
9476 |
246.9 |
1.7 |
0.851 |
4 |
0 |
0 |
0.014 |
50 |
|
[T99]A:701 |
24 |
1 |
657 |
◊ |
B |
x,y,z |
1_555 |
35 |
13 |
9405 |
246.9 |
1.4 |
0.833 |
4 |
0 |
0 |
0.014 |
51 |
|
[T99]B:701 |
26 |
1 |
653 |
◊ |
A |
x,y,z |
1_555 |
34 |
13 |
9273 |
246.0 |
0.9 |
0.809 |
3 |
0 |
0 |
0.014 |
52 |
|
[T99]M:701 |
19 |
1 |
649 |
◊ |
N |
x,y,z |
1_555 |
32 |
15 |
9115 |
226.2 |
1.2 |
0.750 |
3 |
0 |
0 |
0.014 |
53 |
|
[T99]O:701 |
18 |
1 |
655 |
◊ |
P |
x,y,z |
1_555 |
34 |
14 |
9111 |
223.9 |
1.1 |
0.758 |
2 |
0 |
0 |
0.014 |
54 |
|
[T99]D:701 |
16 |
1 |
647 |
◊ |
C |
x,y,z |
1_555 |
30 |
13 |
9390 |
214.6 |
1.2 |
0.735 |
2 |
0 |
0 |
0.014 |
| Average: |
243.4 |
1.4 |
0.823 |
4 |
0 |
0 |
0.014 |
| 7 |
55 |
|
N |
27 |
7 |
9115 |
◊ |
K |
-y+1/2,x,z-1/4 |
6_544 |
25 |
8 |
9336 |
207.0 |
-0.9 |
0.552 |
1 |
1 |
0 |
0.000 |
| 8 |
56 |
|
G |
23 |
8 |
9347 |
◊ |
D |
-x,-y,z |
7_444 |
20 |
7 |
9476 |
177.1 |
0.7 |
0.759 |
6 |
0 |
0 |
0.000 |
57 |
|
H |
20 |
7 |
9440 |
◊ |
C |
-x,-y,z |
7_444 |
20 |
7 |
9390 |
177.1 |
0.2 |
0.712 |
5 |
0 |
0 |
0.000 |
58 |
|
P |
19 |
7 |
9111 |
◊ |
J |
-y+1/2,x,z-1/4 |
6_544 |
22 |
7 |
9388 |
172.5 |
0.6 |
0.760 |
6 |
0 |
0 |
0.000 |
59 |
|
M |
21 |
7 |
8918 |
◊ |
E |
x,y,z |
1_555 |
21 |
7 |
9184 |
170.3 |
0.4 |
0.749 |
6 |
0 |
0 |
0.000 |
60 |
|
K |
22 |
7 |
9336 |
◊ |
H |
x,y,z |
1_555 |
22 |
8 |
9440 |
170.2 |
0.6 |
0.762 |
5 |
0 |
0 |
0.000 |
61 |
|
F |
20 |
7 |
9425 |
◊ |
A |
x,y,z |
1_555 |
22 |
7 |
9273 |
168.4 |
0.4 |
0.739 |
6 |
0 |
0 |
0.000 |
62 |
|
E |
23 |
8 |
9184 |
◊ |
B |
x,y,z |
1_555 |
20 |
8 |
9405 |
167.0 |
0.6 |
0.769 |
6 |
0 |
0 |
0.000 |
63 |
|
O |
22 |
7 |
9017 |
◊ |
K |
x,y,z |
1_555 |
19 |
7 |
9336 |
166.3 |
0.1 |
0.713 |
5 |
0 |
0 |
0.000 |
64 |
|
N |
21 |
7 |
9115 |
◊ |
J |
x,y,z |
1_555 |
19 |
7 |
9388 |
166.0 |
0.2 |
0.723 |
5 |
0 |
0 |
0.000 |
65 |
|
L |
20 |
7 |
9498 |
◊ |
G |
x,y,z |
1_555 |
21 |
7 |
9347 |
165.4 |
0.5 |
0.750 |
5 |
0 |
0 |
0.000 |
66 |
|
P |
20 |
7 |
9111 |
◊ |
L |
x,y,z |
1_555 |
18 |
7 |
9498 |
163.2 |
0.6 |
0.753 |
5 |
0 |
0 |
0.000 |
67 |
|
N |
20 |
7 |
9115 |
◊ |
F |
x,y,z |
1_555 |
20 |
6 |
9425 |
162.4 |
0.7 |
0.777 |
6 |
0 |
0 |
0.000 |
68 |
|
B |
19 |
6 |
9405 |
◊ |
C |
