| ## |
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 |
|
C |
148 |
40 |
19235 |
◊ |
B |
x,y,z |
1_555 |
169 |
46 |
18934 |
1450.4 |
0.4 |
0.721 |
17 |
18 |
0 |
0.258 |
2 |
|
L |
166 |
46 |
18955 |
◊ |
G |
x,y,z |
1_555 |
151 |
40 |
19220 |
1439.9 |
0.4 |
0.717 |
17 |
18 |
0 |
0.258 |
3 |
|
I |
146 |
38 |
19226 |
◊ |
H |
x,y,z |
1_555 |
172 |
46 |
18937 |
1433.5 |
0.4 |
0.723 |
17 |
17 |
0 |
0.258 |
4 |
|
E |
147 |
39 |
19235 |
◊ |
D |
x,y,z |
1_555 |
169 |
45 |
18958 |
1422.4 |
0.2 |
0.712 |
15 |
16 |
0 |
0.258 |
5 |
|
K |
143 |
38 |
19253 |
◊ |
J |
x,y,z |
1_555 |
165 |
43 |
18962 |
1418.6 |
0.3 |
0.716 |
16 |
16 |
0 |
0.258 |
6 |
|
F |
166 |
43 |
18962 |
◊ |
A |
x,y,z |
1_555 |
148 |
39 |
19233 |
1414.7 |
0.4 |
0.717 |
15 |
16 |
0 |
0.258 |
7 |
|
B |
144 |
38 |
18934 |
◊ |
A |
x,y,z |
1_555 |
167 |
48 |
19233 |
1406.6 |
0.8 |
0.735 |
19 |
19 |
0 |
0.258 |
8 |
|
F |
142 |
38 |
18962 |
◊ |
E |
x,y,z |
1_555 |
169 |
46 |
19235 |
1396.9 |
0.6 |
0.727 |
18 |
17 |
0 |
0.258 |
9 |
|
H |
145 |
38 |
18937 |
◊ |
G |
x,y,z |
1_555 |
168 |
47 |
19220 |
1394.8 |
-0.2 |
0.697 |
19 |
17 |
0 |
0.258 |
10 |
|
D |
144 |
38 |
18958 |
◊ |
C |
x,y,z |
1_555 |
165 |
45 |
19235 |
1382.3 |
0.6 |
0.728 |
17 |
16 |
0 |
0.258 |
11 |
|
J |
144 |
38 |
18962 |
◊ |
I |
x,y,z |
1_555 |
164 |
45 |
19226 |
1381.1 |
0.6 |
0.729 |
17 |
14 |
0 |
0.258 |
12 |
|
L |
143 |
38 |
18955 |
◊ |
K |
x,y,z |
1_555 |
165 |
46 |
19253 |
1379.4 |
0.8 |
0.734 |
18 |
17 |
0 |
0.258 |
| Average: |
1410.0 |
0.4 |
0.721 |
17 |
17 |
0 |
0.258 |
| 2 |
13 |
|
U |
49 |
14 |
3198 |
◊ |
F |
x,y,z |
1_555 |
52 |
14 |
18962 |
478.1 |
-7.8 |
0.161 |
2 |
2 |
0 |
0.027 |
14 |
|
W |
45 |
12 |
3166 |
◊ |
J |
x,y,z |
1_555 |
46 |
13 |
18962 |
442.2 |
-6.9 |
0.201 |
2 |
2 |
0 |
0.027 |
15 |
|
V |
42 |
11 |
3212 |
◊ |
H |
x,y,z |
1_555 |
45 |
13 |
18937 |
429.2 |
-6.8 |
0.178 |
2 |
2 |
0 |
0.027 |
| Average: |
449.8 |
-7.2 |
0.180 |
2 |
2 |
0 |
0.027 |
| 3 |
16 |
|
T |
47 |
13 |
3204 |
◊ |
D |
x,y,z |
1_555 |
46 |
12 |
18958 |
450.9 |
-7.7 |
0.145 |
2 |
2 |
0 |
0.027 |
17 |
|
X |
44 |
12 |
3164 |
◊ |
L |
x,y,z |
1_555 |
44 |
