| ## |
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 |
93 |
23 |
7430 |
◊ |
G |
x,y,z |
1_555 |
85 |
23 |
7365 |
842.8 |
-11.9 |
0.080 |
5 |
1 |
0 |
0.000 |
2 |
|
R |
94 |
24 |
7254 |
◊ |
Q |
x,y,z |
1_555 |
90 |
24 |
7386 |
841.4 |
-11.4 |
0.098 |
7 |
5 |
0 |
0.000 |
3 |
|
Q |
96 |
24 |
7386 |
◊ |
P |
x,y,z |
1_555 |
85 |
23 |
7295 |
834.7 |
-12.6 |
0.068 |
9 |
0 |
0 |
0.000 |
4 |
|
E |
95 |
25 |
7456 |
◊ |
D |
x,y,z |
1_555 |
81 |
22 |
7425 |
834.0 |
-12.5 |
0.064 |
7 |
3 |
0 |
0.000 |
5 |
|
R |
89 |
24 |
7254 |
◊ |
P |
x,y,z |
1_555 |
93 |
24 |
7295 |
823.8 |
-11.7 |
0.094 |
7 |
2 |
0 |
0.000 |
6 |
|
F |
90 |
26 |
7258 |
◊ |
D |
x,y,z |
1_555 |
90 |
24 |
7425 |
816.9 |
-12.5 |
0.078 |
8 |
5 |
0 |
0.000 |
7 |
|
U |
92 |
23 |
7352 |
◊ |
T |
x,y,z |
1_555 |
84 |
22 |
7456 |
814.1 |
-11.2 |
0.098 |
10 |
3 |
0 |
0.000 |
8 |
|
B |
91 |
23 |
7445 |
◊ |
A |
x,y,z |
1_555 |
84 |
24 |
7365 |
812.9 |
-11.4 |
0.087 |
7 |
2 |
0 |
0.000 |
9 |
|
N |
89 |
22 |
7296 |
◊ |
M |
x,y,z |
1_555 |
84 |
24 |
7396 |
809.9 |
-11.6 |
0.085 |
8 |
5 |
0 |
0.000 |
10 |
|
I |
87 |
23 |
7273 |
◊ |
G |
x,y,z |
1_555 |
92 |
24 |
7365 |
808.2 |
-11.5 |
0.090 |
8 |
3 |
0 |
0.000 |
11 |
|
I |
94 |
25 |
7273 |
◊ |
H |
x,y,z |
1_555 |
83 |
24 |
7430 |
807.2 |
-12.2 |
0.073 |
9 |
4 |
0 |
0.000 |
12 |
|
T |
89 |
23 |
7456 |
◊ |
S |
x,y,z |
1_555 |
81 |
23 |
7256 |
806.0 |
-11.6 |
0.075 |
9 |
0 |
0 |
0.000 |
13 |
|
O |
83 |
23 |
7518 |
◊ |
M |
x,y,z |
1_555 |
92 |
23 |
7396 |
801.6 |
-10.4 |
0.102 |
11 |
4 |
0 |
0.000 |
14 |
|
C |
92 |
23 |
7349 |
◊ |
B |
x,y,z |
1_555 |
81 |
22 |
7445 |
799.5 |
-11.5 |
0.089 |
8 |
3 |
0 |
0.000 |
15 |
|
X |
79 |
21 |
7363 |
◊ |
V |
x,y,z |
1_555 |
91 |
24 |
7291 |
798.9 |
-11.2 |
0.086 |
8 |
1 |
0 |
0.000 |
16 |
|
L |
84 |
23 |
7318 |
◊ |
J |
x,y,z |
1_555 |
94 |
24 |
7335 |
798.9 |
-12.1 |
0.077 |
10 |
4 |
0 |
0.000 |
17 |
|
C |
83 |
23 |
7349 |
◊ |
A |
x,y,z |
1_555 |
91 |
24 |
7365 |
794.5 |
-12.8 |
0.061 |
8 |
0 |
0 |
0.000 |
18 |
|
W |
92 |
24 |
7296 |
◊ |
V |
x,y,z |
1_555 |
81 |
24 |
7291 |
789.9 |
-11.0 |
0.108 |
7 |
3 |
0 |
0.000 |
19 |
|
K |
91 |
23 |
7364 |
◊ |
J |
x,y,z |
1_555 |
80 |
23 |
7335 |
787.7 |
-13.6 |
0.046 |
8 |
0 |
0 |
0.000 |
20 |
|
F |
91 |
22 |
7258 |
◊ |
E |
x,y,z |
1_555 |
79 |
23 |
7456 |
781.6 |
-12.6 |
0.056 |
6 |
0 |
0 |
0.000 |
21 |
|
L |
93 |
25 |
7318 |
◊ |
K |
x,y,z |
1_555 |
77 |
22 |
7364 |
781.0 |
-12.9 |
0.052 |
7 |
0 |
0 |
0.000 |
22 |
|
O |
89 |
24 |
7518 |
◊ |
N |
x,y,z |
1_555 |
82 |
23 |
7296 |
775.3 |
-13.0 |
0.048 |
8 |
0 |
0 |
0.000 |
23 |
|
X |
90 |
24 |
7363 |
◊ |
W |
x,y,z |
1_555 |
76 |
21 |
7296 |
774.3 |
-12.8 |
0.052 |
6 |
0 |
0 |
0.000 |
24 |
|
U |
73 |
21 |
7352 |
◊ |
S |
x,y,z |
1_555 |
88 |
23 |
7256 |
750.7 |
-12.5 |
0.052 |
8 |
0 |
0 |
0.000 |
| Average: |
803.6 |
-12.0 |
0.076 |
8 |
2 |
0 |
0.000 |
| 2 |
25 |
|
M |
69 |
15 |
7396 |
◊ |
A |
x,y,z |
1_555 |
72 |
17 |
7365 |
531.7 |
-0.7 |
0.586 |
10 |
0 |
0 |
0.000 |
26 |
|
R |
69 |
15 |
7254 |
◊ |
B |
x,y,z |
1_555 |
67 |
17 |
7445 |
521.7 |
-1.2 |
0.572 |
9 |
0 |
0 |
0.000 |
27 |
|
X |
70 |
17 |
7363 |
◊ |
D |
x,y,z |
1_555 |
69 |
16 |
7425 |
512.7 |
-0.5 |
0.622 |
10 |
0 |
0 |
0.000 |
28 |
|
U |
68 |
15 |
7352 |
◊ |
N |
x,y,z |
1_555 |
67 |
16 |
7296 |
509.3 |
-1.3 |
0.574 |
9 |
0 |
0 |
0.000 |
29 |
|
S |
65 |
15 |
7256 |
◊ |
C |
x,y,z |
1_555 |
67 |
16 |
7349 |
500.2 |
-0.6 |
0.609 |
11 |
0 |
0 |
0.000 |
30 |
|
W |
66 |
15 |
7296 |
◊ |
H |
x,y,z |
1_555 |
68 |
16 |
7430 |
498.8 |
-0.9 |
0.591 |
11 |
0 |
0 |
0.000 |
31 |
|
P |
65 |
15 |
7295 |
◊ |
O |
x,y,z |
1_555 |
62 |
15 |
7518 |
496.8 |
-1.8 |
0.504 |
10 |
0 |
0 |
0.000 |
32 |
|
T |
66 |
15 |
7456 |
◊ |
Q |
x,y,z |
1_555 |
63 |
15 |
7386 |
494.9 |
-1.6 |
0.531 |
9 |
0 |
0 |
0.000 |
33 |
|
L |
66 |
16 |
7318 |
◊ |
F |
x,y,z |
1_555 |
65 |
16 |
7258 |
477.7 |
-1.3 |
0.566 |
10 |
0 |
0 |
0.000 |
34 |
|
J |
64 |
16 |
7335 |
◊ |
I |
x,y,z |
1_555 |
64 |
15 |
7273 |
477.5 |
-1.6 |
0.542 |
9 |
0 |
0 |
0.000 |
35 |
|
G |
61 |
16 |
7365 |
◊ |
E |
x,y,z |
1_555 |
63 |
15 |
7456 |
476.5 |
-1.6 |
0.522 |
10 |
0 |
0 |
0.000 |
36 |
|
V |
63 |
15 |
7291 |
◊ |
K |
x,y,z |
1_555 |
63 |
15 |
7364 |
468.3 |
-1.5 |
0.557 |
8 |
0 |
0 |
0.000 |
| Average: |
497.2 |
-1.2 |
0.565 |
10 |
0 |
0 |
0.000 |
| 3 |
37 |
|
E |
34 |
9 |
7456 |
◊ |
U |
x,y,z-1 |
1_554 |
39 |
12 |
7352 |
342.4 |
0.2 |
0.627 |
5 |
4 |
0 |
0.000 |
| 4 |
38 |
|
W |
40 |
14 |
7296 |
◊ |
S |
-x,y-1/2,-z+1 |
2_546 |
35 |
11 |
7256 |
340.9 |
0.0 |
0.601 |
9 |
4 |
0 |
0.000 |
39 |
|
N |
38 |
14 |
7296 |
◊ |
J |
-x,y-1/2,-z+1 |
2_546 |
38 |
12 |
7335 |
339.6 |
-0.3 |
0.573 |
10 |
3 |
0 |
0.000 |
| Average: |
340.2 |
-0.2 |
0.587 |
10 |
4 |
0 |
0.000 |
| 5 |
40 |
|
[COA]X:1944 |
29 |
1 |
934 |
◊ |
X |
x,y,z |
1_555 |
44 |
16 |
7363 |
329.7 |
2.3 |
0.630 |
8 |
0 |
0 |
0.000 |
41 |
|
[COA]Q:1515 |
27 |
1 |
944 |
◊ |
P |
x,y,z |
1_555 |
45 |
16 |
7295 |
328.7 |
2.0 |
0.581 |
6 |
0 |
0 |
0.000 |
42 |
|
[COA]J:780 |
28 |
1 |
943 |
◊ |
L |
x,y,z |
1_555 |
42 |
16 |
7318 |
328.6 |
1.3 |
0.539 |
6 |
0 |
0 |
0.000 |
43 |
|
[COA]P:1424 |
29 |
1 |
943 |
◊ |
R |
x,y,z |
1_555 |
47 |
16 |
7254 |
328.3 |
2.2 |
0.625 |
5 |
0 |
0 |
0.000 |
44 |
|
[COA]E:387 |
28 |
1 |
941 |
◊ |
D |
x,y,z |
1_555 |
44 |
16 |
7425 |
328.1 |
1.8 |
0.576 |
6 |
0 |
0 |
0.000 |
45 |
|
[COA]S:1696 |
30 |
1 |
940 |
◊ |
U |
x,y,z |
1_555 |
43 |
16 |
7352 |
328.0 |
1.3 |
0.542 |
4 |
0 |
0 |
0.000 |
46 |
|
[COA]G:570 |
28 |
1 |
940 |
◊ |
I |
x,y,z |
1_555 |
42 |
16 |
7273 |
327.6 |
1.8 |
0.585 |
5 |
0 |
0 |
0.000 |
47 |
|
[COA]R:1606 |
27 |
1 |
940 |
◊ |
Q |
x,y,z |
1_555 |
43 |
16 |
7386 |
327.2 |
1.6 |
0.567 |
6 |
0 |
0 |
0.000 |
48 |
|
[COA]A:129 |
29 |
1 |
936 |
◊ |
A |
x,y,z |
1_555 |
44 |
16 |
7365 |
326.4 |
1.3 |
0.560 |
5 |
0 |
0 |
0.000 |
49 |
|
[COA]U:1854 |
27 |
1 |
938 |
◊ |
T |
x,y,z |
1_555 |
44 |
16 |
7456 |
326.3 |
1.9 |
0.582 |
6 |
0 |
0 |
0.000 |
50 |
|
[COA]I:699 |
29 |
1 |
938 |
◊ |
H |
x,y,z |
1_555 |
44 |
16 |
7430 |
326.3 |
1.1 |
0.531 |
5 |
0 |
0 |
0.000 |
51 |
|
[COA]F:477 |
28 |
1 |
938 |
◊ |
E |
x,y,z |
1_555 |
44 |
16 |
7456 |
326.0 |
1.5 |
0.546 |
5 |
0 |
0 |
0.000 |
52 |
|
[COA]W:2105 |
30 |
1 |
941 |
◊ |
W |
x,y,z |
1_555 |
44 |
16 |
7296 |
325.6 |
2.3 |
0.569 |
4 |
0 |
0 |
0.000 |
53 |
|
[COA]L:1008 |
28 |
1 |
925 |
◊ |