-y,x+1/2,z-3/4 |
2_554 |
19 |
7 |
9390 |
162.2 |
0.5 |
0.756 |
5 |
0 |
0 |
0.000 |
69 |
|
M |
19 |
7 |
8918 |
◊ |
I |
x,y,z |
1_555 |
20 |
7 |
9263 |
160.7 |
0.6 |
0.770 |
5 |
0 |
0 |
0.000 |
70 |
|
O |
22 |
8 |
9017 |
◊ |
I |
-y+1/2,x,z-1/4 |
6_544 |
20 |
7 |
9263 |
159.8 |
0.4 |
0.752 |
5 |
0 |
0 |
0.000 |
71 |
|
A |
21 |
8 |
9273 |
◊ |
D |
-y,x+1/2,z-3/4 |
2_554 |
21 |
7 |
9476 |
159.6 |
0.6 |
0.761 |
6 |
0 |
0 |
0.000 |
| Average: |
166.8 |
0.5 |
0.750 |
5 |
0 |
0 |
0.000 |
| 9 |
72 |
|
I |
12 |
6 |
9263 |
◊ |
C |
-y+1/2,x,z-1/4 |
6_544 |
14 |
6 |
9390 |
114.6 |
-0.9 |
0.517 |
0 |
0 |
0 |
0.009 |
73 |
|
K |
12 |
5 |
9336 |
◊ |
E |
-y,x+1/2,z+1/4 |
2_555 |
10 |
6 |
9184 |
106.3 |
-1.0 |
0.475 |
0 |
0 |
0 |
0.009 |
74 |
|
A |
9 |
5 |
9273 |
◊ |
G |
-x-1/2,-y+1/2,z-1/2 |
3_454 |
9 |
4 |
9347 |
99.1 |
-1.2 |
0.388 |
0 |
0 |
0 |
0.009 |
| Average: |
106.7 |
-1.0 |
0.460 |
0 |
0 |
0 |
0.009 |
| 10 |
75 |
|
C |
8 |
3 |
9390 |
◊ |
C |
-x,-y,z |
7_444 |
8 |
3 |
9390 |
102.6 |
3.2 |
0.963 |
2 |
4 |
0 |
0.000 |
76 |
|
P |
8 |
2 |
9111 |
◊ |
N |
x,y,z |
1_555 |
7 |
3 |
9115 |
91.0 |
2.3 |
0.930 |
1 |
2 |
0 |
0.000 |
| Average: |
96.8 |
2.7 |
0.947 |
2 |
3 |
0 |
0.000 |
| 11 |
77 |
|
[GOL]D:702 |
6 |
1 |
219 |
f |
C |
x,y,z |
1_555 |
18 |
7 |
9390 |
99.3 |
-1.2 |
0.396 |
2 |
0 |
0 |
0.037 |
78 |
|
[GOL]E:703 |
6 |
1 |
219 |
f |
E |
x,y,z |
1_555 |
19 |
9 |
9184 |
99.1 |
-1.3 |
0.399 |
2 |
0 |
0 |
0.037 |
79 |
|
[GOL]O:703 |
6 |
1 |
218 |
f |
O |
x,y,z |
1_555 |
17 |
7 |
9017 |
95.8 |
-1.1 |
0.431 |
2 |
0 |
0 |
0.037 |
| Average: |
98.1 |
-1.2 |
0.409 |
2 |
0 |
0 |
0.037 |
| 12 |
80 |
|
[GOL]I:701 |
6 |
1 |
219 |
f |
N |
x,y,z |
1_555 |
18 |
7 |
9115 |
99.1 |
-1.2 |
0.419 |
2 |
0 |
0 |
0.071 |
81 |
|
[GOL]C:701 |
6 |
1 |
218 |
f |
G |
-x,-y,z |
7_444 |
18 |
7 |
9347 |
98.0 |
-1.3 |
0.386 |
2 |
0 |
0 |
0.071 |
82 |
|
[GOL]L:701 |
6 |
1 |
221 |
f |
L |
x,y,z |
1_555 |
16 |
6 |
9498 |
96.6 |
-1.1 |
0.430 |
2 |
0 |
0 |
0.071 |
83 |
|
[GOL]F:703 |
6 |
1 |
218 |
f |
M |
x,y,z |
1_555 |
16 |
7 |
8918 |
95.4 |
-1.2 |
0.423 |
2 |
0 |
0 |
0.071 |
84 |
|
[GOL]J:702 |
6 |
1 |
220 |
f |
J |
x,y,z |
1_555 |
17 |
7 |
9388 |
95.3 |
-1.0 |
0.434 |
2 |
0 |
0 |
0.071 |
85 |
|
