## |
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 |
|
L |
188 |
55 |
11804 |
◊ |
H |
x,y,z |
1_555 |
189 |
53 |
11600 |
1697.1 |
-23.8 |
0.057 |
16 |
1 |
0 |
1.000 |
2 |
|
B |
189 |
54 |
11596 |
◊ |
A |
x,y,z |
1_555 |
188 |
51 |
11674 |
1686.4 |
-22.4 |
0.070 |
16 |
2 |
0 |
1.000 |
Average: |
1691.8 |
-23.1 |
0.064 |
16 |
2 |
0 |
1.000 |
2 |
3 |
|
D |
34 |
13 |
7980 |
◊ |
H |
x,y,z |
1_555 |
35 |
11 |
11600 |
350.7 |
-1.5 |
0.571 |
6 |
7 |
0 |
0.000 |
4 |
|
C |
31 |
11 |
8107 |
◊ |
A |
x,y,z |
1_555 |
36 |
10 |
11674 |
336.5 |
-1.0 |
0.598 |
7 |
7 |
0 |
0.000 |
Average: |
343.6 |
-1.2 |
0.584 |
7 |
7 |
0 |
0.000 |
3 |
5 |
|
A |
36 |
10 |
11674 |
◊ |
H |
-x,y-1/2,-z+1/2 |
3_545 |
38 |
11 |
11600 |
335.1 |
0.5 |
0.811 |
10 |
0 |
0 |
0.000 |
4 |
6 |
|
B |
38 |
12 |
11596 |
◊ |
D |
x-1/2,-y-1/2,-z |
4_445 |
37 |
9 |
7980 |
334.8 |
0.8 |
0.756 |
4 |
0 |
0 |
0.000 |
5 |
7 |
|
D |
27 |
8 |
7980 |
◊ |
C |
x,y-1,z |
1_545 |
28 |
9 |
8107 |
283.9 |
-0.6 |
0.655 |
1 |
1 |
0 |
0.000 |
6 |
8 |
|
H |
32 |
11 |
11600 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
33 |
11 |
11674 |
262.8 |
-1.7 |
0.553 |
9 |
0 |
0 |
0.000 |
7 |
9 |
|
L |
24 |
9 |
11804 |
◊ |
B |
x,y,z |
1_555 |
26 |
10 |
11596 |
260.5 |
-0.8 |
0.575 |
4 |
4 |
0 |
0.000 |
8 |
10 |
|
D |
29 |
10 |
7980 |
◊ |
L |
x,y,z |
1_555 |
24 |
6 |
11804 |
255.0 |
-1.9 |
0.335 |
4 |
0 |
0 |
0.000 |
11 |
|
C |
28 |
10 |
8107 |
◊ |
B |
x,y,z |
1_555 |
23 |
5 |
11596 |
253.0 |
-2.9 |
0.267 |
4 |
0 |
0 |
0.000 |
Average: |
254.0 |
-2.4 |
0.301 |
4 |
0 |
0 |
0.000 |
9 |
12 |
|
C |
18 |
8 |
8107 |
◊ |
L |
-x+1/2,-y+1,z-1/2 |
2_564 |
22 |
5 |
11804 |
199.5 |
-0.3 |
0.422 |
5 |
1 |
0 |
0.000 |
10 |
13 |
|
[NAG]D:303 |
12 |
1 |
361 |
cf |
D |
x,y,z |
1_555 |
21 |
14 |
7980 |
177.1 |
4.4 |
0.459 |
2 |
0 |
0 |
0.000 |
14 |
|
[NAG]C:302 |
12 |
1 |
361 |
cf |
C |
x,y,z |
1_555 |
21 |
14 |
8107 |
175.9 |
4.2 |
0.461 |
2 |
0 |
0 |
0.000 |
Average: |
176.5 |
4.3 |
0.460 |
2 |
0 |
0 |
0.000 |
11 |
15 |
|
[NAG]D:302 |
13 |
1 |
365 |
cf |
D |
x,y,z |
1_555 |
18 |
5 |
7980 |
138.1 |
3.3 |
0.331 |
2 |
0 |
0 |
0.000 |
12 |
16 |
|
[NAG]C:301 |