K |
x,y,z |
1_555 |
42 |
16 |
7364 |
324.9 |
2.5 |
0.648 |
9 |
0 |
0 |
0.000 |
54 |
|
[COA]N:1221 |
28 |
1 |
941 |
◊ |
M |
x,y,z |
1_555 |
44 |
16 |
7396 |
324.2 |
2.2 |
0.574 |
6 |
0 |
0 |
0.000 |
55 |
|
[COA]O:1127 |
27 |
1 |
936 |
◊ |
O |
x,y,z |
1_555 |
42 |
16 |
7518 |
323.8 |
1.8 |
0.562 |
5 |
0 |
0 |
0.000 |
56 |
|
[COA]H:630 |
28 |
1 |
930 |
◊ |
G |
x,y,z |
1_555 |
39 |
16 |
7365 |
322.7 |
1.6 |
0.602 |
6 |
0 |
0 |
0.000 |
57 |
|
[COA]D:283 |
27 |
1 |
927 |
◊ |
F |
x,y,z |
1_555 |
43 |
16 |
7258 |
320.2 |
2.1 |
0.635 |
9 |
0 |
0 |
0.000 |
58 |
|
[COA]K:900 |
28 |
1 |
930 |
◊ |
J |
x,y,z |
1_555 |
43 |
16 |
7335 |
317.9 |
1.4 |
0.556 |
4 |
0 |
0 |
0.000 |
59 |
|
[COA]C:169 |
28 |
1 |
940 |
◊ |
B |
x,y,z |
1_555 |
44 |
16 |
7445 |
316.3 |
1.0 |
0.536 |
4 |
0 |
0 |
0.000 |
60 |
|
[COA]A:127 |
28 |
1 |
933 |
◊ |
C |
x,y,z |
1_555 |
43 |
16 |
7349 |
315.8 |
1.2 |
0.556 |
6 |
0 |
0 |
0.000 |
61 |
|
[COA]T:1791 |
26 |
1 |
929 |
◊ |
S |
x,y,z |
1_555 |
43 |
16 |
7256 |
310.4 |
1.2 |
0.529 |
5 |
0 |
0 |
0.000 |
62 |
|
[COA]W:2019 |
30 |
1 |
931 |
◊ |
V |
x,y,z |
1_555 |
42 |
16 |
7291 |
310.1 |
1.6 |
0.590 |
5 |
0 |
0 |
0.000 |
63 |
|
[COA]N:1333 |
28 |
1 |
929 |
◊ |
N |
x,y,z |
1_555 |
42 |
15 |
7296 |
264.6 |
0.0 |
0.514 |
5 |
0 |
0 |
0.000 |
| Average: |
321.2 |
1.6 |
0.572 |
6 |
0 |
0 |
0.000 |
| 6 |
64 |
|
D |
36 |
17 |
7425 |
◊ |
C |
-x+1,y-1/2,-z+1 |
2_646 |
37 |
17 |
7349 |
306.4 |
1.1 |
0.722 |
3 |
2 |
0 |
0.000 |
65 |
|
M |
37 |
16 |
7396 |
◊ |
L |
-x+1,y-1/2,-z+1 |
2_646 |
30 |
15 |
7318 |
275.7 |
0.6 |
0.661 |
2 |
2 |
0 |
0.000 |
| Average: |
291.0 |
0.8 |
0.691 |
3 |
2 |
0 |
0.000 |
| 7 |
66 |
|
[COA]W:2105 |
26 |
1 |
941 |
f |
X |
x,y,z |
1_555 |
38 |
12 |
7363 |
273.6 |
-3.0 |
0.376 |
5 |
0 |
0 |
0.032 |
67 |
|
[COA]F:477 |
26 |
1 |
938 |
f |
F |
x,y,z |
1_555 |
37 |
12 |
7258 |
270.1 |
-3.3 |
0.383 |
5 |
0 |
0 |
0.032 |
68 |
|
[COA]N:1221 |
26 |
1 |
941 |
f |
N |
x,y,z |
1_555 |
39 |
13 |
7296 |
270.0 |
-3.2 |
0.381 |
5 |
0 |
0 |
0.032 |
69 |
|
[COA]U:1854 |
25 |
1 |
938 |
f |
U |
x,y,z |
1_555 |
39 |
12 |
7352 |
269.1 |
-2.3 |
0.432 |
5 |
0 |
0 |
0.032 |
70 |
|
[COA]A:129 |
25 |
1 |
936 |
f |
B |
x,y,z |
1_555 |
37 |
12 |
7445 |
268.9 |
-3.2 |
0.387 |
5 |
0 |
0 |
0.032 |
71 |
|
[COA]X:1944 |
24 |
1 |
934 |
f |
V |
x,y,z |
1_555 |
37 |
12 |
7291 |
268.7 |
-3.0 |
0.374 |
5 |
0 |
0 |
0.032 |
72 |
|
[COA]D:283 |
24 |
1 |
927 |
f |
D |
x,y,z |
1_555 |
37 |
12 |
7425 |
268.5 |
-3.0 |
0.369 |
5 |
0 |
0 |
0.032 |
73 |
|
[COA]K:900 |
25 |
1 |
930 |
f |
K |
x,y,z |
1_555 |
38 |
12 |
7364 |
268.3 |
-3.2 |
0.395 |
5 |
0 |
0 |
0.032 |
74 |
|
[COA]S:1696 |
24 |
1 |
940 |
f |
S |
x,y,z |
1_555 |
37 |
12 |
7256 |
268.3 |
-3.1 |
0.383 |
6 |
0 |
0 |
0.032 |
75 |
|
[COA]J:780 |
25 |
1 |
943 |
f |
J |
x,y,z |
1_555 |
38 |
11 |
7335 |
268.1 |
-3.2 |
0.385 |
5 |
0 |
0 |
0.032 |
76 |
|
[COA]O:1127 |
26 |
1 |
936 |
f |
M |
x,y,z |
1_555 |
38 |
12 |
7396 |
267.9 |
-3.2 |
0.381 |
5 |
0 |
0 |
0.032 |
77 |
|
[COA]L:1008 |
24 |
1 |
925 |
f |
L |
x,y,z |
1_555 |
37 |
12 |
7318 |
267.0 |
-2.9 |
0.364 |
5 |
0 |
0 |
0.032 |
78 |
|
[COA]P:1424 |
25 |
1 |
943 |
f |
P |
x,y,z |
1_555 |
39 |
12 |
7295 |
267.0 |
-2.4 |
0.428 |
5 |
0 |
0 |
0.032 |
79 |
|
[COA]G:570 |
25 |
1 |
940 |
f |
G |
x,y,z |
1_555 |
38 |
13 |
7365 |
267.0 |
-3.3 |
0.372 |
5 |
0 |
0 |
0.032 |
80 |
|
[COA]T:1791 |
25 |
1 |
929 |
f |
T |
x,y,z |
1_555 |
38 |
12 |
7456 |
266.8 |
-2.1 |
0.444 |
5 |
0 |
0 |
0.032 |
81 |
|
[COA]R:1606 |
24 |
1 |
940 |
f |
R |
x,y,z |
1_555 |
37 |
11 |
7254 |
266.6 |
-3.5 |
0.368 |
5 |
0 |
0 |
0.032 |
82 |
|
[COA]I:699 |
25 |
1 |
938 |
f |
I |
x,y,z |
1_555 |
37 |
12 |
7273 |
266.5 |
-2.9 |
0.370 |
5 |
0 |
0 |
0.032 |
83 |
|
[COA]C:169 |
25 |
1 |
940 |
f |
C |
x,y,z |
1_555 |
37 |
11 |
7349 |
266.3 |
-3.0 |
0.386 |
5 |
0 |
0 |
0.032 |
84 |
|
[COA]Q:1515 |
25 |
1 |
944 |
f |
Q |
x,y,z |
1_555 |
37 |
12 |
7386 |
265.7 |
-2.7 |
0.392 |
5 |
0 |
0 |
0.032 |
85 |
|
[COA]H:630 |
25 |
1 |
930 |
f |
H |
x,y,z |
1_555 |
37 |
11 |
7430 |
265.3 |
-3.1 |
0.394 |
4 |
0 |
0 |
0.032 |
86 |
|
[COA]W:2019 |
25 |
1 |
931 |
f |
W |
x,y,z |
1_555 |
38 |
13 |
7296 |
262.8 |
-3.3 |
0.400 |
5 |
0 |
0 |
0.032 |
87 |
|
[COA]E:387 |
25 |
1 |
941 |
f |
E |
x,y,z |
1_555 |
38 |
12 |
7456 |
262.3 |
-3.3 |
0.372 |
5 |
0 |
0 |
0.032 |
88 |
|
[COA]A:127 |
24 |
1 |
933 |
f |
A |
x,y,z |
1_555 |
37 |
12 |
7365 |
260.6 |
-3.2 |
0.369 |
5 |
0 |
0 |
0.032 |
89 |
|
[COA]N:1333 |
26 |
1 |
929 |
f |
O |
x,y,z |
1_555 |
39 |
12 |
7518 |
232.8 |
-2.7 |
0.400 |
5 |
0 |
0 |
0.032 |
| Average: |
265.8 |
-3.0 |
0.388 |
5 |
0 |
0 |
0.032 |
| 8 |
90 |
|
[A3P]O:2575 |
27 |
1 |
573 |
f |
[COA]N:1333 |
x,y,z |
1_555 |
31 |
1 |
929 |
221.8 |
-2.4 |
0.513 |
0 |
0 |
0 |
0.011 |
| 9 |
91 |
|
[A3P]O:2575 |
22 |
1 |
573 |
f |
O |
x,y,z |
1_555 |
41 |
13 |
7518 |
218.9 |
-1.4 |
0.575 |
3 |
0 |
0 |
0.013 |
| 10 |
92 |
|
P |
20 |
6 |
7295 |
◊ |
B |
-x+1,y-1/2,-z+1 |
2_646 |
21 |
5 |
7445 |
199.1 |
2.1 |
0.777 |
1 |
2 |
0 |
0.000 |
93 |
|
O |
23 |
5 |
7518 |
◊ |
R |
-x+1,y-1/2,-z+1 |
2_646 |
20 |
7 |
7254 |
189.6 |
1.9 |
0.760 |
2 |
3 |
0 |
0.000 |
| Average: |
194.4 |
2.0 |
0.768 |
2 |
3 |
0 |
0.000 |
| 11 |
94 |
|
X |
22 |
9 |
7363 |
◊ |
P |
x,y,z |
1_555 |
22 |
7 |
7295 |
184.4 |
1.3 |
0.736 |
3 |
4 |
0 |
0.000 |
95 |
|
Q |
22 |
7 |
7386 |
◊ |
K |
x,y,z |
1_555 |
24 |
9 |
7364 |
182.4 |
1.1 |
0.713 |
2 |
4 |
0 |
0.000 |
96 |
|
R |
24 |
8 |
7254 |
◊ |
F |
x,y,z |
1_555 |
28 |
11 |
7258 |
169.2 |
0.7 |
0.689 |
2 |
4 |
0 |
0.000 |
97 |
|
I |
21 |
8 |
7273 |
◊ |
C |
x-1,y,z-1 |
1_454 |
20 |
9 |
7349 |
147.3 |
-0.5 |
0.542 |
0 |
0 |
0 |
0.000 |
| Average: |
170.8 |
0.7 |
0.670 |
2 |
3 |
0 |
0.000 |
| 12 |
98 |
|
O |
21 |
7 |
7518 |
◊ |
B |
-x+1,y-1/2,-z+1 |
2_646 |
24 |
8 |
7445 |
174.4 |
2.8 |
0.827 |
1 |
1 |
0 |
0.000 |
| 13 |
99 |
|
Q |
20 |
5 |
7386 |
◊ |
A |
x-1,y,z |
1_455 |
18 |
6 |
7365 |
173.4 |
0.5 |
0.627 |
0 |
0 |
0 |
0.000 |
100 |
|
W |
18 |
4 |
7296 |
◊ |
F |
x-1,y,z |
1_455 |
18 |
6 |
7258 |
149.4 |
0.1 |
0.596 |
1 |
0 |
0 |
0.000 |
| Average: |
161.4 |
0.3 |
0.611 |
1 |
0 |
0 |
0.000 |
| 14 |
101 |
|
[MRD]F:2559 |
7 |
1 |
277 |
◊ |
F |
x,y,z |
1_555 |
22 |
9 |
7258 |
171.6 |
2.9 |
0.493 |
2 |
0 |
0 |
0.000 |
| 15 |
102 |
|
[MPD]A:2570 |
7 |
1 |
278 |
f |
A |
x,y,z |
1_555 |
19 |
7 |
7365 |