[GOL]A:704 |
6 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
18 |
7 |
9273 |
95.1 |
-1.3 |
0.410 |
2 |
0 |
0 |
0.071 |
86 |
|
[GOL]F:701 |
6 |
1 |
220 |
f |
F |
x,y,z |
1_555 |
15 |
6 |
9425 |
94.0 |
-1.0 |
0.426 |
2 |
0 |
0 |
0.071 |
87 |
|
[GOL]A:703 |
6 |
1 |
221 |
f |
B |
x,y,z |
1_555 |
16 |
6 |
9405 |
93.7 |
-1.1 |
0.422 |
2 |
0 |
0 |
0.071 |
| Average: |
95.9 |
-1.2 |
0.419 |
2 |
0 |
0 |
0.071 |
| 13 |
88 |
|
[GOL]J:701 |
6 |
1 |
219 |
f |
I |
x,y,z |
1_555 |
17 |
7 |
9263 |
95.1 |
-1.2 |
0.406 |
2 |
0 |
0 |
0.034 |
| 14 |
89 |
|
[GOL]C:704 |
6 |
1 |
220 |
f |
D |
x,y,z |
1_555 |
16 |
6 |
9476 |
92.9 |
-1.2 |
0.425 |
2 |
0 |
0 |
0.036 |
90 |
|
[GOL]G:703 |
6 |
1 |
218 |
f |
H |
x,y,z |
1_555 |
16 |
6 |
9440 |
91.2 |
-1.3 |
0.390 |
2 |
0 |
0 |
0.036 |
| Average: |
92.1 |
-1.2 |
0.407 |
2 |
0 |
0 |
0.036 |
| 15 |
91 |
|
[GOL]K:703 |
6 |
1 |
220 |
f |
K |
x,y,z |
1_555 |
17 |
7 |
9336 |
92.9 |
-1.0 |
0.451 |
2 |
0 |
0 |
0.031 |
| 16 |
92 |
|
K |
9 |
4 |
9336 |
◊ |
F |
-y,x+1/2,z+1/4 |
2_555 |
9 |
5 |
9425 |
77.3 |
0.7 |
0.738 |
0 |
0 |
0 |
0.000 |
93 |
|
I |
9 |
4 |
9263 |
◊ |
D |
-y+1/2,x,z-1/4 |
6_544 |
8 |
6 |
9476 |
67.1 |
0.8 |
0.754 |
0 |
0 |
0 |
0.000 |
94 |
|
B |
7 |
6 |
9405 |
◊ |
G |
-x-1/2,-y+1/2,z-1/2 |
3_454 |
8 |
4 |
9347 |
52.1 |
0.1 |
0.681 |
0 |
0 |
0 |
0.000 |
95 |
|
A |
4 |
4 |
9273 |
◊ |
H |
-x-1/2,-y+1/2,z-1/2 |
3_454 |
5 |
5 |
9440 |
44.9 |
0.7 |
0.821 |
0 |
0 |
0 |
0.000 |
96 |
|
J |
5 |
4 |
9388 |
◊ |
C |
-y+1/2,x,z-1/4 |
6_544 |
4 |
2 |
9390 |
37.2 |
-0.2 |
0.515 |
0 |
0 |
0 |
0.000 |
97 |
|
L |
4 |
3 |
9498 |
◊ |
E |
-y,x+1/2,z+1/4 |
2_555 |
3 |
3 |
9184 |
34.5 |
0.5 |
0.699 |
0 |
0 |
0 |
0.000 |
| Average: |
52.2 |
0.4 |
0.701 |
0 |
0 |
0 |
0.000 |
| 17 |
98 |
|
[GOL]K:703 |
3 |
1 |
220 |
◊ |
P |
x,y,z |
1_555 |
11 |
4 |
9111 |
58.7 |
0.5 |
0.717 |
2 |
0 |
0 |
0.000 |
| 18 |
99 |
|
O |
11 |
4 |
9017 |
◊ |
[GOL]J:702 |
-y+1/2,x,z-1/4 |
6_544 |
3 |
1 |
220 |
58.5 |
0.6 |
0.719 |
2 |
0 |
0 |
0.002 |
100 |
|
[GOL]A:704 |
3 |
1 |
219 |
◊ |
E |
x,y,z |
1_555 |
12 |
4 |
9184 |
58.2 |
0.5 |
0.717 |
3 |
0 |
0 |
0.002 |
101 |
|
[GOL]F:703 |
3 |
1 |
218 |
◊ |
F |
x,y,z |
1_555 |
12 |
4 |
9425 |
57.8 |
0.6 |
0.711 |
3 |