12 |
1 |
362 |
cf |
C |
x,y,z |
1_555 |
16 |
4 |
8107 |
136.6 |
3.3 |
0.367 |
2 |
0 |
0 |
0.000 |
13 |
17 |
|
L |
18 |
8 |
11804 |
x |
L |
-x+1,y-1/2,-z+1/2 |
3_645 |
15 |
5 |
11804 |
128.9 |
-0.2 |
0.582 |
2 |
0 |
0 |
0.000 |
14 |
18 |
|
H |
17 |
6 |
11600 |
◊ |
C |
-x,y-1/2,-z+1/2 |
3_545 |
15 |
5 |
8107 |
127.5 |
-1.5 |
0.439 |
1 |
0 |
0 |
0.000 |
15 |
19 |
|
D |
16 |
6 |
7980 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
15 |
6 |
11674 |
121.2 |
-0.9 |
0.486 |
0 |
0 |
0 |
0.000 |
16 |
20 |
|
[GOL]H:301 |
6 |
1 |
219 |
f |
H |
x,y,z |
1_555 |
18 |
8 |
11600 |
119.8 |
-0.0 |
0.597 |
3 |
0 |
0 |
0.356 |
17 |
21 |
|
[GOL]A:301 |
6 |
1 |
221 |
f |
A |
x,y,z |
1_555 |
19 |
8 |
11674 |
119.0 |
0.4 |
0.674 |
5 |
0 |
0 |
0.063 |
18 |
22 |
|
A |
15 |
7 |
11674 |
◊ |
L |
-x,y-1/2,-z+1/2 |
3_545 |
11 |
3 |
11804 |
117.5 |
-1.3 |
0.414 |
0 |
0 |
0 |
0.000 |
23 |
|
B |
10 |
2 |
11596 |
◊ |
H |
-x,y-1/2,-z+1/2 |
3_545 |
13 |
6 |
11600 |
100.7 |
-1.6 |
0.339 |
0 |
0 |
0 |
0.000 |
Average: |
109.1 |
-1.4 |
0.377 |
0 |
0 |
0 |
0.000 |
19 |
24 |
|
[GOL]A:302 |
6 |
1 |
221 |
f |
A |
x,y,z |
1_555 |
13 |
5 |
11674 |
106.7 |
-0.1 |
0.612 |
3 |
0 |
0 |
0.048 |
20 |
25 |
|
H |
14 |
5 |
11600 |
f |
[GOL]C:308 |
-x,y-1/2,-z+1/2 |
3_545 |
6 |
1 |
219 |
106.0 |
-0.2 |
0.573 |
3 |
0 |
0 |
0.401 |
21 |
26 |
|
[GOL]B:301 |
6 |
1 |
221 |
f |
B |
x,y,z |
1_555 |
18 |
6 |
11596 |
104.5 |
-0.3 |
0.526 |
2 |
0 |
0 |
0.032 |
22 |
27 |
|
[MAN]D:307 |
7 |
1 |
293 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
16 |
6 |
11674 |
103.6 |
1.1 |
0.334 |
3 |
0 |
0 |
0.000 |
23 |
28 |
|
[GOL]L:302 |
6 |
1 |
220 |
f |
L |
x,y,z |
1_555 |
16 |
6 |
11804 |
99.2 |
0.3 |
0.636 |
2 |
0 |
0 |
0.021 |
24 |
29 |
|
[IPA]H:304 |
4 |
1 |
199 |
f |
H |
x,y,z |
1_555 |
16 |
7 |
11600 |
98.8 |
2.9 |
0.284 |
1 |
0 |
0 |
0.000 |
25 |
30 |
|
[NAG]D:301 |
7 |
1 |
364 |
cf |
D |
x,y,z |
1_555 |
14 |
6 |
7980 |
97.4 |
3.5 |
0.609 |
0 |
0 |
0 |
0.000 |
26 |
31 |
|
[IPA]H:303 |
4 |
1 |
200 |
f |
H |
x,y,z |
1_555 |
17 |
5 |
11600 |
96.8 |
2.5 |
0.252 |
2 |
0 |
0 |
0.000 |
32 |
|
[IPA]A:304 |
4 |
1 |
198 |
f |
A |