167.2 |
-10.7 |
0.586 |
2 |
0 |
0 |
0.053 |
103 |
|
[MPD]O:1334 |
7 |
1 |
279 |
f |
O |
x,y,z |
1_555 |
23 |
8 |
7518 |
165.1 |
-10.9 |
0.581 |
1 |
0 |
0 |
0.053 |
104 |
|
[MPD]R:2566 |
7 |
1 |
278 |
f |
R |
x,y,z |
1_555 |
22 |
8 |
7254 |
164.2 |
-10.5 |
0.653 |
1 |
0 |
0 |
0.053 |
105 |
|
[MPD]W:2106 |
7 |
1 |
278 |
f |
W |
x,y,z |
1_555 |
23 |
8 |
7296 |
164.1 |
-11.0 |
0.594 |
0 |
0 |
0 |
0.053 |
106 |
|
[MPD]V:1945 |
7 |
1 |
278 |
f |
V |
x,y,z |
1_555 |
22 |
7 |
7291 |
164.0 |
-10.9 |
0.595 |
0 |
0 |
0 |
0.053 |
107 |
|
[MPD]U:1698 |
7 |
1 |
278 |
f |
U |
x,y,z |
1_555 |
23 |
7 |
7352 |
161.7 |
-10.7 |
0.601 |
1 |
0 |
0 |
0.053 |
108 |
|
[MPD]E:2560 |
7 |
1 |
277 |
f |
E |
x,y,z |
1_555 |
21 |
7 |
7456 |
161.2 |
-10.7 |
0.570 |
2 |
0 |
0 |
0.053 |
109 |
|
[MPD]C:2571 |
7 |
1 |
278 |
f |
C |
x,y,z |
1_555 |
20 |
7 |
7349 |
151.6 |
-10.7 |
0.467 |
0 |
0 |
0 |
0.053 |
| Average: |
162.4 |
-10.8 |
0.581 |
1 |
0 |
0 |
0.053 |
| 16 |
110 |
|
[MPD]G:571 |
7 |
1 |
277 |
f |
G |
x,y,z |
1_555 |
22 |
8 |
7365 |
163.8 |
-11.0 |
0.567 |
0 |
0 |
0 |
0.039 |
111 |
|
[MPD]P:1425 |
7 |
1 |
277 |
f |
P |
x,y,z |
1_555 |
22 |
7 |
7295 |
163.3 |
-10.4 |
0.649 |
1 |
0 |
0 |
0.039 |
112 |
|
[MPD]Q:2567 |
7 |
1 |
278 |
f |
Q |
x,y,z |
1_555 |
22 |
7 |
7386 |
160.0 |
-10.7 |
0.591 |
0 |
0 |
0 |
0.039 |
| Average: |
162.3 |
-10.7 |
0.603 |
0 |
0 |
0 |
0.039 |
| 17 |
113 |
|
[MRD]L:2562 |
7 |
1 |
279 |
◊ |
L |
x,y,z |
1_555 |
22 |
7 |
7318 |
163.6 |
2.0 |
0.406 |
1 |
0 |
0 |
0.000 |
| 18 |
114 |
|
[MRD]K:2564 |
7 |
1 |
277 |
◊ |
K |
x,y,z |
1_555 |
20 |
7 |
7364 |
163.5 |
2.6 |
0.431 |
2 |
0 |
0 |
0.000 |
| 19 |
115 |
|
[MRD]T:2569 |
7 |
1 |
277 |
◊ |
T |
x,y,z |
1_555 |
22 |
7 |
7456 |
161.7 |
3.2 |
0.492 |
2 |
0 |
0 |
0.000 |
| 20 |
116 |
|
[MRD]D:2573 |
7 |
1 |
274 |
f |
D |
x,y,z |
1_555 |
21 |
7 |
7425 |
161.4 |
0.8 |
0.300 |
2 |
0 |
0 |
0.000 |
| 21 |
117 |
|
[MPD]M:2572 |
7 |
1 |
276 |
f |
M |
x,y,z |
1_555 |
20 |
7 |
7396 |
160.9 |
-10.1 |
0.631 |
2 |
0 |
0 |
0.028 |
| 22 |
118 |
|
[MPD]I:2561 |
7 |
1 |
279 |
f |
I |
x,y,z |
1_555 |
23 |
7 |
7273 |
160.6 |
-10.3 |
0.649 |
3 |
0 |
0 |
0.040 |
| 23 |
119 |
|
[MPD]H:631 |
7 |
1 |
279 |
f |
H |
x,y,z |
1_555 |
19 |
7 |
7430 |
157.0 |
-10.2 |
0.568 |
1 |
0 |
0 |
0.038 |
| 24 |
120 |
|
[MRD]N:2565 |
7 |
1 |
272 |
◊ |
N |
x,y,z |
1_555 |
21 |
7 |
7296 |
155.6 |
1.6 |
0.341 |
1 |
0 |
0 |
0.000 |
| 25 |
121 |
|
[MPD]B:127 |
7 |
1 |
275 |
f |
B |
x,y,z |
1_555 |
21 |
7 |
7445 |
155.3 |
-10.3 |
0.508 |
1 |
0 |
0 |
0.038 |
| 26 |
122 |
|
V |
23 |
6 |
7291 |
◊ |
B |
x-1,y,z |
1_455 |
15 |
6 |
7445 |
134.4 |
0.0 |
0.571 |
1 |
0 |
0 |
0.000 |
| 27 |
123 |
|
[MPD]S:1697 |
7 |
1 |
277 |
f |
S |
x,y,z |
1_555 |
18 |
7 |
7256 |
127.6 |
-6.9 |
0.704 |
2 |
0 |
0 |
0.030 |
| 28 |
124 |
|
[COA]W:2105 |
15 |
1 |
941 |
◊ |
S |
-x,y-1/2,-z+1 |
2_546 |
15 |
4 |
7256 |
117.0 |
0.7 |
0.598 |
1 |
0 |
0 |
0.000 |
125 |
|
[COA]N:1333 |
13 |
1 |
929 |
◊ |
J |
-x,y-1/2,-z+1 |
2_546 |
14 |
3 |
7335 |
107.2 |
1.2 |
0.668 |
0 |
0 |
0 |
0.000 |
| Average: |
112.1 |
1.0 |
0.633 |
1 |
0 |
0 |
0.000 |
| 29 |
126 |
|
W |
15 |
3 |
7296 |
◊ |
[COA]T:1791 |
-x,y-1/2,-z+1 |
2_546 |
14 |
1 |
929 |
104.2 |
2.2 |
0.686 |
0 |
0 |
0 |
0.000 |
127 |
|
N |
16 |
3 |
7296 |
◊ |
[COA]K:900 |
-x,y-1/2,-z+1 |
2_546 |
13 |
1 |
930 |
100.2 |
2.2 |
0.677 |
0 |
0 |
0 |
0.000 |
| Average: |
102.2 |
2.2 |
0.682 |
0 |
0 |
0 |
0.000 |
| 30 |
128 |
|
G |
12 |
4 |
7365 |
◊ |
L |
-x,y-1/2,-z |
2_545 |
14 |
4 |
7318 |
98.4 |
0.8 |
0.706 |
1 |
0 |
0 |
0.000 |
129 |
|
D |
3 |
1 |
7425 |
◊ |
I |
-x,y-1/2,-z |
2_545 |
4 |
2 |
7273 |
32.1 |
-0.0 |
0.521 |
0 |
0 |
0 |
0.000 |
| Average: |
65.3 |
0.4 |
0.613 |
1 |
0 |
0 |
0.000 |
| 31 |
130 |
|
G |
10 |
4 |
7365 |
◊ |
M |
x-1,y,z-1 |
1_454 |
15 |
6 |
7396 |
94.5 |
0.8 |
0.655 |
0 |
0 |
0 |
0.000 |
| 32 |
131 |
|
[COA]X:1944 |
8 |
1 |
934 |
◊ |
P |
x,y,z |
1_555 |
14 |
4 |
7295 |
91.6 |
2.3 |
0.669 |
0 |
0 |
0 |
0.000 |
132 |
|
[COA]L:1008 |
9 |
1 |
925 |
◊ |
Q |
x,y,z |
1_555 |
14 |
4 |
7386 |
91.4 |
2.4 |
0.669 |
0 |
0 |
0 |
0.000 |
133 |
|
I |
13 |
4 |
7273 |
◊ |
[COA]A:127 |
x-1,y,z-1 |
1_454 |
7 |
1 |
933 |
89.3 |
2.6 |
0.737 |
0 |
0 |
0 |
0.000 |
134 |
|
[COA]D:283 |
8 |
1 |
927 |
◊ |
R |
x,y,z |
1_555 |
14 |
4 |
7254 |
84.2 |
2.0 |
0.622 |
0 |
0 |
0 |
0.000 |
| Average: |
89.1 |
2.3 |
0.674 |
0 |
0 |
0 |
0.000 |
| 33 |
135 |
|
O |
8 |
3 |
7518 |
◊ |
K |
-x,y-1/2,-z+1 |
2_546 |
10 |
4 |
7364 |
90.4 |
3.1 |
0.917 |
1 |
0 |
0 |
0.000 |
136 |
|
X |
11 |
6 |
7363 |
◊ |
T |
-x,y-1/2,-z+1 |
2_546 |
8 |
3 |
7456 |
76.2 |
1.8 |
0.833 |
0 |
0 |
0 |
0.000 |
| Average: |
83.3 |
2.4 |
0.875 |
1 |
0 |
0 |
0.000 |
| 34 |
137 |
|
G |
10 |
3 |
7365 |
◊ |
A |
x-1,y,z-1 |
1_454 |
9 |
3 |
7365 |
85.0 |
1.8 |
0.834 |
2 |
0 |
0 |
0.000 |
138 |
|
R |
8 |
3 |
7254 |
◊ |
L |
x,y,z |
1_555 |
9 |
3 |
7318 |
70.1 |
1.8 |
0.831 |
2 |
0 |
0 |
0.000 |
139 |
|
V |
5 |
2 |
7291 |
◊ |
Q |
x,y,z |
1_555 |
9 |
3 |
7386 |
42.9 |
1.0 |
0.761 |
1 |
0 |
0 |
0.000 |
140 |
|
I |
5 |
3 |
7273 |
◊ |
S |
x-1,y,z-1 |
1_454 |
3 |
2 |
7256 |
31.7 |
0.2 |
0.528 |
0 |
0 |
0 |
0.000 |
| Average: |
57.4 |
1.2 |
0.739 |
1 |
0 |
0 |
0.000 |
| 35 |
141 |
|
[ACT]C:2598 |
4 |
1 |
182 |
f |
C |
x,y,z |
1_555 |
11 |
5 |
7349 |
81.9 |
0.0 |
0.737 |
1 |
0 |
0 |
0.001 |
| 36 |
142 |
|
[A3P]O:2575 |
14 |
1 |
573 |
◊ |
N |
x,y,z |
1_555 |
16 |
5 |
7296 |
81.7 |
1.7 |
0.662 |
1 |
0 |
0 |
0.000 |
| 37 |
143 |
|
[ACT]T:2568 |
4 |
1 |
183 |
f |
T |
x,y,z |
1_555 |
15 |
4 |
7456 |
78.3 |
-0.3 |
0.667 |
1 |
0 |
0 |
0.002 |
| 38 |
144 |
|
[ACT]K:2563 |
4 |
1 |
182 |
◊ |
K |
x,y,z |
1_555 |
10 |
4 |
7364 |
75.4 |
0.7 |
0.795 |
1 |
0 |
0 |
0.000 |
| 39 |
145 |
|
[CL]G:2574 |
1 |
1 |
125 |
f |
G |
x,y,z |
1_555 |
10 |
5 |
7365 |
72.9 |
-9.3 |
0.000 |
0 |
0 |
0 |
0.036 |
146 |
|
[CL]E:2591 |
1 |
1 |
125 |
f |
E |
x,y,z |
1_555 |
11 |
5 |
7456 |
70.8 |
-9.3 |
0.000 |
0 |
0 |
0 |
0.036 |
147 |
|
[CL]T:2592 |
1 |
1 |
125 |
f |
T |
x,y,z |
1_555 |
9 |
4 |
7456 |
69.5 |
-10.3 |
0.000 |
0 |
0 |
0 |
0.036 |
148 |
|
[CL]C:2558 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
8 |
4 |
7349 |
68.1 |
-10.3 |
0.000 |
0 |
0 |
0 |
0.036 |
149 |
|
[CL]L:2543 |
1 |
1 |
125 |
f |
L |
x,y,z |
1_555 |
8 |
4 |
7318 |
68.0 |
-10.4 |
0.000 |
0 |
0 |
0 |
0.036 |
150 |
|
[CL]P:2544 |
1 |
1 |
125 |
