| ## |
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 |
|
J |
674 |
147 |
32873 |
◊ |
I |
x,y,z |
1_555 |
701 |
146 |
32381 |
6551.2 |
-89.8 |
0.976 |
369 |
0 |
0 |
1.000 |
2 |
|
V |
671 |
147 |
32823 |
◊ |
U |
x,y,z |
1_555 |
684 |
146 |
32304 |
6505.6 |
-89.3 |
0.973 |
373 |
0 |
0 |
1.000 |
| Average: |
6528.4 |
-89.6 |
0.974 |
371 |
0 |
0 |
1.000 |
| 2 |
3 |
|
B |
235 |
55 |
7411 |
◊ |
A |
x,y,z |
1_555 |
271 |
59 |
8429 |
2526.5 |
-41.8 |
0.060 |
23 |
4 |
0 |
1.000 |
4 |
|
N |
231 |
53 |
7069 |
◊ |
M |
x,y,z |
1_555 |
262 |
60 |
8761 |
2452.4 |
-43.2 |
0.062 |
20 |
4 |
0 |
1.000 |
5 |
|
R |
229 |
53 |
6589 |
◊ |
Q |
x,y,z |
1_555 |
256 |
58 |
8283 |
2429.3 |
-42.2 |
0.070 |
24 |
6 |
0 |
1.000 |
6 |
|
F |
229 |
53 |
7126 |
◊ |
E |
x,y,z |
1_555 |
257 |
58 |
8352 |
2420.6 |
-42.3 |
0.053 |
25 |
4 |
0 |
1.000 |
| Average: |
2457.2 |
-42.4 |
0.061 |
23 |
5 |
0 |
1.000 |
| 3 |
7 |
|
D |
241 |
60 |
8006 |
◊ |
C |
x,y,z |
1_555 |
251 |
60 |
8217 |
2490.7 |
-43.2 |
0.053 |
18 |
6 |
0 |
1.000 |
8 |
|
P |
245 |
61 |
7778 |
◊ |
O |
x,y,z |
1_555 |
249 |
58 |
8692 |
2436.1 |
-41.9 |
0.056 |
17 |
7 |
0 |
1.000 |
9 |
|
H |
235 |
61 |
7745 |
◊ |
G |
x,y,z |
1_555 |
241 |
61 |
8447 |
2417.7 |
-44.3 |
0.046 |
20 |
7 |
0 |
1.000 |
10 |
|
T |
240 |
59 |
7731 |
◊ |
S |
x,y,z |
1_555 |
240 |
59 |
8691 |
2408.4 |
-44.7 |
0.032 |
20 |
6 |
0 |
1.000 |
| Average: |
2438.2 |
-43.5 |
0.047 |
19 |
7 |
0 |
1.000 |
| 4 |
11 |
|
U |
102 |
19 |
32304 |
◊ |
M |
x,y,z |
1_555 |
85 |
24 |
8761 |
792.7 |
-7.3 |
0.804 |
12 |
0 |
0 |
0.161 |
12 |
|
I |
99 |
21 |
32381 |
◊ |
A |
x,y,z |
1_555 |
76 |
21 |
8429 |
766.9 |
-3.8 |
0.874 |
12 |
0 |
0 |
0.161 |
| Average: |
779.8 |
-5.6 |
0.839 |
12 |
0 |
0 |
0.161 |
| 5 |
13 |
|
V |
93 |
18 |
32823 |
◊ |
M |
x,y,z |
1_555 |
75 |
23 |
8761 |
755.6 |
-11.2 |
0.646 |
15 |
0 |
0 |
1.000 |
14 |
|
J |
89 |
18 |
32873 |
◊ |
A |
x,y,z |
1_555 |
69 |
23 |
8429 |
688.4 |
-8.6 |
0.730 |
16 |
0 |
0 |
1.000 |
| Average: |
722.0 |
-9.9 |
0.688 |
16 |
0 |
0 |
1.000 |
| 6 |
15 |
|
V |
94 |
18 |
32823 |
◊ |
Q |
x,y,z |
1_555 |
72 |
21 |
8283 |
712.4 |
-9.5 |
0.713 |
14 |
0 |
0 |
1.000 |
16 |
|
J |