12 |
18955 |
435.8 |
-7.0 |
0.184 |
2 |
2 |
0 |
0.027 |
18 |
|
S |
46 |
12 |
3205 |
◊ |
B |
x,y,z |
1_555 |
46 |
11 |
18934 |
434.6 |
-7.1 |
0.179 |
2 |
2 |
0 |
0.027 |
19 |
|
M |
37 |
9 |
3218 |
◊ |
A |
x,y,z |
1_555 |
35 |
10 |
19233 |
348.1 |
-5.2 |
0.257 |
2 |
2 |
0 |
0.027 |
20 |
|
P |
39 |
9 |
3218 |
◊ |
G |
x,y,z |
1_555 |
34 |
10 |
19220 |
341.0 |
-5.0 |
0.279 |
4 |
2 |
0 |
0.027 |
21 |
|
Q |
35 |
8 |
3212 |
◊ |
I |
x,y,z |
1_555 |
32 |
10 |
19226 |
326.7 |
-4.8 |
0.268 |
3 |
2 |
0 |
0.027 |
22 |
|
R |
35 |
9 |
3222 |
◊ |
K |
x,y,z |
1_555 |
35 |
11 |
19253 |
326.5 |
-4.7 |
0.294 |
3 |
2 |
0 |
0.027 |
23 |
|
O |
36 |
8 |
3212 |
◊ |
E |
x,y,z |
1_555 |
33 |
10 |
19235 |
315.5 |
-4.3 |
0.328 |
2 |
2 |
0 |
0.027 |
24 |
|
N |
35 |
8 |
3218 |
◊ |
C |
x,y,z |
1_555 |
32 |
10 |
19235 |
302.7 |
-4.2 |
0.324 |
2 |
2 |
0 |
0.027 |
| Average: |
364.6 |
-5.5 |
0.251 |
2 |
2 |
0 |
0.027 |
| 4 |
25 |
|
[ADP]K:1000 |
25 |
1 |
548 |
f |
K |
x,y,z |
1_555 |
40 |
13 |
19253 |
309.1 |
-7.4 |
0.200 |
12 |
0 |
0 |
0.340 |
26 |
|
[ADP]A:1000 |
25 |
1 |
549 |
f |
A |
x,y,z |
1_555 |
43 |
14 |
19233 |
309.1 |
-7.4 |
0.218 |
12 |
0 |
0 |
0.340 |
27 |
|
[ADP]E:1000 |
25 |
1 |
550 |
f |
E |
x,y,z |
1_555 |
43 |
14 |
19235 |
308.6 |
-7.4 |
0.223 |
12 |
0 |
0 |
0.340 |
28 |
|
[ADP]L:1000 |
25 |
1 |
549 |
f |
L |
x,y,z |
1_555 |
41 |
13 |
18955 |
308.1 |
-7.5 |
0.197 |
12 |
0 |
0 |
0.340 |
29 |
|
[ADP]G:1000 |
25 |
1 |
547 |
f |
G |
x,y,z |
1_555 |
44 |
14 |
19220 |
307.8 |
-7.5 |
0.216 |
12 |
0 |
0 |
0.340 |
30 |
|
[ADP]I:1000 |
25 |
1 |
550 |
f |
I |
x,y,z |
1_555 |
41 |
13 |
19226 |
307.1 |
-7.3 |
0.210 |
12 |
0 |
0 |
0.340 |
31 |
|
[ADP]C:1000 |
25 |
1 |
546 |
f |
C |
x,y,z |
1_555 |
41 |
13 |
19235 |
306.6 |
-7.4 |
0.205 |
12 |
0 |
0 |
0.340 |
32 |
|
[ADP]F:1000 |
25 |
1 |
548 |
f |
F |
x,y,z |
1_555 |
41 |
13 |
18962 |
306.3 |
-7.4 |
0.199 |
12 |
0 |
0 |
0.340 |
33 |
|
[ADP]J:1000 |
25 |
1 |
549 |
f |
J |
x,y,z |
1_555 |
43 |
13 |
18962 |
305.8 |
-7.4 |
0.207 |
12 |
0 |
0 |
0.340 |
34 |
|
[ADP]H:1000 |
25 |
1 |
547 |
f |
H |
x,y,z |
1_555 |
41 |
13 |
18937 |
305.4 |
-7.5 |