f |
P |
x,y,z |
1_555 |
8 |
4 |
7295 |
67.8 |
-10.2 |
0.000 |
0 |
0 |
0 |
0.036 |
151 |
|
[CL]M:2555 |
1 |
1 |
125 |
f |
M |
x,y,z |
1_555 |
10 |
5 |
7396 |
67.8 |
-8.8 |
0.000 |
0 |
0 |
0 |
0.036 |
152 |
|
[CL]J:2541 |
1 |
1 |
125 |
f |
J |
x,y,z |
1_555 |
8 |
4 |
7335 |
67.6 |
-10.2 |
0.000 |
0 |
0 |
0 |
0.036 |
153 |
|
[CL]A:128 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
7365 |
64.6 |
-9.7 |
0.000 |
0 |
0 |
0 |
0.036 |
| Average: |
68.6 |
-9.8 |
0.000 |
0 |
0 |
0 |
0.036 |
| 40 |
154 |
|
[ACT]R:2595 |
4 |
1 |
183 |
f |
[COA]R:1606 |
x,y,z |
1_555 |
9 |
1 |
940 |
70.8 |
-0.9 |
0.537 |
0 |
0 |
0 |
0.003 |
| 41 |
155 |
|
[ACT]E:2594 |
4 |
1 |
183 |
f |
[COA]E:387 |
x,y,z |
1_555 |
9 |
1 |
941 |
70.5 |
-0.8 |
0.551 |
0 |
0 |
0 |
0.002 |
| 42 |
156 |
|
[ACT]W:2596 |
4 |
1 |
183 |
f |
[COA]W:2019 |
x,y,z |
1_555 |
9 |
1 |
931 |
70.5 |
-1.0 |
0.522 |
0 |
0 |
0 |
0.003 |
| 43 |
157 |
|
[ACT]K:629 |
4 |
1 |
183 |
f |
K |
x,y,z |
1_555 |
15 |
5 |
7364 |
69.5 |
0.1 |
0.716 |
1 |
0 |
0 |
0.002 |
| 44 |
158 |
|
[ACT]A:2597 |
4 |
1 |
183 |
f |
[COA]A:127 |
x,y,z |
1_555 |
9 |
1 |
933 |
69.3 |
-1.0 |
0.522 |
0 |
0 |
0 |
0.002 |
| 45 |
159 |
|
P |
6 |
2 |
7295 |
◊ |
D |
x,y,z |
1_555 |
6 |
3 |
7425 |
66.2 |
2.3 |
0.911 |
2 |
0 |
0 |
0.000 |
| 46 |
160 |
|
[MPD]S:1697 |
4 |
1 |
277 |
◊ |
[COA]T:1791 |
x,y,z |
1_555 |
8 |
1 |
929 |
62.3 |
-2.7 |
0.735 |
0 |
0 |
0 |
0.000 |
| 47 |
161 |
|
G |
8 |
3 |
7365 |
◊ |
[COA]N:1221 |
x-1,y,z-1 |
1_454 |
4 |
1 |
941 |
59.2 |
0.3 |
0.550 |
1 |
0 |
0 |
0.000 |
| 48 |
162 |
|
[ACT]A:2597 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
8 |
3 |
7365 |
56.4 |
1.3 |
0.844 |
1 |
0 |
0 |
0.000 |
| 49 |
163 |
|
E |
4 |
1 |
7456 |
◊ |
I |
-x,y-1/2,-z |
2_545 |
7 |
3 |
7273 |
55.5 |
0.6 |
0.677 |
0 |
0 |
0 |
0.000 |
| 50 |
164 |
|
H |
8 |
5 |
7430 |
◊ |
U |
x-1,y,z-1 |
1_454 |
8 |
5 |
7352 |
54.5 |
0.9 |
0.736 |
0 |
0 |
0 |
0.000 |
| 51 |
165 |
|
U |
4 |
1 |
7352 |
◊ |
J |
-x,y-1/2,-z+1 |
2_546 |
8 |
3 |
7335 |
53.7 |
1.5 |
0.812 |
1 |
1 |
0 |
0.000 |
166 |
|
H |
4 |
1 |
7430 |
◊ |
S |
-x,y-1/2,-z+1 |
2_546 |
5 |
2 |
7256 |
36.9 |
-0.3 |
0.389 |
0 |
0 |
0 |
0.000 |
167 |
|
N |
7 |
3 |
7296 |
◊ |
I |
-x,y-1/2,-z+1 |
2_546 |
3 |
1 |
7273 |
36.7 |
1.1 |
0.823 |
1 |
1 |
0 |
0.000 |
168 |
|
W |
4 |
2 |
7296 |
◊ |
C |
-x,y-1/2,-z+1 |
2_546 |
2 |
1 |
7349 |
31.4 |
-0.2 |
0.309 |
0 |
0 |
0 |
0.000 |
| Average: |
39.7 |
0.5 |
0.583 |
1 |
1 |
0 |
0.000 |
| 52 |
169 |
|
[ACT]R:2595 |
4 |
1 |
183 |
f |
R |
x,y,z |
1_555 |
6 |
2 |
7254 |
52.9 |
1.5 |
0.920 |
1 |
0 |
0 |
0.000 |
| 53 |
170 |
|
[ACT]W:2596 |
4 |
1 |
183 |
f |
W |
x,y,z |
1_555 |
6 |
2 |
7296 |
49.2 |
1.4 |
0.853 |
1 |
0 |
0 |
0.000 |
| 54 |
171 |
|
E |
6 |
2 |
7456 |
◊ |
J |
-x,y-1/2,-z |
2_545 |
7 |
3 |
7335 |
48.5 |
0.8 |
0.758 |
2 |
0 |
0 |
0.000 |
| 55 |
172 |
|
[ACT]E:2594 |
4 |
1 |
183 |
f |
E |
x,y,z |
1_555 |
6 |
2 |
7456 |
47.4 |
1.3 |
0.851 |
1 |
0 |
0 |
0.000 |
| 56 |
173 |
|
G |
9 |
4 |
7365 |
◊ |
J |
-x,y-1/2,-z |
2_545 |
2 |
1 |
7335 |
40.7 |
0.5 |
0.604 |
0 |
0 |
0 |
0.000 |
| 57 |
174 |
|
H |
9 |
2 |
7430 |
◊ |
[COA]S:1696 |
x-1,y,z-1 |
1_454 |
5 |
1 |
940 |
40.6 |
0.9 |
0.597 |
0 |
0 |
0 |
0.000 |
| 58 |
175 |
|
[MPD]M:2572 |
2 |
1 |
276 |
◊ |
[COA]N:1221 |
x,y,z |
1_555 |
3 |
1 |
941 |
39.5 |
-1.5 |
0.778 |
0 |
0 |
0 |
0.000 |
| 59 |
176 |
|
[MRD]F:2559 |
3 |
1 |
277 |
◊ |
[COA]D:283 |
x,y,z |
1_555 |
2 |
1 |
927 |
39.1 |
1.3 |
0.426 |
0 |
0 |
0 |
0.000 |
| 60 |
177 |
|
[MRD]K:2564 |
1 |
1 |
277 |
◊ |
[COA]L:1008 |
x,y,z |
1_555 |
2 |
1 |
925 |
36.8 |
1.6 |
0.634 |
0 |
0 |
0 |
0.000 |
| 61 |
178 |
|
[MPD]C:2571 |
1 |
1 |
278 |
◊ |
[COA]A:127 |
x,y,z |
1_555 |
2 |
1 |
933 |
35.4 |
-2.0 |
0.373 |
0 |
0 |
0 |
0.000 |
179 |
|
[MPD]R:2566 |
1 |
1 |
278 |
◊ |
[COA]P:1424 |
x,y,z |
1_555 |
4 |
1 |
943 |
33.2 |
-0.8 |
0.547 |
0 |
0 |
0 |
0.000 |
180 |
|
[MPD]A:2570 |
2 |
1 |
278 |
◊ |
[COA]A:129 |
x,y,z |
1_555 |
3 |
1 |
936 |
33.2 |
-2.4 |
0.532 |
0 |
0 |
0 |
0.000 |
181 |
|
[MPD]V:1945 |
1 |
1 |
278 |
◊ |
[COA]W:2019 |
x,y,z |
1_555 |
2 |
1 |
931 |
30.9 |
-2.3 |
0.401 |
0 |
0 |
0 |
0.000 |
182 |
|
[MPD]O:1334 |
1 |
1 |
279 |
◊ |
[COA]O:1127 |
x,y,z |
1_555 |
3 |
1 |
936 |
29.8 |
-0.8 |
0.693 |
0 |
0 |
0 |
0.000 |
183 |
|
[MPD]E:2560 |
1 |
1 |
277 |
◊ |
[COA]F:477 |
x,y,z |
1_555 |
4 |
1 |
938 |
27.8 |
-0.8 |
0.648 |
0 |
0 |
0 |
0.000 |
184 |
|
[MPD]G:571 |
1 |
1 |
277 |
◊ |
[COA]H:630 |
x,y,z |
1_555 |
2 |
1 |
930 |
27.1 |
-1.7 |
0.467 |
0 |
0 |
0 |
0.000 |
185 |
|
[MPD]U:1698 |
1 |
1 |
278 |
◊ |
[COA]S:1696 |
x,y,z |
1_555 |
2 |
1 |
940 |
26.7 |
-0.9 |
0.604 |
0 |
0 |
0 |
0.000 |
| Average: |
30.5 |
-1.5 |
0.533 |
0 |
0 |
0 |
0.000 |
| 62 |
186 |
|
[CA]D:2540 |
1 |
1 |
85 |
f |
D |
x,y,z |
1_555 |
5 |
3 |
7425 |
35.1 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.038 |
187 |
|
[CA]Q:2535 |
1 |
1 |
85 |
f |
Q |
x,y,z |
1_555 |
5 |
3 |
7386 |
34.7 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.038 |
188 |
|
[CA]U:2546 |
1 |
1 |
85 |
f |
U |
x,y,z |
1_555 |
5 |
3 |
7352 |
34.7 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.038 |
189 |
|
[CA]S:2538 |
1 |
1 |
85 |
f |
S |
x,y,z |
1_555 |
5 |
3 |
7256 |
34.7 |
-6.6 |
0.000 |
0 |
0 |
0 |
0.038 |
190 |
|
[CA]N:2532 |
1 |
1 |
85 |
f |
N |
x,y,z |
1_555 |
4 |
3 |
7296 |
34.7 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.038 |
191 |
|
[CA]H:2522 |
1 |
1 |
85 |
f |
H |
x,y,z |
1_555 |
4 |
3 |
7430 |
34.5 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.038 |
192 |
|
[CA]I:2525 |
1 |
1 |
85 |
f |
I |
x,y,z |
1_555 |
5 |
3 |
7273 |
34.5 |
-6.6 |
0.000 |
0 |
0 |
0 |
0.038 |
193 |
|
[CA]J:2542 |
1 |
1 |
85 |
f |
J |
x,y,z |
1_555 |
5 |
3 |
7335 |
34.4 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.038 |
194 |
|
[CA]C:2553 |
1 |
1 |
85 |
f |
C |
x,y,z |
1_555 |
5 |
3 |
7349 |
34.4 |
-6.5 |
0.000 |
0 |
0 |
0 |
0.038 |
195 |
|
[CA]L:2528 |
1 |
1 |
85 |
f |
L |
x,y,z |
1_555 |
5 |
3 |
7318 |
34.2 |
-6.5 |
0.000 |
0 |
0 |
0 |
0.038 |
196 |
|
[CA]M:2530 |
1 |
1 |
85 |
f |
M |
x,y,z |
1_555 |
5 |
3 |
7396 |
33.7 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.038 |
197 |
|
[CA]B:2551 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
4 |
3 |
7445 |
33.6 |
-6.5 |
0.000 |
0 |
0 |
0 |
0.038 |
198 |
|
[CA]G:2520 |
1 |
1 |
85 |
f |
G |
x,y,z |
1_555 |
5 |