97 |
18 |
32873 |
◊ |
E |
x,y,z |
1_555 |
75 |
21 |
8352 |
709.2 |
-8.7 |
0.726 |
17 |
0 |
0 |
1.000 |
| Average: |
710.8 |
-9.1 |
0.720 |
16 |
0 |
0 |
1.000 |
| 7 |
17 |
|
O |
63 |
17 |
8692 |
◊ |
Q |
x,y,z |
1_555 |
64 |
22 |
8283 |
670.1 |
-8.7 |
0.328 |
6 |
0 |
0 |
0.285 |
18 |
|
G |
63 |
17 |
8447 |
◊ |
A |
x,y,z |
1_555 |
67 |
21 |
8429 |
658.4 |
-7.9 |
0.404 |
6 |
0 |
0 |
0.285 |
19 |
|
C |
59 |
17 |
8217 |
◊ |
E |
x,y,z |
1_555 |
65 |
22 |
8352 |
651.5 |
-8.6 |
0.295 |
5 |
0 |
0 |
0.285 |
20 |
|
S |
56 |
16 |
8691 |
◊ |
M |
x,y,z |
1_555 |
61 |
20 |
8761 |
651.3 |
-8.4 |
0.299 |
6 |
0 |
0 |
0.285 |
| Average: |
657.8 |
-8.4 |
0.331 |
6 |
0 |
0 |
0.285 |
| 8 |
21 |
|
U |
84 |
16 |
32304 |
◊ |
Q |
x,y,z |
1_555 |
74 |
23 |
8283 |
666.7 |
-11.8 |
0.612 |
12 |
0 |
0 |
1.000 |
22 |
|
I |
82 |
17 |
32381 |
◊ |
E |
x,y,z |
1_555 |
73 |
21 |
8352 |
647.0 |
-12.5 |
0.547 |
12 |
0 |
0 |
1.000 |
| Average: |
656.9 |
-12.1 |
0.579 |
12 |
0 |
0 |
1.000 |
| 9 |
23 |
|
E |
59 |
15 |
8352 |
◊ |
A |
x,y,z |
1_555 |
61 |
15 |
8429 |
651.7 |
-8.1 |
0.368 |
5 |
5 |
0 |
0.142 |
24 |
|
Q |
61 |
15 |
8283 |
◊ |
M |
x,y,z |
1_555 |
56 |
15 |
8761 |
630.3 |
-7.6 |
0.425 |
3 |
4 |
0 |
0.142 |
| Average: |
641.0 |
-7.9 |
0.397 |
4 |
5 |
0 |
0.142 |
| 10 |
25 |
|
D |
51 |
13 |
8006 |
◊ |
B |
x,y,z |
1_555 |
58 |
11 |
7411 |
520.5 |
-1.0 |
0.707 |
7 |
1 |
0 |
0.056 |
26 |
|
T |
52 |
12 |
7731 |
◊ |
R |
x,y,z |
1_555 |
49 |
11 |
6589 |
486.4 |
-1.9 |
0.694 |
4 |
1 |
0 |
0.056 |
27 |
|
P |
52 |
13 |
7778 |
◊ |
N |
x,y,z |
1_555 |
52 |
11 |
7069 |
479.8 |
-3.4 |
0.610 |
4 |
1 |
0 |
0.056 |
28 |
|
H |
47 |
12 |
7745 |
◊ |
F |
x,y,z |
1_555 |
48 |
11 |
7126 |
475.1 |
-2.5 |
0.678 |
5 |
1 |
0 |
0.056 |
| Average: |
490.4 |
-2.2 |
0.672 |
5 |
1 |
0 |
0.056 |
| 11 |
29 |
|
V |
60 |
13 |
32823 |
◊ |
S |
x,y,z |
1_555 |
54 |
18 |
8691 |
493.3 |
-5.2 |
0.688 |
7 |
0 |
0 |
0.016 |
30 |
|
J |
66 |
13 |
32873 |
◊ |
G |
x,y,z |
1_555 |
51 |
18 |
8447 |
485.6 |
-3.9 |
0.769 |
10 |
0 |
0 |
0.016 |
| Average: |
489.4 |
-4.5 |
0.728 |
9 |
0 |
0 |
0.016 |
| 12 |
31 |
|
J |
61 |
16 |
32873 |
◊ |
D |
x,y,z |
1_555 |
50 |
15 |
8006 |
492.2 |