0 |
0 |
0.002 |
102 |
|
[GOL]L:701 |
3 |
1 |
221 |
◊ |
H |
x,y,z |
1_555 |
12 |
4 |
9440 |
57.5 |
0.6 |
0.717 |
2 |
0 |
0 |
0.002 |
103 |
|
[GOL]F:701 |
3 |
1 |
220 |
◊ |
M |
x,y,z |
1_555 |
11 |
4 |
8918 |
57.2 |
0.6 |
0.716 |
2 |
0 |
0 |
0.002 |
| Average: |
57.8 |
0.6 |
0.716 |
2 |
0 |
0 |
0.002 |
| 19 |
104 |
|
B |
12 |
4 |
9405 |
◊ |
[GOL]C:704 |
-y,x+1/2,z-3/4 |
2_554 |
3 |
1 |
220 |
58.4 |
0.6 |
0.715 |
3 |
0 |
0 |
0.001 |
105 |
|
[GOL]G:703 |
4 |
1 |
218 |
◊ |
L |
x,y,z |
1_555 |
12 |
4 |
9498 |
56.7 |
0.5 |
0.683 |
2 |
0 |
0 |
0.001 |
| Average: |
57.6 |
0.6 |
0.699 |
3 |
0 |
0 |
0.001 |
| 20 |
106 |
|
[GOL]J:701 |
4 |
1 |
219 |
◊ |
N |
x,y,z |
1_555 |
11 |
4 |
9115 |
58.0 |
0.4 |
0.673 |
3 |
0 |
0 |
0.002 |
107 |
|
[GOL]A:703 |
3 |
1 |
221 |
◊ |
D |
-y,x+1/2,z-3/4 |
2_554 |
12 |
4 |
9476 |
57.1 |
0.5 |
0.709 |
2 |
0 |
0 |
0.002 |
108 |
|
[GOL]E:703 |
4 |
1 |
219 |
◊ |
A |
x,y,z |
1_555 |
12 |
4 |
9273 |
56.6 |
0.4 |
0.674 |
2 |
0 |
0 |
0.002 |
109 |
|
[GOL]C:701 |
4 |
1 |
218 |
◊ |
C |
x,y,z |
1_555 |
12 |
4 |
9390 |
56.4 |
0.5 |
0.685 |
3 |
0 |
0 |
0.002 |
110 |
|
[GOL]I:701 |
3 |
1 |
219 |
◊ |
I |
x,y,z |
1_555 |
12 |
4 |
9263 |
56.1 |
0.5 |
0.716 |
2 |
0 |
0 |
0.002 |
111 |
|
[GOL]O:703 |
3 |
1 |
218 |
◊ |
J |
-y+1/2,x,z-1/4 |
6_544 |
10 |
4 |
9388 |
55.1 |
0.6 |
0.716 |
2 |
0 |
0 |
0.002 |
112 |
|
[GOL]D:702 |
4 |
1 |
219 |
◊ |
G |
-x,-y,z |
7_444 |
11 |
4 |
9347 |
55.1 |
0.4 |
0.680 |
2 |
0 |
0 |
0.002 |
| Average: |
56.4 |
0.5 |
0.693 |
2 |
0 |
0 |
0.002 |
| 21 |
113 |
|
G |
5 |
2 |
9347 |
◊ |
C |
x,y,z |
1_555 |
4 |
2 |
9390 |
42.3 |
2.3 |
0.943 |
1 |
1 |
0 |
0.000 |
114 |
|
N |
4 |
2 |
9115 |
◊ |
K |
x,y,z |
1_555 |
3 |
1 |
9336 |
20.3 |
1.1 |
0.886 |
0 |
0 |
0 |
0.000 |
| Average: |
31.3 |
1.7 |
0.914 |
1 |
1 |
0 |
0.000 |
| 22 |
115 |
|
[GOL]O:703 |
4 |
1 |
218 |
◊ |
P |
x,y,z |
1_555 |
4 |
1 |
9111 |
38.5 |
0.3 |
0.629 |
2 |
0 |
0 |
0.020 |
116 |
|
[GOL]A:703 |
3 |
1 |
221 |
◊ |
A |
x,y,z |
1_555 |
4 |
1 |
9273 |
37.4 |
0.3 |
0.621 |
2 |
0 |
0 |
0.020 |
117 |
|
[GOL]K:703 |
4 |
1 |
220 |
◊ |
L |
x,y,z |
1_555 |
5 |
2 |
9498 |
37.1 |
0.3 |
0.651 |
2 |
0 |
0 |
0.020 |
118 |
|
[GOL]F:701 |
4 |
1 |
220 |
◊ |
E |
x,y,z |
1_555 |
4 |