x,y,z |
1_555 |
19 |
5 |
11674 |
96.5 |
2.5 |
0.252 |
2 |
0 |
0 |
0.000 |
Average: |
96.7 |
2.5 |
0.252 |
2 |
0 |
0 |
0.000 |
27 |
33 |
|
[MAN]D:310 |
8 |
1 |
293 |
◊ |
A |
x,y,z |
1_555 |
16 |
5 |
11674 |
94.1 |
0.7 |
0.265 |
1 |
0 |
0 |
0.000 |
28 |
34 |
|
[IPA]A:305 |
4 |
1 |
198 |
◊ |
A |
x,y,z |
1_555 |
14 |
7 |
11674 |
93.6 |
3.6 |
0.305 |
1 |
0 |
0 |
0.000 |
29 |
35 |
|
[GOL]L:301 |
6 |
1 |
219 |
f |
L |
x,y,z |
1_555 |
13 |
5 |
11804 |
91.6 |
-0.7 |
0.475 |
2 |
0 |
0 |
0.060 |
30 |
36 |
|
[GOL]B:303 |
6 |
1 |
221 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
11596 |
91.6 |
-0.4 |
0.507 |
2 |
0 |
0 |
0.034 |
31 |
37 |
|
[IPA]L:303 |
3 |
1 |
198 |
f |
L |
x,y,z |
1_555 |
11 |
5 |
11804 |
91.1 |
3.9 |
0.588 |
0 |
0 |
0 |
0.000 |
32 |
38 |
|
[GOL]B:302 |
5 |
1 |
220 |
◊ |
A |
x,y,z |
1_555 |
14 |
8 |
11674 |
89.7 |
-1.0 |
0.428 |
1 |
0 |
0 |
0.040 |
33 |
39 |
|
[IPA]H:305 |
4 |
1 |
198 |
◊ |
H |
x,y,z |
1_555 |
12 |
5 |
11600 |
88.0 |
2.9 |
0.310 |
2 |
0 |
0 |
0.000 |
34 |
40 |
|
[GOL]B:302 |
6 |
1 |
220 |
f |
B |
x,y,z |
1_555 |
14 |
5 |
11596 |
86.9 |
-0.4 |
0.509 |
5 |
0 |
0 |
0.071 |
35 |
41 |
|
[MAN]D:311 |
8 |
1 |
293 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
12 |
6 |
11674 |
83.0 |
0.3 |
0.216 |
1 |
0 |
0 |
0.000 |
36 |
42 |
|
[GOL]H:302 |
5 |
1 |
219 |
◊ |
H |
x,y,z |
1_555 |
13 |
6 |
11600 |
71.3 |
-0.2 |
0.565 |
3 |
0 |
0 |
0.000 |
37 |
43 |
|
D |
9 |
4 |
7980 |
◊ |
L |
-x+1,y-1/2,-z+1/2 |
3_645 |
8 |
3 |
11804 |
69.7 |
0.3 |
0.643 |
0 |
0 |
0 |
0.000 |
38 |
44 |
|
A |
10 |
6 |
11674 |
f |
[GOL]H:302 |
-x,y-1/2,-z+1/2 |
3_545 |
6 |
1 |
219 |
69.0 |
-0.4 |
0.491 |
2 |
0 |
0 |
0.043 |
39 |
45 |
|
[GOL]A:303 |
5 |
1 |
219 |
◊ |
A |
x,y,z |
1_555 |
13 |
6 |
11674 |
67.3 |
0.0 |
0.628 |
3 |
0 |
0 |
0.000 |
40 |
46 |
|
[GOL]A:303 |
5 |
1 |
219 |
f |
H |
-x,y-1/2,-z+1/2 |
3_545 |
9 |
6 |
11600 |
65.2 |
-0.8 |
0.409 |
2 |
0 |
0 |
0.435 |
41 |
47 |
|
[NAG]C:303 |
9 |
1 |
367 |
cf |
[NAG]C:302 |
x,y,z |
1_555 |
7 |
1 |
361 |
64.2 |
0.9 |
0.065 |
0 |
0 |
0 |
0.000 |
42 |
48 |
|
[MAN]D:310 |
7 |
1 |
293 |
cf |
[MAN]D:309 |
x,y,z |
1_555 |
7 |
1 |
292 |