-8.6 |
0.509 |
18 |
0 |
0 |
1.000 |
32 |
|
V |
56 |
16 |
32823 |
◊ |
P |
x,y,z |
1_555 |
47 |
15 |
7778 |
446.2 |
-8.3 |
0.515 |
14 |
0 |
0 |
1.000 |
| Average: |
469.2 |
-8.4 |
0.512 |
16 |
0 |
0 |
1.000 |
| 13 |
33 |
|
U |
64 |
13 |
32304 |
◊ |
O |
x,y,z |
1_555 |
51 |
18 |
8692 |
490.2 |
-6.2 |
0.678 |
6 |
0 |
0 |
0.134 |
34 |
|
I |
50 |
11 |
32381 |
◊ |
C |
x,y,z |
1_555 |
42 |
18 |
8217 |
405.6 |
-7.4 |
0.569 |
7 |
0 |
0 |
0.134 |
| Average: |
447.9 |
-6.8 |
0.623 |
7 |
0 |
0 |
0.134 |
| 14 |
35 |
|
K |
53 |
14 |
10573 |
◊ |
D |
x,y,z |
1_555 |
49 |
16 |
8006 |
484.1 |
-1.2 |
0.629 |
9 |
0 |
0 |
0.000 |
36 |
|
W |
47 |
11 |
11973 |
◊ |
P |
x,y,z |
1_555 |
54 |
15 |
7778 |
463.7 |
-0.2 |
0.817 |
11 |
0 |
0 |
0.000 |
37 |
|
L |
50 |
11 |
12116 |
◊ |
H |
x,y,z |
1_555 |
51 |
15 |
7745 |
462.1 |
-0.3 |
0.819 |
8 |
3 |
0 |
0.000 |
| Average: |
469.9 |
-0.6 |
0.755 |
9 |
1 |
0 |
0.000 |
| 15 |
38 |
|
X |
48 |
10 |
9143 |
◊ |
T |
x,y,z |
1_555 |
51 |
15 |
7731 |
474.5 |
-0.8 |
0.841 |
6 |
1 |
0 |
0.000 |
| 16 |
39 |
|
I |
62 |
14 |
32381 |
◊ |
H |
x,y,z |
1_555 |
42 |
14 |
7745 |
462.9 |
-9.9 |
0.489 |
14 |
0 |
0 |
1.000 |
40 |
|
U |
59 |
15 |
32304 |
◊ |
T |
x,y,z |
1_555 |
40 |
13 |
7731 |
435.1 |
-11.3 |
0.431 |
9 |
0 |
0 |
1.000 |
| Average: |
449.0 |
-10.6 |
0.460 |
12 |
0 |
0 |
1.000 |
| 17 |
41 |
|
K |
57 |
19 |
10573 |
◊ |
B |
x,y,z |
1_555 |
51 |
13 |
7411 |
461.7 |
-3.6 |
0.416 |
4 |
3 |
0 |
0.000 |
42 |
|
L |
53 |
19 |
12116 |
◊ |
F |
x,y,z |
1_555 |
44 |
13 |
7126 |
416.0 |
-3.2 |
0.614 |
2 |
2 |
0 |
0.000 |
43 |
|
W |
53 |
19 |
11973 |
◊ |
N |
x,y,z |
1_555 |
46 |
13 |
7069 |
391.2 |
-2.2 |
0.687 |
3 |
3 |
0 |
0.000 |
| Average: |
423.0 |
-3.0 |
0.572 |
3 |
3 |
0 |
0.000 |
| 18 |
44 |
|
U |
62 |
13 |
32304 |
◊ |
S |
x,y,z |
1_555 |
54 |
15 |
8691 |
455.5 |
-5.2 |
0.713 |
7 |
0 |
0 |
0.114 |
45 |
|
I |
54 |
12 |
32381 |
◊ |
G |
x,y,z |
1_555 |
50 |
12 |
8447 |
423.7 |
-5.0 |
0.702 |
9 |
0 |
0 |
0.114 |
| Average: |
439.6 |
-5.1 |
0.707 |
8 |
0 |
0 |
0.114 |
| 19 |
46 |
|
V |
53 |
12 |
32823 |
◊ |
O |
x,y,z |
1_555 |
52 |
15 |
8692 |
446.1 |
-4.0 |
0.720 |
7 |
0 |
0 |
0.074 |
47 |
|
J |