3 |
7365 |
33.6 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.038 |
199 |
|
[CA]X:2550 |
1 |
1 |
85 |
f |
X |
x,y,z |
1_555 |
6 |
3 |
7363 |
33.5 |
-6.4 |
0.000 |
0 |
0 |
0 |
0.038 |
200 |
|
[CA]V:2557 |
1 |
1 |
85 |
f |
V |
x,y,z |
1_555 |
5 |
3 |
7291 |
33.5 |
-6.4 |
0.000 |
0 |
0 |
0 |
0.038 |
201 |
|
[CA]P:2534 |
1 |
1 |
85 |
f |
P |
x,y,z |
1_555 |
5 |
3 |
7295 |
33.2 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.038 |
202 |
|
[CA]F:2518 |
1 |
1 |
85 |
f |
F |
x,y,z |
1_555 |
4 |
3 |
7258 |
33.1 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.038 |
203 |
|
[CA]K:569 |
1 |
1 |
85 |
f |
K |
x,y,z |
1_555 |
5 |
3 |
7364 |
27.2 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.038 |
204 |
|
[CA]R:2512 |
1 |
1 |
85 |
f |
R |
x,y,z |
1_555 |
5 |
3 |
7254 |
26.9 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.038 |
205 |
|
[CA]T:1792 |
1 |
1 |
85 |
f |
T |
x,y,z |
1_555 |
5 |
3 |
7456 |
26.1 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.038 |
206 |
|
[CA]W:2548 |
1 |
1 |
85 |
f |
W |
x,y,z |
1_555 |
4 |
3 |
7296 |
26.0 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.038 |
207 |
|
[CA]E:2554 |
1 |
1 |
85 |
f |
E |
x,y,z |
1_555 |
4 |
3 |
7456 |
25.7 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.038 |
208 |
|
[CA]A:2552 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
5 |
3 |
7365 |
25.5 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.038 |
| Average: |
32.1 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.038 |
| 63 |
209 |
|
[MPD]W:2106 |
1 |
1 |
278 |
◊ |
[COA]W:2105 |
x,y,z |
1_555 |
4 |
1 |
941 |
34.5 |
-1.1 |
0.513 |
0 |
0 |
0 |
0.000 |
210 |
|
[MPD]I:2561 |
2 |
1 |
279 |
◊ |
[COA]G:570 |
x,y,z |
1_555 |
4 |
1 |
940 |
27.7 |
-1.1 |
0.705 |
0 |
0 |
0 |
0.000 |
| Average: |
31.1 |
-1.1 |
0.609 |
0 |
0 |
0 |
0.000 |
| 64 |
211 |
|
[CA]X:2550 |
1 |
1 |
85 |
f |
[COA]W:2105 |
x,y,z |
1_555 |
5 |
1 |
941 |
31.6 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.035 |
212 |
|
[CA]V:2557 |
1 |
1 |
85 |
f |
[COA]X:1944 |
x,y,z |
1_555 |
5 |
1 |
934 |
30.7 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.035 |
213 |
|
[CA]P:2534 |
1 |
1 |
85 |
f |
[COA]P:1424 |
x,y,z |
1_555 |
5 |
1 |
943 |
30.4 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.035 |
214 |
|
[CA]M:2530 |
1 |
1 |
85 |
f |
[COA]O:1127 |
x,y,z |
1_555 |
6 |
1 |
936 |
30.3 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.035 |
215 |
|
[CA]C:2553 |
1 |
1 |
85 |
f |
[COA]C:169 |
x,y,z |
1_555 |
5 |
1 |
940 |
30.2 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.035 |
216 |
|
[CA]N:2532 |
1 |
1 |
85 |
f |
[COA]N:1221 |
x,y,z |
1_555 |
5 |
1 |
941 |
30.0 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.035 |
217 |
|
[CA]D:2540 |
1 |
1 |
85 |
f |
[COA]D:283 |
x,y,z |
1_555 |
5 |
1 |
927 |
30.0 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.035 |
218 |
|
[CA]H:2522 |
1 |
1 |
85 |
f |
[COA]H:630 |
x,y,z |
1_555 |
5 |
1 |
930 |
29.9 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.035 |
219 |
|
[CA]B:2551 |
1 |
1 |
85 |
f |
[COA]A:129 |
x,y,z |
1_555 |
5 |
1 |
936 |
29.7 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.035 |
220 |
|
[CA]Q:2535 |
1 |
1 |
85 |
f |
[COA]Q:1515 |
x,y,z |
1_555 |
5 |
1 |
944 |
29.7 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.035 |
221 |
|
[CA]I:2525 |
1 |
1 |
85 |
f |
[COA]I:699 |
x,y,z |
1_555 |
5 |
1 |
938 |
29.2 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.035 |
222 |
|
[CA]L:2528 |
1 |
1 |
85 |
f |
[COA]L:1008 |
x,y,z |
1_555 |
5 |
1 |
925 |
29.0 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.035 |
223 |
|
[CA]J:2542 |
1 |
1 |
85 |
f |
[COA]J:780 |
x,y,z |
1_555 |
5 |
1 |
943 |
29.0 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.035 |
224 |
|
[CA]U:2546 |
1 |
1 |
85 |
f |
[COA]U:1854 |
x,y,z |
1_555 |
5 |
1 |
938 |
28.9 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.035 |
225 |
|
[CA]G:2520 |
1 |
1 |
85 |
f |
[COA]G:570 |
x,y,z |
1_555 |
5 |
1 |
940 |
28.8 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.035 |
226 |
|
[CA]S:2538 |
1 |
1 |
85 |
f |
[COA]S:1696 |
x,y,z |
1_555 |
5 |
1 |
940 |
28.5 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.035 |
227 |
|
[CA]F:2518 |
1 |
1 |
85 |
f |
[COA]F:477 |
x,y,z |
1_555 |
6 |
1 |
938 |
28.0 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.035 |
228 |
|
[CA]K:569 |
1 |
1 |
85 |
f |
[COA]K:900 |
x,y,z |
1_555 |
4 |
1 |
930 |
26.3 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.035 |
229 |
|
[CA]T:1792 |
1 |
1 |
85 |
f |
[COA]T:1791 |
x,y,z |
1_555 |
4 |
1 |
929 |
25.5 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.035 |
230 |
|
[CA]E:2554 |
1 |
1 |
85 |
f |
[COA]E:387 |
x,y,z |
1_555 |
5 |
1 |
941 |
25.4 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.035 |
231 |
|
[CA]W:2548 |
1 |
1 |
85 |
f |
[COA]W:2019 |
x,y,z |
1_555 |
5 |
1 |
931 |
24.9 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.035 |
232 |
|
[CA]R:2512 |
1 |
1 |
85 |
f |
[COA]R:1606 |
x,y,z |
1_555 |
5 |
1 |
940 |
24.9 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.035 |
233 |
|
[CA]A:2552 |
1 |
1 |
85 |
f |
[COA]A:127 |
x,y,z |
1_555 |
5 |
1 |
933 |
24.8 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.035 |
| Average: |
28.5 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.035 |
| 65 |
234 |
|
[CA]U:2537 |
1 |
1 |
85 |
f |
U |
x,y,z |
1_555 |
8 |
5 |
7352 |
30.8 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.000 |
235 |
|
[CA]V:2547 |
1 |
1 |
85 |
f |
V |
x,y,z |
1_555 |
9 |
5 |
7291 |
30.6 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.000 |
236 |
|
[CA]I:2521 |
1 |
1 |
85 |
f |
I |
x,y,z |
1_555 |
7 |
5 |
7273 |
30.6 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.000 |
237 |
|
[CA]K:2529 |
1 |
1 |
85 |
f |
K |
x,y,z |
1_555 |
8 |
5 |
7364 |
30.5 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.000 |
238 |
|
[CA]C:2513 |
1 |
1 |
85 |
f |
C |
x,y,z |
1_555 |
7 |
5 |
7349 |
29.9 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.000 |
239 |
|
[CA]Q:2536 |
1 |
1 |
85 |
f |
Q |
x,y,z |
1_555 |
8 |
5 |
7386 |
29.9 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.000 |
240 |
|
[CA]R:1607 |
1 |
1 |
85 |
f |
R |
x,y,z |
1_555 |
8 |
5 |
7254 |
29.9 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.000 |