63.7 |
2.5 |
0.151 |
0 |
0 |
0 |
0.000 |
43 |
49 |
|
[NAG]D:304 |
9 |
1 |
368 |
cf |
[NAG]D:303 |
x,y,z |
1_555 |
6 |
1 |
361 |
63.3 |
1.1 |
0.078 |
0 |
0 |
0 |
0.000 |
44 |
50 |
|
[GOL]B:303 |
5 |
1 |
221 |
◊ |
A |
x,y,z |
1_555 |
12 |
5 |
11674 |
61.9 |
-0.3 |
0.606 |
2 |
0 |
0 |
0.031 |
45 |
51 |
|
[MAN]D:309 |
7 |
1 |
292 |
cf |
[BMA]D:305 |
x,y,z |
1_555 |
6 |
1 |
292 |
61.0 |
2.8 |
0.196 |
0 |
0 |
0 |
0.000 |
46 |
52 |
|
[NAG]D:304 |
5 |
1 |
368 |
f |
D |
x,y,z |
1_555 |
8 |
3 |
7980 |
60.9 |
1.6 |
0.481 |
0 |
0 |
0 |
0.000 |
53 |
|
[NAG]C:303 |
5 |
1 |
367 |
f |
C |
x,y,z |
1_555 |
5 |
4 |
8107 |
38.9 |
0.9 |
0.313 |
0 |
0 |
0 |
0.000 |
Average: |
49.9 |
1.3 |
0.397 |
0 |
0 |
0 |
0.000 |
47 |
54 |
|
[BMA]D:305 |
7 |
1 |
292 |
cf |
[NAG]D:304 |
x,y,z |
1_555 |
5 |
1 |
368 |
60.5 |
1.0 |
0.106 |
0 |
0 |
0 |
0.000 |
55 |
|
[BMA]C:304 |
6 |
1 |
292 |
cf |
[NAG]C:303 |
x,y,z |
1_555 |
6 |
1 |
367 |
59.5 |
1.1 |
0.118 |
0 |
0 |
0 |
0.000 |
Average: |
60.0 |
1.0 |
0.112 |
0 |
0 |
0 |
0.000 |
48 |
56 |
|
[MAN]C:307 |
7 |
1 |
294 |
cf |
[BMA]C:304 |
x,y,z |
1_555 |
6 |
1 |
292 |
59.2 |
2.6 |
0.190 |
0 |
0 |
0 |
0.000 |
49 |
57 |
|
[MAN]D:308 |
6 |
1 |
292 |
cf |
[MAN]D:307 |
x,y,z |
1_555 |
6 |
1 |
293 |
58.7 |
2.4 |
0.211 |
0 |
0 |
0 |
0.000 |
50 |
58 |
|
[MAN]D:306 |
7 |
1 |
290 |
cf |
[BMA]D:305 |
x,y,z |
1_555 |
5 |
1 |
292 |
58.4 |
2.6 |
0.223 |
0 |
0 |
0 |
0.000 |
51 |
59 |
|
[MAN]D:307 |
6 |
1 |
293 |
cf |
[MAN]D:306 |
x,y,z |
1_555 |
5 |
1 |
290 |
58.1 |
2.5 |
0.251 |
0 |
0 |
0 |
0.000 |
52 |
60 |
|
[GOL]L:301 |
4 |
1 |
219 |
◊ |
H |
x,y,z |
1_555 |
10 |
4 |
11600 |
56.4 |
-0.2 |
0.604 |
1 |
0 |
0 |
0.023 |
53 |
61 |
|
[MAN]C:306 |
6 |
1 |
293 |
cf |
[MAN]C:305 |
x,y,z |
1_555 |
6 |
1 |
295 |
55.8 |
2.4 |
0.196 |
0 |
0 |
0 |
0.000 |
54 |
62 |
|
[MAN]D:311 |
5 |
1 |
293 |
cf |
[MAN]D:306 |
x,y,z |
1_555 |
6 |
1 |
290 |
55.3 |
2.2 |
0.230 |
0 |
0 |
0 |
0.000 |
55 |
63 |
|
[GOL]L:302 |
4 |
1 |
220 |
◊ |
D |
x,y,z |
1_555 |
6 |
3 |
7980 |
54.1 |
-0.6 |
0.446 |
0 |
0 |
0 |
0.000 |
56 |
64 |
|
[MAN]D:308 |
4 |
1 |
292 |
◊ |
H |
x,y,z |
1_555 |
10 |
4 |
11600 |
54.1 |
1.2 |