0.198 |
12 |
0 |
0 |
0.340 |
35 |
|
[ADP]D:1000 |
25 |
1 |
548 |
f |
D |
x,y,z |
1_555 |
41 |
13 |
18958 |
304.7 |
-7.4 |
0.207 |
12 |
0 |
0 |
0.340 |
36 |
|
[ADP]B:1000 |
25 |
1 |
548 |
f |
B |
x,y,z |
1_555 |
44 |
14 |
18934 |
304.2 |
-7.5 |
0.215 |
12 |
0 |
0 |
0.340 |
| Average: |
306.9 |
-7.4 |
0.208 |
12 |
0 |
0 |
0.340 |
| 5 |
37 |
|
Z |
20 |
4 |
1320 |
◊ |
G |
x,y,z |
1_555 |
20 |
7 |
19220 |
160.7 |
-4.9 |
0.552 |
4 |
0 |
0 |
0.026 |
38 |
|
Y |
20 |
4 |
1318 |
◊ |
A |
x,y,z |
1_555 |
19 |
7 |
19233 |
160.6 |
-5.0 |
0.548 |
3 |
0 |
0 |
0.026 |
| Average: |
160.7 |
-4.9 |
0.550 |
4 |
0 |
0 |
0.026 |
| 6 |
39 |
|
Z |
20 |
5 |
1320 |
◊ |
L |
x,y,z |
1_555 |
19 |
8 |
18955 |
158.8 |
-5.9 |
0.507 |
4 |
0 |
0 |
0.030 |
40 |
|
Y |
19 |
5 |
1318 |
◊ |
F |
x,y,z |
1_555 |
19 |
8 |
18962 |
155.7 |
-5.8 |
0.495 |
3 |
0 |
0 |
0.030 |
| Average: |
157.3 |
-5.8 |
0.501 |
4 |
0 |
0 |
0.030 |
| 7 |
41 |
|
G |
18 |
6 |
19220 |
◊ |
J |
x-1,y+1,z |
1_465 |
19 |
6 |
18962 |
158.5 |
3.7 |
0.920 |
0 |
4 |
0 |
0.000 |
42 |
|
A |
18 |
6 |
19233 |
◊ |
D |
x-1,y,z |
1_455 |
20 |
6 |
18958 |
156.2 |
3.7 |
0.920 |
0 |
4 |
0 |
0.000 |
43 |
|
K |
19 |
6 |
19253 |
◊ |
H |
x,y-1,z |
1_545 |
21 |
7 |
18937 |
154.4 |
3.7 |
0.918 |
0 |
4 |
0 |
0.000 |
44 |
|
F |
19 |
7 |
18962 |
◊ |
C |
x,y-1,z |
1_545 |
18 |
5 |
19235 |
154.1 |
3.7 |
0.921 |
0 |
4 |
0 |
0.000 |
45 |
|
B |
20 |
7 |
18934 |
◊ |
E |
x-1,y+1,z |
1_465 |
19 |
6 |
19235 |
151.7 |
3.7 |
0.918 |
0 |
4 |
0 |
0.000 |
46 |
|
L |
19 |
7 |
18955 |
◊ |
I |
x-1,y,z |
1_455 |
19 |
5 |
19226 |
151.0 |
3.7 |
0.921 |
0 |
4 |
0 |
0.000 |
| Average: |
154.3 |
3.7 |
0.920 |
0 |
4 |
0 |
0.000 |
| 8 |
47 |
|
Z |
17 |
3 |
1320 |
◊ |
K |
x,y,z |
1_555 |
18 |
6 |
19253 |
142.5 |
-4.9 |
0.535 |
3 |
0 |
0 |
0.024 |
48 |
|
Y |
17 |
3 |
1318 |
◊ |
E |
x,y,z |
1_555 |
17 |
6 |
19235 |
136.2 |
-4.6 |
0.540 |
2 |
0 |
0 |
0.024 |
| Average: |
139.4 |
-4.8 |
0.538 |
3 |
0 |
0 |
0.024 |
| 9 |
49 |
|
Y |
17 |
3 |
1318 |
◊ |
B |
x,y,z |
1_555 |
17 |
8 |
18934 |
131.4 |
-3.6 |
0.535 |
1 |
0 |
0 |
0.016 |
50 |
|
Z |
18 |
3 |
1320 |
◊ |
H |
x,y,z |
1_555 |
17 |
8 |