241 |
|
[CA]P:1426 |
1 |
1 |
85 |
f |
P |
x,y,z |
1_555 |
8 |
5 |
7295 |
29.8 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.000 |
242 |
|
[CA]T:2545 |
1 |
1 |
85 |
f |
T |
x,y,z |
1_555 |
7 |
5 |
7456 |
29.8 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.000 |
243 |
|
[CA]O:2531 |
1 |
1 |
85 |
f |
O |
x,y,z |
1_555 |
7 |
5 |
7518 |
29.8 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.000 |
244 |
|
[CA]L:2526 |
1 |
1 |
85 |
f |
L |
x,y,z |
1_555 |
7 |
5 |
7318 |
29.7 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.000 |
245 |
|
[CA]H:2524 |
1 |
1 |
85 |
f |
H |
x,y,z |
1_555 |
7 |
5 |
7430 |
29.7 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.000 |
246 |
|
[CA]A:2514 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
7 |
5 |
7365 |
29.7 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.000 |
247 |
|
[CA]B:2515 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
8 |
5 |
7445 |
29.6 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.000 |
248 |
|
[CA]G:2523 |
1 |
1 |
85 |
f |
G |
x,y,z |
1_555 |
8 |
5 |
7365 |
29.5 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.000 |
249 |
|
[CA]X:2556 |
1 |
1 |
85 |
f |
X |
x,y,z |
1_555 |
7 |
5 |
7363 |
29.3 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.000 |
250 |
|
[CA]F:2516 |
1 |
1 |
85 |
f |
F |
x,y,z |
1_555 |
7 |
5 |
7258 |
29.3 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.000 |
251 |
|
[CA]E:2519 |
1 |
1 |
85 |
f |
E |
x,y,z |
1_555 |
7 |
5 |
7456 |
29.2 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.000 |
252 |
|
[CA]D:2517 |
1 |
1 |
85 |
f |
D |
x,y,z |
1_555 |
7 |
5 |
7425 |
29.1 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.000 |
253 |
|
[CA]M:2533 |
1 |
1 |
85 |
f |
M |
x,y,z |
1_555 |
7 |
5 |
7396 |
29.1 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.000 |
254 |
|
[CA]W:2549 |
1 |
1 |
85 |
f |
W |
x,y,z |
1_555 |
8 |
5 |
7296 |
29.1 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.000 |
255 |
|
[CA]J:2527 |
1 |
1 |
85 |
f |
J |
x,y,z |
1_555 |
7 |
5 |
7335 |
28.6 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.000 |
256 |
|
[CA]S:2539 |
1 |
1 |
85 |
f |
S |
x,y,z |
1_555 |
7 |
5 |
7256 |
28.5 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.000 |
| Average: |
29.7 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.000 |
| 66 |
257 |
|
[MPD]B:127 |
1 |
1 |
275 |
◊ |
[COA]C:169 |
x,y,z |
1_555 |
2 |
1 |
940 |
30.5 |
-1.3 |
0.526 |
0 |
0 |
0 |
0.000 |
258 |
|
[MPD]H:631 |
1 |
1 |
279 |
◊ |
[COA]I:699 |
x,y,z |
1_555 |
2 |
1 |
938 |
29.5 |
-0.9 |
0.692 |
0 |
0 |
0 |
0.000 |
| Average: |
30.0 |
-1.1 |
0.609 |
0 |
0 |
0 |
0.000 |
| 67 |
259 |
|
[CA]S:2539 |
1 |
1 |
85 |
◊ |
[COA]T:1791 |
x,y,z |
1_555 |
4 |
1 |
929 |
29.5 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.000 |
260 |
|
[CA]J:2527 |
1 |
1 |
85 |
◊ |
[COA]K:900 |
x,y,z |
1_555 |
4 |
1 |
930 |
29.1 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.000 |
261 |
|
[CA]V:2547 |
1 |
1 |
85 |
◊ |
[COA]W:2019 |
x,y,z |
1_555 |
4 |
1 |
931 |
28.8 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.000 |
262 |
|
[CA]M:2533 |
1 |
1 |
85 |
◊ |
[COA]N:1221 |
x,y,z |
1_555 |
4 |
1 |
941 |
28.8 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.000 |
263 |
|
[CA]R:1607 |
1 |
1 |
85 |
◊ |
[COA]P:1424 |
x,y,z |
1_555 |
4 |
1 |
943 |
28.8 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.000 |
264 |
|
[CA]A:2514 |
1 |
1 |
85 |
◊ |
[COA]A:129 |
x,y,z |
1_555 |
4 |
1 |
936 |
28.8 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.000 |
265 |
|
[CA]B:2515 |
1 |
1 |
85 |
◊ |
[COA]C:169 |
x,y,z |
1_555 |
4 |
1 |
940 |
28.8 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.000 |
266 |
|
[CA]O:2531 |
1 |
1 |
85 |
◊ |
[COA]O:1127 |
x,y,z |
1_555 |
4 |
1 |
936 |
28.7 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.000 |
267 |
|
[CA]W:2549 |
1 |
1 |
85 |
◊ |
[COA]W:2105 |
x,y,z |
1_555 |
4 |
1 |
941 |
28.7 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.000 |
268 |
|
[CA]D:2517 |
1 |
1 |
85 |
◊ |
[COA]E:387 |
x,y,z |
1_555 |
4 |
1 |
941 |
28.7 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.000 |
269 |
|
[CA]I:2521 |
1 |
1 |
85 |
◊ |
[COA]G:570 |
x,y,z |
1_555 |
4 |
1 |
940 |
28.7 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.000 |
270 |
|
[CA]H:2524 |
1 |
1 |
85 |
◊ |
[COA]I:699 |
x,y,z |
1_555 |
4 |
1 |
938 |
28.6 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.000 |
271 |
|
[CA]X:2556 |
1 |
1 |
85 |
◊ |
[COA]X:1944 |
x,y,z |
1_555 |
4 |
1 |
934 |
28.6 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.000 |
272 |
|
[CA]F:2516 |
1 |
1 |
85 |
◊ |
[COA]D:283 |
x,y,z |
1_555 |
4 |
1 |
927 |
28.6 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.000 |
273 |
|
[CA]L:2526 |
1 |
1 |
85 |
◊ |
[COA]J:780 |
x,y,z |
1_555 |
4 |
1 |
943 |
28.5 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.000 |
274 |
|
[CA]P:1426 |
1 |
1 |
85 |
◊ |
[COA]Q:1515 |
x,y,z |
1_555 |
4 |
1 |
944 |
28.5 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.000 |
275 |
|
[CA]G:2523 |
1 |
1 |
85 |
◊ |
[COA]H:630 |
x,y,z |
1_555 |
4 |
1 |
930 |
28.4 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.000 |
276 |
|
[CA]E:2519 |
1 |
1 |
85 |
◊ |
[COA]F:477 |
x,y,z |
1_555 |
4 |
1 |
938 |
28.3 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.000 |
277 |
|
[CA]T:2545 |
1 |
1 |
85 |
◊ |
[COA]U:1854 |
x,y,z |
1_555 |
4 |
1 |
938 |
28.2 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.000 |
278 |
|
[CA]U:2537 |
1 |
1 |
85 |
◊ |
[COA]S:1696 |
x,y,z |
1_555 |
5 |
1 |
940 |
28.0 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.000 |
279 |
|
[CA]Q:2536 |
1 |
1 |
85 |
◊ |
[COA]R:1606 |
x,y,z |
1_555 |
4 |
1 |
940 |
28.0 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.000 |
280 |
|
[CA]K:2529 |
1 |
1 |
85 |
◊ |
[COA]L:1008 |
x,y,z |
1_555 |
4 |
1 |
925 |
28.0 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.000 |
281 |
|
[CA]C:2513 |
1 |
1 |
85 |
◊ |
[COA]A:127 |
x,y,z |
1_555 |
5 |
1 |
933 |
26.8 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.000 |
| Average: |
28.5 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.000 |
| 68 |
282 |
|
[MPD]P:1425 |
2 |
1 |
277 |
◊ |
[COA]Q:1515 |
x,y,z |
1_555 |
4 |
1 |
944 |
28.8 |
-0.9 |
0.760 |
0 |
0 |
0 |
0.000 |
283 |
|
[MPD]Q:2567 |