0.496 |
0 |
0 |
0 |
0.000 |
57 |
65 |
|
[MAN]C:305 |
6 |
1 |
295 |
cf |
[BMA]C:304 |
x,y,z |
1_555 |
6 |
1 |
292 |
52.7 |
2.4 |
0.202 |
0 |
0 |
0 |
0.000 |
58 |
66 |
|
[MAN]D:308 |
6 |
1 |
292 |
◊ |
[MAN]C:305 |
-x,y-1/2,-z+1/2 |
3_545 |
6 |
1 |
295 |
49.0 |
1.2 |
0.134 |
1 |
0 |
0 |
0.000 |
59 |
67 |
|
[NAG]D:304 |
4 |
1 |
368 |
◊ |
H |
x,y,z |
1_555 |
8 |
3 |
11600 |
46.6 |
1.1 |
0.465 |
0 |
0 |
0 |
0.000 |
60 |
68 |
|
[GOL]B:301 |
5 |
1 |
221 |
◊ |
C |
x,y,z |
1_555 |
5 |
2 |
8107 |
46.4 |
-0.1 |
0.488 |
1 |
0 |
0 |
0.000 |
61 |
69 |
|
[MAN]D:308 |
6 |
1 |
292 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
6 |
3 |
11674 |
43.5 |
0.9 |
0.315 |
0 |
0 |
0 |
0.000 |
62 |
70 |
|
B |
6 |
3 |
11596 |
◊ |
[NAG]D:301 |
x-1/2,-y-1/2,-z |
4_445 |
5 |
1 |
364 |
43.0 |
0.7 |
0.322 |
0 |
0 |
0 |
0.000 |
63 |
71 |
|
[GOL]C:308 |
3 |
1 |
219 |
◊ |
C |
x,y,z |
1_555 |
5 |
2 |
8107 |
40.7 |
-0.1 |
0.556 |
1 |
0 |
0 |
0.000 |
64 |
72 |
|
H |
3 |
2 |
11600 |
◊ |
[MAN]C:306 |
-x,y-1/2,-z+1/2 |
3_545 |
6 |
1 |
293 |
40.2 |
-0.2 |
0.136 |
0 |
0 |
0 |
0.000 |
65 |
73 |
|
B |
3 |
1 |
11596 |
◊ |
H |
-x+1/2,-y,z-1/2 |
2_554 |
6 |
4 |
11600 |
39.6 |
-1.2 |
0.188 |
0 |
0 |
0 |
0.000 |
66 |
74 |
|
[MAN]C:306 |
2 |
1 |
293 |
f |
C |
x,y,z |
1_555 |
5 |
2 |
8107 |
37.4 |
0.5 |
0.474 |
1 |
0 |
0 |
0.000 |
67 |
75 |
|
[MAN]C:307 |
6 |
1 |
294 |
◊ |
H |
x,y,z |
1_555 |
9 |
3 |
11600 |
37.4 |
0.8 |
0.321 |
0 |
0 |
0 |
0.000 |
68 |
76 |
|
[GOL]A:303 |
3 |
1 |
219 |
◊ |
[GOL]H:302 |
-x,y-1/2,-z+1/2 |
3_545 |
4 |
1 |
219 |
35.3 |
-0.1 |
0.508 |
0 |
0 |
0 |
0.000 |
69 |
77 |
|
D |
3 |
1 |
7980 |
◊ |
[GOL]A:302 |
-x,y-1/2,-z+1/2 |
3_545 |
2 |
1 |
221 |
35.3 |
0.0 |
0.633 |
1 |
0 |
0 |
0.000 |
70 |
78 |
|
D |
5 |
3 |
7980 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
11674 |
32.8 |
-0.7 |
0.382 |
0 |
0 |
0 |
0.000 |
71 |
79 |
|
[MAN]D:308 |
4 |
1 |
292 |
◊ |
[BMA]C:304 |
-x,y-1/2,-z+1/2 |
3_545 |
2 |
1 |
292 |
32.5 |
1.0 |
0.267 |
0 |
0 |
0 |
0.000 |
72 |
80 |
|
[GOL]B:301 |
2 |
1 |
221 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
11674 |
32.3 |
0.3 |
0.671 |
1 |
0 |
0 |
0.005 |
73 |