37 |
10 |
32873 |
◊ |
C |
x,y,z |
1_555 |
43 |
12 |
8217 |
326.1 |
-5.0 |
0.587 |
6 |
0 |
0 |
0.074 |
| Average: |
386.1 |
-4.5 |
0.654 |
7 |
0 |
0 |
0.074 |
| 20 |
48 |
|
O |
48 |
14 |
8692 |
◊ |
R |
x,y,z |
1_555 |
51 |
12 |
6589 |
423.2 |
-3.0 |
0.551 |
6 |
0 |
0 |
0.061 |
49 |
|
S |
49 |
14 |
8691 |
◊ |
N |
x,y,z |
1_555 |
51 |
12 |
7069 |
412.4 |
-3.2 |
0.536 |
6 |
0 |
0 |
0.061 |
50 |
|
C |
47 |
14 |
8217 |
◊ |
F |
x,y,z |
1_555 |
52 |
13 |
7126 |
404.6 |
-4.0 |
0.493 |
6 |
0 |
0 |
0.061 |
51 |
|
G |
48 |
15 |
8447 |
◊ |
B |
x,y,z |
1_555 |
54 |
13 |
7411 |
399.4 |
-3.8 |
0.490 |
6 |
0 |
0 |
0.061 |
| Average: |
409.9 |
-3.5 |
0.518 |
6 |
0 |
0 |
0.061 |
| 21 |
52 |
|
U |
44 |
7 |
32304 |
◊ |
N |
x,y,z |
1_555 |
40 |
13 |
7069 |
370.6 |
-6.4 |
0.536 |
7 |
0 |
0 |
0.055 |
53 |
|
I |
43 |
7 |
32381 |
◊ |
B |
x,y,z |
1_555 |
40 |
13 |
7411 |
367.5 |
-6.8 |
0.498 |
6 |
0 |
0 |
0.055 |
| Average: |
369.1 |
-6.6 |
0.517 |
7 |
0 |
0 |
0.055 |
| 22 |
54 |
|
V |
44 |
7 |
32823 |
◊ |
R |
x,y,z |
1_555 |
42 |
14 |
6589 |
369.2 |
-5.3 |
0.599 |
7 |
0 |
0 |
0.049 |
55 |
|
J |
44 |
7 |
32873 |
◊ |
F |
x,y,z |
1_555 |
39 |
12 |
7126 |
342.6 |
-4.3 |
0.650 |
7 |
0 |
0 |
0.049 |
| Average: |
355.9 |
-4.8 |
0.625 |
7 |
0 |
0 |
0.049 |
| 23 |
56 |
|
K |
27 |
6 |
10573 |
◊ |
C |
x,y,z |
1_555 |
43 |
13 |
8217 |
332.5 |
1.4 |
0.826 |
7 |
8 |
0 |
0.000 |
57 |
|
W |
25 |
4 |
11973 |
◊ |
O |
x,y,z |
1_555 |
34 |
9 |
8692 |
280.9 |
1.8 |
0.862 |
5 |
9 |
0 |
0.000 |
58 |
|
L |
21 |
3 |
12116 |
◊ |
G |
x,y,z |
1_555 |
35 |
10 |
8447 |
276.9 |
1.6 |
0.849 |
6 |
10 |
0 |
0.000 |
| Average: |
296.7 |
1.6 |
0.846 |
6 |
9 |
0 |
0.000 |
| 24 |
59 |
|
J |
50 |
12 |
32873 |
◊ |
B |
x,y,z |
1_555 |
33 |
12 |
7411 |
323.8 |
-3.4 |
0.698 |
4 |
0 |
0 |
0.070 |
60 |
|
V |
40 |
11 |
32823 |
◊ |
N |
x,y,z |
1_555 |
25 |
11 |
7069 |
264.4 |
-2.5 |
0.707 |
5 |
0 |
0 |
0.070 |
| Average: |
294.1 |
-3.0 |
0.702 |
5 |
0 |
0 |
0.070 |
| 25 |
61 |
|
U |
33 |
5 |
32304 |
◊ |
P |
x,y,z |
1_555 |
36 |
11 |
7778 |
313.2 |
-3.9 |
0.631 |
4 |
0 |
0 |
0.028 |
62 |
|
I |
36 |
6 |
32381 |
◊ |
D |
x,y,z |
1_555 |
36 |
12 |
8006 |
309.5 |
-3.8 |
0.642 |