1 |
9184 |
37.1 |
0.3 |
0.642 |
2 |
0 |
0 |
0.020 |
119 |
|
[GOL]A:704 |
4 |
1 |
219 |
◊ |
B |
x,y,z |
1_555 |
4 |
1 |
9405 |
37.0 |
0.3 |
0.624 |
2 |
0 |
0 |
0.020 |
120 |
|
[GOL]D:702 |
4 |
1 |
219 |
◊ |
D |
x,y,z |
1_555 |
4 |
1 |
9476 |
36.8 |
0.3 |
0.630 |
2 |
0 |
0 |
0.020 |
121 |
|
[GOL]I:701 |
3 |
1 |
219 |
◊ |
M |
x,y,z |
1_555 |
4 |
1 |
8918 |
36.4 |
0.3 |
0.689 |
2 |
0 |
0 |
0.020 |
122 |
|
[GOL]C:701 |
3 |
1 |
218 |
◊ |
H |
-x,-y,z |
7_444 |
4 |
1 |
9440 |
36.1 |
0.3 |
0.692 |
2 |
0 |
0 |
0.020 |
123 |
|
[GOL]L:701 |
4 |
1 |
221 |
◊ |
K |
x,y,z |
1_555 |
4 |
1 |
9336 |
35.9 |
0.3 |
0.639 |
2 |
0 |
0 |
0.020 |
124 |
|
[GOL]F:703 |
3 |
1 |
218 |
◊ |
N |
x,y,z |
1_555 |
4 |
1 |
9115 |
35.7 |
0.3 |
0.702 |
2 |
0 |
0 |
0.020 |
125 |
|
[GOL]J:702 |
3 |
1 |
220 |
◊ |
I |
x,y,z |
1_555 |
4 |
1 |
9263 |
35.1 |
0.3 |
0.645 |
2 |
0 |
0 |
0.020 |
| Average: |
36.6 |
0.3 |
0.651 |
2 |
0 |
0 |
0.020 |
| 23 |
126 |
|
[GOL]C:704 |
4 |
1 |
220 |
◊ |
C |
x,y,z |
1_555 |
4 |
1 |
9390 |
38.0 |
0.3 |
0.632 |
2 |
0 |
0 |
0.009 |
127 |
|
[GOL]G:703 |
3 |
1 |
218 |
◊ |
G |
x,y,z |
1_555 |
4 |
1 |
9347 |
37.9 |
0.4 |
0.703 |
2 |
0 |
0 |
0.009 |
| Average: |
38.0 |
0.3 |
0.668 |
2 |
0 |
0 |
0.009 |
| 24 |
128 |
|
[GOL]E:703 |
4 |
1 |
219 |
◊ |
F |
x,y,z |
1_555 |
4 |
1 |
9425 |
37.3 |
0.3 |
0.637 |
2 |
0 |
0 |
0.009 |
129 |
|
[GOL]J:701 |
4 |
1 |
219 |
◊ |
J |
x,y,z |
1_555 |
4 |
1 |
9388 |
36.3 |
0.4 |
0.646 |
2 |
0 |
0 |
0.009 |
| Average: |
36.8 |
0.3 |
0.641 |
2 |
0 |
0 |
0.009 |
| 25 |
130 |
|
[CA]J:704 |
1 |
1 |
85 |
f |
J |
x,y,z |
1_555 |
9 |
7 |
9388 |
33.6 |
-6.9 |
0.000 |
0 |
0 |
0 |
0.250 |
131 |
|
[CA]I:703 |
1 |
1 |
85 |
f |
I |
x,y,z |
1_555 |
9 |
7 |
9263 |
33.4 |
-7.1 |
0.000 |
0 |
0 |
0 |
0.250 |
132 |
|
[CA]O:702 |
1 |
1 |
85 |
f |
O |
x,y,z |
1_555 |
9 |
7 |
9017 |
33.3 |
-6.9 |
0.000 |
0 |
0 |
0 |
0.250 |
133 |
|
[CA]C:703 |
1 |
1 |
85 |
f |
C |
x,y,z |
1_555 |
10 |
7 |
9390 |
33.3 |
-7.1 |
0.000 |
0 |
0 |
0 |
0.250 |
134 |
|
[CA]N:702 |
1 |
1 |
85 |
f |
N |
x,y,z |
1_555 |
8 |
7 |
9115 |
33.0 |
-7.1 |
0.000 |
0 |
0 |
0 |
0.250 |
135 |
|
[CA]M:702 |
1 |
1 |
85 |
f |
M |
x,y,z |
1_555 |
8 |
7 |
8918 |
33.0 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.250 |