81 |
|
H |
4 |
2 |
11600 |
◊ |
[NAG]C:303 |
-x,y-1/2,-z+1/2 |
3_545 |
1 |
1 |
367 |
32.0 |
1.0 |
0.625 |
0 |
0 |
0 |
0.000 |
74 |
82 |
|
[BMA]D:305 |
3 |
1 |
292 |
◊ |
H |
x,y,z |
1_555 |
3 |
1 |
11600 |
32.0 |
1.0 |
0.460 |
0 |
0 |
0 |
0.000 |
75 |
83 |
|
[MAN]D:306 |
3 |
1 |
290 |
◊ |
H |
x,y,z |
1_555 |
3 |
2 |
11600 |
30.3 |
0.2 |
0.324 |
0 |
0 |
0 |
0.000 |
76 |
84 |
|
[MAN]D:306 |
3 |
1 |
290 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
4 |
3 |
11674 |
29.5 |
0.7 |
0.484 |
0 |
0 |
0 |
0.000 |
77 |
85 |
|
[GOL]A:303 |
3 |
1 |
219 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
11596 |
28.5 |
0.5 |
0.743 |
1 |
0 |
0 |
0.000 |
78 |
86 |
|
[MAN]D:310 |
4 |
1 |
293 |
f |
[BMA]D:305 |
x,y,z |
1_555 |
3 |
1 |
292 |
26.4 |
1.0 |
0.239 |
0 |
0 |
0 |
0.000 |
79 |
87 |
|
[MAN]D:311 |
2 |
1 |
293 |
f |
D |
x,y,z |
1_555 |
4 |
3 |
7980 |
26.0 |
0.5 |
0.479 |
0 |
0 |
0 |
0.000 |
80 |
88 |
|
[MAN]D:308 |
4 |
1 |
292 |
f |
[MAN]D:306 |
x,y,z |
1_555 |
2 |
1 |
290 |
24.0 |
1.1 |
0.239 |
0 |
0 |
0 |
0.000 |
81 |
89 |
|
[MAN]D:311 |
2 |
1 |
293 |
f |
[BMA]D:305 |
x,y,z |
1_555 |
3 |
1 |
292 |
23.7 |
1.1 |
0.331 |
0 |
0 |
0 |
0.000 |
82 |
90 |
|
A |
4 |
1 |
11674 |
◊ |
C |
x,y-1,z |
1_545 |
3 |
1 |
8107 |
22.6 |
0.8 |
0.772 |
0 |
0 |
0 |
0.000 |
83 |
91 |
|
[GOL]C:308 |
2 |
1 |
219 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
11674 |
22.0 |
-0.2 |
0.548 |
0 |
0 |
0 |
0.000 |
92 |
|
H |
2 |
1 |
11600 |
◊ |
[GOL]A:302 |
-x,y-1/2,-z+1/2 |
3_545 |
2 |
1 |
221 |
21.2 |
-0.4 |
0.485 |
0 |
0 |
0 |
0.000 |
Average: |
21.6 |
-0.3 |
0.516 |
0 |
0 |
0 |
0.000 |
84 |
93 |
|
[MAN]D:308 |
2 |
1 |
292 |
◊ |
[NAG]C:303 |
-x,y-1/2,-z+1/2 |
3_545 |
3 |
1 |
367 |
21.0 |
0.5 |
0.242 |
0 |
0 |
0 |
0.000 |
85 |
94 |
|
[GOL]L:302 |
2 |
1 |
220 |
◊ |
H |
x,y,z |
1_555 |
3 |
2 |
11600 |
19.0 |
0.5 |
0.765 |
0 |
0 |
0 |
0.000 |
86 |
95 |
|
[MAN]D:309 |
3 |
1 |
292 |
f |
[NAG]D:304 |
x,y,z |
1_555 |
3 |
1 |
368 |
18.6 |
0.4 |
0.212 |
0 |
0 |
0 |
0.000 |
87 |
96 |
|
A |
3 |
2 |
11674 |
◊ |
C |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
8107 |
17.3 |
-0.2 |
0.312 |
0 |
0 |
0 |