1 |
1 |
278 |
◊ |
[COA]R:1606 |
x,y,z |
1_555 |
3 |
1 |
940 |
28.6 |
-1.1 |
0.611 |
0 |
0 |
0 |
0.000 |
| Average: |
28.7 |
-1.0 |
0.686 |
0 |
0 |
0 |
0.000 |
| 69 |
284 |
|
[MRD]T:2569 |
1 |
1 |
277 |
f |
[COA]U:1854 |
x,y,z |
1_555 |
3 |
1 |
938 |
27.9 |
-0.4 |
0.355 |
0 |
0 |
0 |
0.002 |
| 70 |
285 |
|
[MRD]N:2565 |
1 |
1 |
272 |
f |
[COA]N:1333 |
x,y,z |
1_555 |
3 |
1 |
929 |
27.7 |
0.0 |
0.431 |
0 |
0 |
0 |
0.000 |
| 71 |
286 |
|
H |
4 |
2 |
7430 |
◊ |
F |
x-1,y,z |
1_455 |
2 |
2 |
7258 |
26.9 |
0.9 |
0.856 |
1 |
2 |
0 |
0.000 |
| 72 |
287 |
|
[MRD]D:2573 |
1 |
1 |
274 |
◊ |
[COA]E:387 |
x,y,z |
1_555 |
3 |
1 |
941 |
26.9 |
1.6 |
0.676 |
0 |
0 |
0 |
0.000 |
| 73 |
288 |
|
[MRD]L:2562 |
1 |
1 |
279 |
f |
[COA]J:780 |
x,y,z |
1_555 |
3 |
1 |
943 |
25.7 |
1.5 |
0.681 |
0 |
0 |
0 |
0.000 |
| 74 |
289 |
|
[ACT]T:2568 |
2 |
1 |
183 |
◊ |
S |
x,y,z |
1_555 |
3 |
1 |
7256 |
25.1 |
0.2 |
0.670 |
0 |
0 |
0 |
0.000 |
| 75 |
290 |
|
[ACT]T:2568 |
2 |
1 |
183 |
f |
[CA]T:1792 |
x,y,z |
1_555 |
1 |
1 |
85 |
23.6 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.012 |
| 76 |
291 |
|
[ACT]W:2596 |
2 |
1 |
183 |
f |
[CA]W:2548 |
x,y,z |
1_555 |
1 |
1 |
85 |
23.5 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.016 |
292 |
|
[ACT]K:629 |
3 |
1 |
183 |
f |
[CA]K:569 |
x,y,z |
1_555 |
1 |
1 |
85 |
23.0 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.016 |
293 |
|
[ACT]E:2594 |
3 |
1 |
183 |
f |
[CA]E:2554 |
x,y,z |
1_555 |
1 |
1 |
85 |
22.9 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.016 |
294 |
|
[ACT]R:2595 |
1 |
1 |
183 |
f |
[CA]R:2512 |
x,y,z |
1_555 |
1 |
1 |
85 |
22.0 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.016 |
| Average: |
22.9 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.016 |
| 77 |
295 |
|
[ACT]K:629 |
2 |
1 |
183 |
◊ |
J |
x,y,z |
1_555 |
2 |
1 |
7335 |
23.2 |
0.5 |
0.787 |
1 |
0 |
0 |
0.000 |
| 78 |
296 |
|
[ACT]T:2568 |
1 |
1 |
183 |
◊ |
[MPD]S:1697 |
x,y,z |
1_555 |
2 |
1 |
277 |
22.8 |
-1.5 |
0.700 |
0 |
0 |
0 |
0.000 |
| 79 |
297 |
|
H |
6 |
2 |
7430 |
◊ |
N |
x-1,y,z-1 |
1_454 |
5 |
2 |
7296 |
22.7 |
0.7 |
0.764 |
0 |
0 |
0 |
0.000 |
| 80 |
298 |
|
[ACT]A:2597 |
1 |
1 |
183 |
f |
[CA]A:2552 |
x,y,z |
1_555 |
1 |
1 |
85 |
21.9 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.007 |
| 81 |
299 |
|
[MRD]K:2564 |
2 |
1 |
277 |
f |
Q |
x,y,z |
1_555 |
2 |
1 |
7386 |
21.8 |
1.0 |
0.541 |
0 |
0 |
0 |
0.000 |
| 82 |
300 |
|
G |
2 |
1 |
7365 |
◊ |
U |
x,y,z-1 |
1_554 |
2 |
1 |
7352 |
21.4 |
-0.7 |
0.208 |
0 |
0 |
0 |
0.000 |
| 83 |
301 |
|
H |
2 |
1 |
7430 |
◊ |
E |
x-1,y,z |
1_455 |
2 |
1 |
7456 |
19.3 |
0.4 |
0.782 |
0 |
0 |
0 |
0.000 |
302 |
|
T |
1 |
1 |
7456 |
◊ |
C |
x-1,y,z |
1_455 |
1 |
1 |
7349 |
4.1 |
0.2 |
0.813 |
0 |
0 |
0 |
0.000 |
| Average: |
11.7 |
0.3 |
0.797 |
0 |
0 |
0 |
0.000 |
| 84 |
303 |
|
G |
3 |
1 |
7365 |
◊ |
[MPD]M:2572 |
x-1,y,z-1 |
1_454 |
1 |
1 |
276 |
18.2 |
-0.7 |
0.864 |
0 |
0 |
0 |
0.000 |
| 85 |
304 |
|
[COA]N:1333 |
1 |
1 |
929 |
◊ |
K |
-x,y-1/2,-z+1 |
2_546 |
2 |
2 |
7364 |
17.6 |
0.3 |
0.455 |
0 |
0 |
0 |
0.000 |
| 86 |
305 |
|
[CL]G:2574 |
1 |
1 |
125 |
f |
[COA]G:570 |
x,y,z |
1_555 |
1 |
1 |
940 |
13.9 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.007 |
306 |
|
[CL]L:2543 |
1 |
1 |
125 |
f |
[COA]L:1008 |
x,y,z |
1_555 |
1 |
1 |
925 |
13.8 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.007 |
307 |
|
[CL]P:2544 |
1 |
1 |
125 |
f |
[COA]P:1424 |
x,y,z |
1_555 |
1 |
1 |
943 |
13.6 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.007 |
308 |
|
[CL]A:128 |
1 |
1 |
125 |
f |
[COA]A:127 |
x,y,z |
1_555 |
1 |
1 |
933 |
13.4 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.007 |
309 |
|
[CL]J:2541 |
1 |
1 |
125 |
f |
[COA]J:780 |
x,y,z |
1_555 |
1 |
1 |
943 |
13.1 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.007 |
310 |
|
[CL]C:2558 |
1 |
1 |
125 |
f |
[COA]C:169 |
x,y,z |
1_555 |
1 |
1 |
940 |
13.0 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.007 |
311 |
|
[CL]M:2555 |
1 |
1 |
125 |
f |
[COA]O:1127 |
x,y,z |
1_555 |
1 |
1 |
936 |
13.0 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.007 |
312 |
|
[CL]E:2591 |
1 |
1 |
125 |
f |
[COA]E:387 |
x,y,z |
1_555 |
1 |
1 |
941 |
12.7 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.007 |
313 |
|
[CL]T:2592 |
1 |
1 |
125 |
f |
[COA]T:1791 |
x,y,z |
1_555 |
1 |
1 |
929 |
12.6 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.007 |
| Average: |
13.2 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.007 |
| 87 |
314 |
|
I |
1 |
1 |
7273 |
◊ |
[MPD]C:2571 |
x-1,y,z-1 |
1_454 |
2 |
1 |
278 |
13.7 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.000 |
| 88 |
315 |
|
[ACT]T:2568 |
2 |
1 |
183 |
f |
[COA]T:1791 |
x,y,z |
1_555 |
4 |
1 |
929 |
13.4 |
-0.3 |
0.536 |
0 |
0 |
0 |
0.000 |
| 89 |
316 |
|
[MRD]F:2559 |
2 |
1 |
277 |
f |
R |
x,y,z |
1_555 |
4 |
1 |
7254 |
13.4 |
0.3 |
0.449 |
0 |
0 |
0 |
0.000 |
| 90 |
317 |
|
[ACT]A:2597 |
3 |
1 |
183 |
f |
[CL]A:128 |
x,y,z |
1_555 |
1 |
1 |
125 |
12.9 |
-1.3 |
0.000 |
0 |
0 |
0 |
0.003 |
| 91 |
318 |
|
[ACT]E:2594 |
3 |
1 |
183 |
f |
[CL]E:2591 |
x,y,z |
1_555 |
1 |
1 |
125 |
12.5 |
-1.3 |
0.000 |
0 |
0 |
0 |
0.003 |
| 92 |
319 |
|
[CA]E:2519 |
1 |
1 |
85 |
◊ |
F |
x,y,z |
1_555 |
2 |
2 |
7258 |
12.1 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.000 |
320 |
|
[CA]T:2545 |
1 |
1 |
85 |
◊ |
U |
x,y,z |
1_555 |
2 |
2 |
7352 |
11.9 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.000 |
321 |
|
[CA]F:2516 |
1 |
1 |
85 |
◊ |
D |
x,y,z |
1_555 |
2 |
2 |
7425 |
11.9 |
-1.6 |
0.000 |
0 |
0 |
0 |
0.000 |
322 |
|
[CA]M:2533 |
1 |
1 |
85 |
◊ |
N |
x,y,z |
1_555 |
2 |
2 |
7296 |
11.8 |
-1.6 |
0.000 |
0 |
0 |
0 |
0.000 |
323 |
|
[CA]L:2526 |
1 |
1 |
85 |
◊ |
J |
x,y,z |
1_555 |
2 |
2 |
7335 |
11.8 |
-1.6 |
0.000 |
0 |
0 |
0 |
0.000 |
324 |
|
[CA]O:2531 |
1 |
1 |
85 |
◊ |
M |
x,y,z |
1_555 |
2 |
2 |
7396 |
11.6 |
-1.6 |
0.000 |
0 |
0 |
0 |
0.000 |
325 |
|
[CA]D:2517 |
1 |
1 |
85 |
◊ |
E |
x,y,z |
1_555 |
2 |
2 |
7456 |
11.5 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.000 |
326 |
|
[CA]J:2527 |
1 |
1 |
85 |
◊ |
K |
x,y,z |
1_555 |
2 |
2 |
7364 |
11.5 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.000 |
327 |
|
[CA]X:2556 |
1 |
1 |
85 |
◊ |
V |
x,y,z |
1_555 |
2 |
2 |
7291 |
11.4 |