3 |
0 |
0 |
0.028 |
| Average: |
311.4 |
-3.8 |
0.637 |
4 |
0 |
0 |
0.028 |
| 26 |
63 |
|
I |
46 |
11 |
32381 |
◊ |
F |
x,y,z |
1_555 |
29 |
11 |
7126 |
301.2 |
-4.0 |
0.678 |
6 |
0 |
0 |
0.085 |
64 |
|
U |
40 |
10 |
32304 |
◊ |
R |
x,y,z |
1_555 |
25 |
10 |
6589 |
241.3 |
-2.0 |
0.734 |
4 |
0 |
0 |
0.085 |
| Average: |
271.2 |
-3.0 |
0.706 |
5 |
0 |
0 |
0.085 |
| 27 |
65 |
|
J |
32 |
5 |
32873 |
◊ |
H |
x,y,z |
1_555 |
36 |
12 |
7745 |
299.3 |
-3.5 |
0.655 |
5 |
0 |
0 |
0.017 |
66 |
|
V |
32 |
6 |
32823 |
◊ |
T |
x,y,z |
1_555 |
36 |
12 |
7731 |
290.1 |
-3.2 |
0.654 |
4 |
0 |
0 |
0.017 |
| Average: |
294.7 |
-3.3 |
0.655 |
5 |
0 |
0 |
0.017 |
| 28 |
67 |
|
K |
35 |
11 |
10573 |
◊ |
A |
x,y,z |
1_555 |
30 |
6 |
8429 |
296.1 |
0.7 |
0.750 |
7 |
2 |
0 |
0.000 |
68 |
|
L |
31 |
11 |
12116 |
◊ |
E |
x,y,z |
1_555 |
27 |
6 |
8352 |
256.2 |
1.4 |
0.820 |
3 |
1 |
0 |
0.000 |
69 |
|
W |
33 |
11 |
11973 |
◊ |
M |
x,y,z |
1_555 |
26 |
6 |
8761 |
245.0 |
0.2 |
0.774 |
5 |
3 |
0 |
0.000 |
| Average: |
265.7 |
0.8 |
0.781 |
5 |
2 |
0 |
0.000 |
| 29 |
70 |
|
X |
31 |
10 |
9143 |
◊ |
Q |
x,y,z |
1_555 |
23 |
5 |
8283 |
279.6 |
0.1 |
0.775 |
6 |
1 |
0 |
0.000 |
| 30 |
71 |
|
X |
20 |
3 |
9143 |
◊ |
S |
x,y,z |
1_555 |
35 |
9 |
8691 |
275.8 |
2.0 |
0.864 |
7 |
11 |
0 |
0.000 |
| 31 |
72 |
|
T |
30 |
10 |
7731 |
◊ |
N |
x,y,z |
1_555 |
27 |
7 |
7069 |
241.2 |
-2.0 |
0.570 |
5 |
1 |
0 |
0.025 |
73 |
|
P |
30 |
10 |
7778 |
◊ |
R |
x,y,z |
1_555 |
28 |
7 |
6589 |
234.2 |
-1.9 |
0.586 |
3 |
1 |
0 |
0.025 |
74 |
|
D |
29 |
9 |
8006 |
◊ |
F |
x,y,z |
1_555 |
25 |
6 |
7126 |
222.1 |
-1.5 |
0.620 |
5 |
2 |
0 |
0.025 |
75 |
|
H |
29 |
10 |
7745 |
◊ |
B |
x,y,z |
1_555 |
26 |
7 |
7411 |
215.3 |
-2.4 |
0.516 |
4 |
0 |
0 |
0.025 |
| Average: |
228.2 |
-2.0 |
0.573 |
4 |
1 |
0 |
0.025 |
| 32 |
76 |
|
K |
26 |
9 |
10573 |
◊ |
V |
x,y,z-1 |
1_554 |
23 |
4 |
32823 |
205.5 |
-5.9 |
0.350 |
4 |
0 |
0 |
0.000 |
| 33 |
77 |
|
X |
20 |
9 |
9143 |
◊ |
R |
x,y,z |
1_555 |
27 |
9 |
6589 |
194.2 |
-0.7 |
0.691 |
1 |
0 |
0 |
0.000 |
| 34 |
78 |
|
U |
18 |
4 |
32304 |
◊ |
P |
-x,y-1/2,-z |
2_545 |
17 |
6 |
7778 |
141.9 |
-1.6 |
0.632 |
0 |