0.000 |
88 |
97 |
|
[IPA]H:305 |
2 |
1 |
198 |
f |
L |
x,y,z |
1_555 |
3 |
1 |
11804 |
15.4 |
0.6 |
0.825 |
0 |
0 |
0 |
0.000 |
89 |
98 |
|
[IPA]A:305 |
2 |
1 |
198 |
f |
B |
x,y,z |
1_555 |
3 |
1 |
11596 |
15.0 |
0.4 |
0.794 |
0 |
0 |
0 |
0.000 |
90 |
99 |
|
H |
3 |
2 |
11600 |
◊ |
[MAN]C:305 |
-x,y-1/2,-z+1/2 |
3_545 |
3 |
1 |
295 |
14.6 |
0.5 |
0.404 |
0 |
0 |
0 |
0.000 |
91 |
100 |
|
[MAN]D:306 |
2 |
1 |
290 |
f |
[NAG]D:304 |
x,y,z |
1_555 |
2 |
1 |
368 |
14.0 |
0.6 |
0.232 |
0 |
0 |
0 |
0.000 |
101 |
|
[MAN]C:305 |
2 |
1 |
295 |
f |
[NAG]C:303 |
x,y,z |
1_555 |
2 |
1 |
367 |
9.5 |
0.4 |
0.232 |
0 |
0 |
0 |
0.000 |
Average: |
11.8 |
0.5 |
0.232 |
0 |
0 |
0 |
0.000 |
92 |
102 |
|
[MAN]C:306 |
2 |
1 |
293 |
f |
[BMA]C:304 |
x,y,z |
1_555 |
2 |
1 |
292 |
13.5 |
0.6 |
0.264 |
0 |
0 |
0 |
0.000 |
93 |
103 |
|
[NAG]C:303 |
3 |
1 |
367 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
11674 |
11.8 |
0.3 |
0.412 |
0 |
0 |
0 |
0.000 |
94 |
104 |
|
[MAN]C:307 |
3 |
1 |
294 |
f |
[NAG]C:303 |
x,y,z |
1_555 |
3 |
1 |
367 |
10.0 |
0.3 |
0.218 |
0 |
0 |
0 |
0.000 |
95 |
105 |
|
[NAG]D:304 |
1 |
1 |
368 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
1 |
1 |
11674 |
9.2 |
0.2 |
0.426 |
0 |
0 |
0 |
0.000 |
96 |
106 |
|
[GOL]H:302 |
1 |
1 |
219 |
◊ |
L |
x,y,z |
1_555 |
1 |
1 |
11804 |
6.2 |
-0.0 |
0.375 |
0 |
0 |
0 |
0.000 |
97 |
107 |
|
B |
1 |
1 |
11596 |
◊ |
C |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
8107 |
5.7 |
0.0 |
0.501 |
0 |
0 |
0 |
0.000 |
98 |
108 |
|
[NAG]D:303 |
1 |
1 |
361 |
◊ |
H |
x,y,z |
1_555 |
1 |
1 |
11600 |
4.6 |
0.1 |
0.321 |
0 |
0 |
0 |
0.000 |
99 |
109 |
|
C |
2 |
2 |
8107 |
◊ |
H |
x,y,z |
1_555 |
2 |
2 |
11600 |
3.8 |
-0.1 |
0.537 |
0 |
0 |
0 |
0.000 |
100 |
110 |
|
[MAN]D:307 |
1 |
1 |
293 |
◊ |
H |
x,y,z |
1_555 |
2 |
2 |
11600 |
2.6 |
0.0 |
0.343 |
0 |
0 |
0 |
0.000 |
101 |
111 |
|
[MAN]C:306 |
1 |
1 |
293 |
f |
[NAG]C:303 |
x,y,z |
1_555 |
1 |
1 |
367 |
0.9 |
0.0 |
0.161 |
0 |
0 |
0 |
0.000 |
102 |
112 |
|
[NAG]C:302 |
1 |
1 |
361 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
11674 |
0.2 |
0.0 |
0.296 |
0 |
0 |
0 |
0.000 |
|