136 |
|
[CA]D:703 |
1 |
1 |
85 |
f |
D |
x,y,z |
1_555 |
8 |
7 |
9476 |
33.0 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.250 |
137 |
|
[CA]K:702 |
1 |
1 |
85 |
f |
K |
x,y,z |
1_555 |
9 |
7 |
9336 |
32.9 |
-7.0 |
0.000 |
0 |
0 |
0 |
0.250 |
138 |
|
[CA]G:702 |
1 |
1 |
85 |
f |
G |
x,y,z |
1_555 |
9 |
7 |
9347 |
32.9 |
-7.0 |
0.000 |
0 |
0 |
0 |
0.250 |
139 |
|
[CA]P:702 |
1 |
1 |
85 |
f |
P |
x,y,z |
1_555 |
8 |
7 |
9111 |
32.8 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.250 |
140 |
|
[CA]F:704 |
1 |
1 |
85 |
f |
F |
x,y,z |
1_555 |
7 |
6 |
9425 |
32.7 |
-7.0 |
0.000 |
0 |
0 |
0 |
0.250 |
141 |
|
[CA]E:702 |
1 |
1 |
85 |
f |
E |
x,y,z |
1_555 |
9 |
7 |
9184 |
32.6 |
-6.8 |
0.000 |
0 |
0 |
0 |
0.250 |
142 |
|
[CA]A:702 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
8 |
7 |
9273 |
32.6 |
-7.1 |
0.000 |
0 |
0 |
0 |
0.250 |
143 |
|
[CA]H:702 |
1 |
1 |
85 |
f |
H |
x,y,z |
1_555 |
8 |
7 |
9440 |
32.5 |
-7.0 |
0.000 |
0 |
0 |
0 |
0.250 |
144 |
|
[CA]L:703 |
1 |
1 |
85 |
f |
L |
x,y,z |
1_555 |
8 |
7 |
9498 |
32.4 |
-7.1 |
0.000 |
0 |
0 |
0 |
0.250 |
145 |
|
[CA]B:702 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
8 |
7 |
9405 |
32.4 |
-7.1 |
0.000 |
0 |
0 |
0 |
0.250 |
| Average: |
32.9 |
-7.1 |
0.000 |
0 |
0 |
0 |
0.250 |
| 26 |
146 |
|
[CA]J:704 |
1 |
1 |
85 |
f |
[T99]J:703 |
x,y,z |
1_555 |
5 |
1 |
656 |
31.8 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.209 |
147 |
|
[CA]I:703 |
1 |
1 |
85 |
f |
[T99]I:702 |
x,y,z |
1_555 |
6 |
1 |
657 |
31.8 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.209 |
148 |
|
[CA]E:702 |
1 |
1 |
85 |
f |
[T99]E:701 |
x,y,z |
1_555 |
5 |
1 |
651 |
31.7 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.209 |
149 |
|
[CA]O:702 |
1 |
1 |
85 |
f |
[T99]O:701 |
x,y,z |
1_555 |
5 |
1 |
655 |
31.7 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.209 |
150 |
|
[CA]G:702 |
1 |
1 |
85 |
f |
[T99]G:701 |
x,y,z |
1_555 |
5 |
1 |
662 |
31.6 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.209 |
151 |
|
[CA]A:702 |
1 |
1 |
85 |
f |
[T99]A:701 |
x,y,z |
1_555 |
5 |
1 |
657 |
31.6 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.209 |
152 |
|