-1.6 |
0.000 |
0 |
0 |
0 |
0.000 |
328 |
|
[CA]C:2513 |
1 |
1 |
85 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
7365 |
11.4 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.000 |
329 |
|
[CA]I:2521 |
1 |
1 |
85 |
◊ |
G |
x,y,z |
1_555 |
2 |
2 |
7365 |
11.3 |
-1.6 |
0.000 |
0 |
0 |
0 |
0.000 |
330 |
|
[CA]U:2537 |
1 |
1 |
85 |
◊ |
S |
x,y,z |
1_555 |
2 |
2 |
7256 |
11.3 |
-1.6 |
0.000 |
0 |
0 |
0 |
0.000 |
331 |
|
[CA]H:2524 |
1 |
1 |
85 |
◊ |
I |
x,y,z |
1_555 |
2 |
2 |
7273 |
11.2 |
-1.6 |
0.000 |
0 |
0 |
0 |
0.000 |
332 |
|
[CA]B:2515 |
1 |
1 |
85 |
◊ |
C |
x,y,z |
1_555 |
2 |
2 |
7349 |
11.2 |
-1.6 |
0.000 |
0 |
0 |
0 |
0.000 |
333 |
|
[CA]P:1426 |
1 |
1 |
85 |
◊ |
Q |
x,y,z |
1_555 |
2 |
2 |
7386 |
11.2 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.000 |
334 |
|
[CA]Q:2536 |
1 |
1 |
85 |
◊ |
R |
x,y,z |
1_555 |
2 |
2 |
7254 |
11.2 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.000 |
335 |
|
[CA]K:2529 |
1 |
1 |
85 |
◊ |
L |
x,y,z |
1_555 |
2 |
2 |
7318 |
11.1 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.000 |
336 |
|
[CA]R:1607 |
1 |
1 |
85 |
◊ |
P |
x,y,z |
1_555 |
2 |
2 |
7295 |
11.1 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.000 |
337 |
|
[CA]V:2547 |
1 |
1 |
85 |
◊ |
W |
x,y,z |
1_555 |
2 |
2 |
7296 |
10.9 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.000 |
338 |
|
[CA]S:2539 |
1 |
1 |
85 |
◊ |
T |
x,y,z |
1_555 |
2 |
2 |
7456 |
10.7 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.000 |
339 |
|
[CA]A:2514 |
1 |
1 |
85 |
◊ |
B |
x,y,z |
1_555 |
2 |
2 |
7445 |
10.6 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.000 |
340 |
|
[CA]G:2523 |
1 |
1 |
85 |
◊ |
H |
x,y,z |
1_555 |
2 |
2 |
7430 |
10.4 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.000 |
341 |
|
[CA]W:2549 |
1 |
1 |
85 |
◊ |
X |
x,y,z |
1_555 |
2 |
2 |
7363 |
10.4 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.000 |
| Average: |
11.3 |
-1.6 |
0.000 |
0 |
0 |
0 |
0.000 |
| 93 |
342 |
|
[MPD]S:1697 |
3 |
1 |
277 |
◊ |
T |
x,y,z |
1_555 |
2 |
1 |
7456 |
11.4 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.000 |
| 94 |
343 |
|
[ACT]K:629 |
1 |
1 |
183 |
f |
[COA]K:900 |
x,y,z |
1_555 |
3 |
1 |
930 |
10.3 |
-0.1 |
0.435 |
0 |
0 |
0 |
0.000 |
| 95 |
344 |
|
G |
2 |
1 |
7365 |
◊ |
C |
x-1,y,z-1 |
1_454 |
1 |
1 |
7349 |
7.5 |
0.3 |
0.798 |
0 |
0 |
0 |
0.000 |
345 |
|
R |
1 |
1 |
7254 |
◊ |
K |
x,y,z |
1_555 |
1 |
1 |
7364 |
1.0 |
0.0 |
0.722 |
0 |
0 |
0 |
0.000 |
| Average: |
4.2 |
0.2 |
0.760 |
0 |
0 |
0 |
0.000 |
| 96 |
346 |
|
[ACT]K:2563 |
1 |
1 |
182 |
f |
V |
x,y,z |
1_555 |
3 |
1 |
7291 |
6.5 |
-0.0 |
0.576 |
0 |
0 |
0 |
0.000 |
| 97 |
347 |
|
[CA]X:2556 |
1 |
1 |
85 |
◊ |
[CA]V:2557 |
x,y,z |
1_555 |
1 |
1 |
85 |
2.6 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.000 |
| 98 |
348 |
|
[CA]C:2513 |
1 |
1 |
85 |
◊ |
[CA]A:2552 |
x,y,z |
1_555 |
1 |
1 |
85 |
2.4 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.000 |
| 99 |
349 |
|
[CA]F:2518 |
1 |
1 |
85 |
◊ |
[CA]E:2519 |
x,y,z |
1_555 |
1 |
1 |
85 |
2.4 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.000 |
| 100 |
350 |
|
[CA]N:2532 |
1 |
1 |
85 |
◊ |
[CA]M:2533 |
x,y,z |
1_555 |
1 |
1 |
85 |
1.9 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.000 |
| 101 |
351 |
|
[CA]X:2550 |
1 |
1 |
85 |
◊ |
[CA]W:2549 |
x,y,z |
1_555 |
1 |
1 |
85 |
1.9 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.000 |
| 102 |
352 |
|
[CA]F:2516 |
1 |
1 |
85 |
◊ |
[CA]D:2540 |
x,y,z |
1_555 |
1 |
1 |
85 |
1.8 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.000 |
| 103 |
353 |
|
[CA]B:2551 |
1 |
1 |
85 |
◊ |
[CA]A:2514 |
x,y,z |
1_555 |
1 |
1 |
85 |
1.7 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.000 |
| 104 |
354 |
|
[CA]K:569 |
1 |
1 |
85 |
◊ |
[CA]J:2527 |
x,y,z |
1_555 |
1 |
1 |
85 |
1.6 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.000 |
| 105 |
355 |
|
[CA]L:2528 |
1 |
1 |
85 |
◊ |
[CA]K:2529 |
x,y,z |
1_555 |
1 |
1 |
85 |
1.6 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.000 |
| 106 |
356 |
|
[CA]R:1607 |
1 |
1 |
85 |
◊ |
[CA]P:2534 |
x,y,z |
1_555 |
1 |
1 |
85 |
1.5 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.000 |
| 107 |
357 |
|
[CA]H:2522 |
1 |
1 |
85 |
◊ |
[CA]G:2523 |
x,y,z |
1_555 |
1 |
1 |
85 |
1.5 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.000 |
| 108 |
358 |
|
[CA]Q:2535 |
1 |
1 |
85 |
◊ |
[CA]P:1426 |
x,y,z |
1_555 |
1 |
1 |
85 |
1.5 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.000 |
| 109 |
359 |
|
[CA]U:2546 |
1 |
1 |
85 |
◊ |
[CA]T:2545 |
x,y,z |
1_555 |
1 |
1 |
85 |
1.5 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.000 |
| 110 |
360 |
|
[CA]C:2553 |
1 |
1 |
85 |
◊ |
[CA]B:2515 |
x,y,z |
1_555 |
1 |
1 |
85 |
1.5 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.000 |
| 111 |
361 |
|
[CA]O:2531 |
1 |
1 |
85 |
◊ |
[CA]M:2530 |
x,y,z |
1_555 |
1 |
1 |
85 |
1.4 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.000 |
| 112 |
362 |
|
[CA]E:2554 |
1 |
1 |
85 |
◊ |
[CA]D:2517 |
x,y,z |
1_555 |
1 |
1 |
85 |
1.3 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.000 |
| 113 |
363 |
|
[CA]R:2512 |
1 |
1 |
85 |
◊ |
[CA]Q:2536 |
x,y,z |
1_555 |
1 |
1 |
85 |
1.3 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.000 |
| 114 |
364 |
|
[CA]W:2548 |
1 |
1 |
85 |
◊ |
[CA]V:2547 |
x,y,z |
1_555 |
1 |
1 |
85 |
1.2 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.000 |
| 115 |
365 |
|
[CA]I:2521 |
1 |
1 |
85 |
◊ |
[CA]G:2520 |
x,y,z |
1_555 |
1 |
1 |
85 |
1.2 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.000 |
| 116 |
366 |
|
[CA]T:1792 |
1 |
1 |
85 |
◊ |
[CA]S:2539 |
x,y,z |
1_555 |
1 |
1 |
85 |
1.2 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.000 |
| 117 |
367 |
|
[CA]U:2537 |
1 |
1 |
85 |
◊ |
[CA]S:2538 |
x,y,z |
1_555 |
1 |
1 |
85 |
1.1 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.000 |
| 118 |
368 |
|
[CA]I:2525 |
1 |
1 |
85 |
◊ |
[CA]H:2524 |
x,y,z |
1_555 |
1 |
1 |
85 |
1.0 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.000 |
| 119 |
369 |
|
[CA]L:2526 |
1 |
1 |
85 |
◊ |
[CA]J:2542 |
x,y,z |
1_555 |
1 |
1 |
85 |
1.0 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.000 |
| 120 |
370 |
|
[CA]H:2522 |
1 |
1 |
85 |
◊ |
G |
x,y,z |
1_555 |
1 |
1 |
7365 |
0.3 |
-0.0 |
0.000 |
0 |
0 |
0 |
0.000 |
|