0 |
0 |
0.000 |
| 35 |
79 |
|
G |
17 |
4 |
8447 |
◊ |
C |
x,y,z |
1_555 |
18 |
4 |
8217 |
125.4 |
0.3 |
0.764 |
0 |
0 |
0 |
0.000 |
80 |
|
S |
15 |
4 |
8691 |
◊ |
O |
x,y,z |
1_555 |
17 |
4 |
8692 |
122.3 |
0.2 |
0.721 |
0 |
0 |
0 |
0.000 |
| Average: |
123.8 |
0.3 |
0.743 |
0 |
0 |
0 |
0.000 |
| 36 |
81 |
|
U |
16 |
4 |
32304 |
◊ |
W |
-x,y-1/2,-z |
2_545 |
11 |
5 |
11973 |
120.3 |
-5.3 |
0.279 |
2 |
0 |
0 |
0.000 |
| 37 |
82 |
|
H |
15 |
6 |
7745 |
◊ |
J |
-x-1,y-1/2,-z-1 |
2_444 |
15 |
4 |
32873 |
120.1 |
-3.6 |
0.442 |
0 |
0 |
0 |
0.000 |
| 38 |
83 |
|
L |
15 |
6 |
12116 |
◊ |
J |
-x-1,y-1/2,-z-1 |
2_444 |
13 |
4 |
32873 |
99.9 |
-5.5 |
0.236 |
2 |
0 |
0 |
0.000 |
| 39 |
84 |
|
[ACE]X:1 |
3 |
1 |
172 |
cf |
X |
x,y,z |
1_555 |
16 |
8 |
9143 |
98.7 |
-1.5 |
0.715 |
1 |
0 |
0 |
0.100 |
| 40 |
85 |
|
[ACE]L:1 |
3 |
1 |
171 |
cf |
L |
x,y,z |
1_555 |
16 |
9 |
12116 |
94.2 |
-1.8 |
0.660 |
1 |
0 |
0 |
0.100 |
86 |
|
[ACE]K:1 |
3 |
1 |
171 |
cf |
K |
x,y,z |
1_555 |
16 |
8 |
10573 |
90.5 |
-1.6 |
0.626 |
1 |
0 |
0 |
0.100 |
| Average: |
92.3 |
-1.7 |
0.643 |
1 |
0 |
0 |
0.100 |
| 41 |
87 |
|
[ACE]W:1 |
3 |
1 |
172 |
cf |
W |
x,y,z |
1_555 |
13 |
6 |
11973 |
93.5 |
-1.7 |
0.723 |
1 |
0 |
0 |
0.100 |
| 42 |
88 |
|
V |
13 |
3 |
32823 |
◊ |
U |
x-1,y,z |
1_455 |
14 |
1 |
32304 |
92.0 |
-0.6 |
0.626 |
0 |
0 |
0 |
0.000 |
| 43 |
89 |
|
U |
12 |
3 |
32304 |
◊ |
O |
-x,y-1/2,-z |
2_545 |
9 |
3 |
8692 |
88.4 |
-1.5 |
0.473 |
3 |
0 |
0 |
0.000 |
| 44 |
90 |
|
K |
9 |
3 |
10573 |
◊ |
U |
x-1,y,z-1 |
1_454 |
9 |
2 |
32304 |
83.0 |
-2.5 |
0.361 |
3 |
0 |
0 |
0.000 |
| 45 |
91 |
|
U |
11 |
3 |
32304 |
◊ |
L |
x,y,z |
1_555 |
11 |
3 |
12116 |
82.0 |
-2.6 |
0.421 |
1 |
0 |
0 |
0.000 |
| 46 |
92 |
|
K |
13 |
5 |
10573 |
◊ |
V |
x-1,y,z-1 |
1_454 |
8 |
2 |
32823 |
55.6 |
-2.5 |
0.374 |
0 |
0 |
0 |
0.000 |
| 47 |
93 |
|
K |
8 |
4 |
10573 |
◊ |
U |
x,y,z-1 |
1_554 |
6 |
4 |
32304 |
55.6 |
0.1 |
0.658 |
1 |
0 |
0 |
0.000 |
| 48 |
94 |
|
I |
11 |
2 |
32381 |
◊ |
W |
x,y,z-1 |
1_554 |
4 |
3 |
11973 |
51.0 |
-1.1 |
0.286 |
0 |
0 |
0 |
0.000 |
| 49 |
95 |
|
P |
4 |
2 |
7778 |
◊ |
S |
x,y,z |
1_555 |
7 |
3 |
8691 |
44.5 |
-0.0 |