[CA]C:703 |
1 |
1 |
85 |
f |
[T99]C:702 |
x,y,z |
1_555 |
5 |
1 |
659 |
31.5 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.209 |
153 |
|
[CA]F:704 |
1 |
1 |
85 |
f |
[T99]F:702 |
x,y,z |
1_555 |
5 |
1 |
651 |
31.5 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.209 |
154 |
|
[CA]K:702 |
1 |
1 |
85 |
f |
[T99]K:701 |
x,y,z |
1_555 |
5 |
1 |
652 |
31.3 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.209 |
155 |
|
[CA]H:702 |
1 |
1 |
85 |
f |
[T99]H:701 |
x,y,z |
1_555 |
5 |
1 |
652 |
31.2 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.209 |
156 |
|
[CA]P:702 |
1 |
1 |
85 |
f |
[T99]P:701 |
x,y,z |
1_555 |
5 |
1 |
654 |
31.1 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.209 |
157 |
|
[CA]N:702 |
1 |
1 |
85 |
f |
[T99]N:701 |
x,y,z |
1_555 |
5 |
1 |
653 |
31.1 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.209 |
158 |
|
[CA]B:702 |
1 |
1 |
85 |
f |
[T99]B:701 |
x,y,z |
1_555 |
5 |
1 |
653 |
31.1 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.209 |
159 |
|
[CA]M:702 |
1 |
1 |
85 |
f |
[T99]M:701 |
x,y,z |
1_555 |
5 |
1 |
649 |
30.7 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.209 |
160 |
|
[CA]L:703 |
1 |
1 |
85 |
f |
[T99]L:702 |
x,y,z |
1_555 |
5 |
1 |
645 |
30.7 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.209 |
161 |
|
[CA]D:703 |
1 |
1 |
85 |
f |
[T99]D:701 |
x,y,z |
1_555 |
4 |
1 |
647 |
30.6 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.209 |
| Average: |
31.3 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.209 |
| 27 |
162 |
|
K |
4 |
1 |
9336 |
◊ |
I |
x,y,z |
1_555 |
4 |
1 |
9263 |
24.2 |
0.0 |
0.657 |
0 |
0 |
0 |
0.000 |
163 |
|
G |
2 |
1 |
9347 |
◊ |
G |
-x,-y,z |
7_444 |
2 |
1 |
9347 |
12.8 |
0.1 |
0.705 |
0 |
0 |
0 |
0.000 |
| Average: |
18.5 |
0.1 |
0.681 |
0 |
0 |
0 |
0.000 |
| 28 |
164 |
|
M |
2 |
2 |
8918 |
◊ |
M |
-x,-y,z |
7_444 |
2 |
2 |
8918 |
4.2 |
0.0 |
0.635 |
0 |
0 |
0 |
0.000 |
| 29 |
165 |
|
P |
2 |
2 |
9111 |
◊ |
M |
x,y,z |
1_555 |
1 |
1 |
8918 |
1.6 |
0.0 |
0.660 |
0 |
0 |
0 |
0.000 |
166 |
|
D |
1 |
1 |
9476 |
◊ |
C |
-x,-y,z |
7_444 |
1 |
1 |
9390 |
1.0 |
0.0 |
0.704 |
0 |
0 |
0 |
0.000 |
| Average: |
1.3 |
0.0 |
0.682 |
0 |
0 |
0 |
0.000 |
|