0.671 |
0 |
0 |
0 |
0.000 |
96 |
|
D |
4 |
2 |
8006 |
◊ |
G |
x,y,z |
1_555 |
7 |
3 |
8447 |
43.2 |
-0.2 |
0.633 |
0 |
0 |
0 |
0.000 |
97 |
|
H |
3 |
2 |
7745 |
◊ |
C |
x,y,z |
1_555 |
7 |
3 |
8217 |
42.3 |
0.2 |
0.731 |
0 |
0 |
0 |
0.000 |
98 |
|
T |
4 |
2 |
7731 |
◊ |
O |
x,y,z |
1_555 |
7 |
3 |
8692 |
39.8 |
0.0 |
0.697 |
0 |
0 |
0 |
0.000 |
| Average: |
42.4 |
-0.0 |
0.683 |
0 |
0 |
0 |
0.000 |
| 50 |
99 |
|
L |
8 |
2 |
12116 |
◊ |
V |
x-1,y,z |
1_455 |
9 |
2 |
32823 |
37.0 |
-1.5 |
0.451 |
0 |
0 |
0 |
0.000 |
| 51 |
100 |
|
I |
6 |
2 |
32381 |
◊ |
J |
-x-1,y-1/2,-z-1 |
2_444 |
5 |
2 |
32873 |
29.4 |
-2.2 |
0.373 |
0 |
0 |
0 |
0.000 |
| 52 |
101 |
|
I |
7 |
2 |
32381 |
◊ |
V |
-x-1,y-1/2,-z-1 |
2_444 |
5 |
2 |
32823 |
27.3 |
-1.7 |
0.443 |
0 |
0 |
0 |
0.000 |
| 53 |
102 |
|
A |
4 |
1 |
8429 |
◊ |
U |
-x-1,y-1/2,-z-1 |
2_444 |
4 |
2 |
32304 |
25.4 |
-1.7 |
0.347 |
0 |
0 |
0 |
0.000 |
| 54 |
103 |
|
V |
4 |
2 |
32823 |
x |
V |
x-1,y,z |
1_455 |
5 |
2 |
32823 |
25.0 |
-2.3 |
0.323 |
0 |
0 |
0 |
0.000 |
| 55 |
104 |
|
G |
5 |
2 |
8447 |
◊ |
J |
-x-1,y-1/2,-z-1 |
2_444 |
4 |
2 |
32873 |
24.4 |
-0.8 |
0.515 |
0 |
0 |
0 |
0.000 |
| 56 |
105 |
|
I |
4 |
2 |
32381 |
◊ |
J |
x-1,y,z |
1_455 |
4 |
2 |
32873 |
24.3 |
-2.2 |
0.333 |
0 |
0 |
0 |
0.000 |
| 57 |
106 |
|
V |
3 |
2 |
32823 |
◊ |
O |
-x,y-1/2,-z |
2_545 |
2 |
2 |
8692 |
23.6 |
-0.9 |
0.465 |
0 |
0 |
0 |
0.000 |
| 58 |
107 |
|
J |
2 |
1 |
32873 |
◊ |
U |
x-1,y,z |
1_455 |
3 |
1 |
32304 |
15.1 |
-1.0 |
0.341 |
0 |
0 |
0 |
0.000 |
| 59 |
108 |
|
J |
3 |
1 |
32873 |
◊ |
U |
-x,y-1/2,-z-1 |
2_544 |
4 |
2 |
32304 |
13.9 |
-1.1 |
0.419 |
0 |
0 |
0 |
0.000 |
| 60 |
109 |
|
I |
2 |
1 |
32381 |
◊ |
U |
-x,y-1/2,-z-1 |
2_544 |
1 |
1 |
32304 |
13.7 |
-1.2 |
0.229 |
0 |
0 |
0 |
0.000 |
| 61 |
110 |
|
L |
3 |
2 |
12116 |
◊ |
U |
x-1,y,z |
1_455 |
6 |
3 |
32304 |
12.3 |
-0.4 |
0.633 |
0 |
0 |
0 |
0.000 |
| 62 |
111 |
|
J |
3 |
2 |
32873 |
◊ |
I |
x-1,y,z |
1_455 |
4 |
2 |
32381 |
12.0 |
-1.0 |
0.423 |
0 |
0 |
0 |
0.000 |
| 63 |
112 |
|
O |
1 |
1 |
8692 |
◊ |
U |
x-1,y,z |
1_455 |
4 |
1 |
32304 |
11.3 |
-0.2 |
0.368 |
0 |
0 |
0 |
0.000 |
| 64 |
113 |
|
J |
1 |
1 |
32873 |
◊ |
V |
-x,y-1/2,-z-1 |
2_544 |
2 |
1 |
32823 |
10.9 |
-1.1 |
0.232 |
0 |
0 |
0 |
0.000 |
| 65 |
114 |
|
I |
3 |
1 |
32381 |
◊ |
V |
x-1,y,z |
1_455 |
1 |
1 |
32823 |
10.6 |
-1.0 |
0.266 |
0 |
0 |
0 |
0.000 |
| 66 |
115 |
|
I |
2 |
2 |
32381 |
◊ |
U |
-x-1,y-1/2,-z-1 |
2_444 |
2 |
1 |
32304 |
8.9 |
-1.0 |
0.310 |
0 |
0 |
0 |
0.000 |
| 67 |
116 |
|
J |
1 |
1 |
32873 |
◊ |
I |
-x-1,y-1/2,-z-1 |
2_444 |
1 |
1 |
32381 |
8.0 |
-0.9 |
0.178 |
0 |
0 |
0 |
0.000 |
| 68 |
117 |
|
H |
1 |
1 |
7745 |
◊ |
D |
x,y,z |
1_555 |
2 |
1 |
8006 |
7.6 |
0.1 |
0.530 |
0 |
0 |
0 |
0.000 |
| 69 |
118 |
|
V |
2 |
1 |
32823 |
◊ |
P |
-x,y-1/2,-z |
2_545 |
1 |
1 |
7778 |
7.5 |
0.0 |
0.559 |
0 |
0 |
0 |
0.000 |
| 70 |
119 |
|
I |
1 |
1 |
32381 |
◊ |
V |
-x,y-1/2,-z-1 |
2_544 |
2 |
1 |
32823 |
4.8 |
-0.4 |
0.246 |
0 |
0 |
0 |
0.000 |
| 71 |
120 |
|
C |
1 |
1 |
8217 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
8429 |
4.1 |
0.1 |
0.776 |
0 |
0 |
0 |
0.000 |
121 |
|
G |
1 |
1 |
8447 |
◊ |
E |
x,y,z |
1_555 |
1 |
1 |
8352 |
2.4 |
0.1 |
0.751 |
0 |
0 |
0 |
0.000 |
| Average: |
3.2 |
0.1 |
0.763 |
0 |
0 |
0 |
0.000 |
| 72 |
122 |
|
C |
1 |
1 |
8217 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
7411 |
3.4 |
0.2 |
0.792 |
0 |
0 |
0 |
0.000 |
123 |
|
G |
1 |
1 |
8447 |
◊ |
F |
x,y,z |
1_555 |
1 |
1 |
7126 |
3.1 |
0.1 |
0.794 |
0 |
0 |
0 |
0.000 |
| Average: |
3.2 |
0.2 |
0.793 |
0 |
0 |
0 |
0.000 |
| 73 |
124 |
|
H |
2 |
2 |
7745 |
◊ |
I |
-x-1,y-1/2,-z-1 |
2_444 |
2 |
2 |
32381 |
3.0 |
-0.0 |
0.533 |
0 |
0 |
0 |
0.000 |
| 74 |
125 |
|
V |
1 |
1 |
32823 |
◊ |
J |
x,y,z |
1_555 |
1 |
1 |
32873 |
2.4 |
-0.3 |
0.207 |
0 |
0 |
0 |
0.000 |
| 75 |
126 |
|
I |
1 |
1 |
32381 |
x |
I |
x-1,y,z |
1_455 |
1 |
1 |
32381 |
2.4 |
-0.3 |
0.213 |
0 |
0 |
0 |
0.000 |
| 76 |
127 |
|
J |
1 |
1 |
32873 |
◊ |
V |
-x-1,y-1/2,-z-1 |
2_444 |
1 |
1 |
32823 |
1.9 |
-0.2 |
0.239 |
0 |
0 |
0 |
0.000 |
| 77 |
128 |
|
V |
1 |
1 |
32823 |
◊ |
L |
x,y,z |
1_555 |
1 |
1 |
12116 |
1.8 |
-0.1 |
0.434 |
0 |
0 |
0 |
0.000 |
| 78 |
129 |
|
U |
1 |
1 |
32304 |
x |
U |
x-1,y,z |
1_455 |
1 |
1 |
32304 |
1.1 |
-0.0 |
0.380 |
0 |
0 |
0 |
0.000 |
|