18937 |
131.3 |
-3.6 |
0.545 |
1 |
0 |
0 |
0.016 |
| Average: |
131.4 |
-3.6 |
0.540 |
1 |
0 |
0 |
0.016 |
| 10 |
51 |
|
[ADP]D:1000 |
9 |
1 |
548 |
◊ |
C |
x,y,z |
1_555 |
18 |
5 |
19235 |
102.4 |
-2.0 |
0.561 |
4 |
0 |
0 |
0.100 |
52 |
|
[ADP]B:1000 |
9 |
1 |
548 |
◊ |
A |
x,y,z |
1_555 |
18 |
5 |
19233 |
102.2 |
-2.0 |
0.554 |
4 |
0 |
0 |
0.100 |
53 |
|
[ADP]F:1000 |
9 |
1 |
548 |
◊ |
E |
x,y,z |
1_555 |
18 |
5 |
19235 |
102.0 |
-2.0 |
0.550 |
4 |
0 |
0 |
0.100 |
54 |
|
[ADP]H:1000 |
9 |
1 |
547 |
◊ |
G |
x,y,z |
1_555 |
19 |
5 |
19220 |
101.9 |
-2.0 |
0.549 |
4 |
0 |
0 |
0.100 |
55 |
|
[ADP]J:1000 |
9 |
1 |
549 |
◊ |
I |
x,y,z |
1_555 |
19 |
5 |
19226 |
101.8 |
-2.0 |
0.541 |
4 |
0 |
0 |
0.100 |
56 |
|
[ADP]I:1000 |
8 |
1 |
550 |
◊ |
H |
x,y,z |
1_555 |
19 |
5 |
18937 |
101.5 |
-2.0 |
0.532 |
4 |
0 |
0 |
0.100 |
57 |
|
[ADP]C:1000 |
8 |
1 |
546 |
◊ |
B |
x,y,z |
1_555 |
19 |
5 |
18934 |
100.8 |
-2.0 |
0.534 |
4 |
0 |
0 |
0.100 |
58 |
|
[ADP]L:1000 |
8 |
1 |
549 |
◊ |
K |
x,y,z |
1_555 |
19 |
5 |
19253 |
100.6 |
-2.0 |
0.524 |
4 |
0 |
0 |
0.100 |
59 |
|
[ADP]G:1000 |
8 |
1 |
547 |
◊ |
L |
x,y,z |
1_555 |
19 |
5 |
18955 |
100.6 |
-2.0 |
0.528 |
4 |
0 |
0 |
0.100 |
60 |
|
[ADP]E:1000 |
8 |
1 |
550 |
◊ |
D |
x,y,z |
1_555 |
19 |
5 |
18958 |
100.3 |
-1.9 |
0.544 |
4 |
0 |
0 |
0.100 |
61 |
|
[ADP]A:1000 |
8 |
1 |
549 |
◊ |
F |
x,y,z |
1_555 |
19 |
5 |
18962 |
99.1 |
-1.9 |
0.547 |
4 |
0 |
0 |
0.100 |
62 |
|
[ADP]K:1000 |
8 |
1 |
548 |
◊ |
J |
x,y,z |
1_555 |
19 |
5 |
18962 |
98.7 |
-1.9 |
0.541 |
4 |
0 |
0 |
0.100 |
| Average: |
101.0 |
-2.0 |
0.542 |
4 |
0 |
0 |
0.100 |
| 11 |
63 |
|
Y |
12 |
3 |
1318 |
◊ |
C |
x,y,z |
1_555 |
13 |
6 |
19235 |
99.6 |
-2.9 |
0.435 |
0 |
0 |
0 |
0.011 |
64 |
|
Z |
11 |
3 |
1320 |
◊ |
I |
x,y,z |
1_555 |
13 |
6 |
19226 |
91.3 |
-2.5 |
0.465 |
0 |
0 |
0 |
0.011 |
| Average: |
95.5 |
-2.7 |
0.450 |
0 |
0 |
0 |
0.011 |
| 12 |
65 |
|
K |
8 |
4 |
19253 |
◊ |
M |
x,y-1,z |
1_545 |
10 |
3 |
3218 |
92.3 |
0.1 |
0.527 |
2 |
4 |
0 |
0.000 |
66 |
|
Q |
10 |
3 |
3212 |
◊ |
C |
x,y-1,z+1 |
1_546 |
10 |
5 |
19235 |
88.3 |
0.3 |
0.658 |
1 |
1 |
0 |
0.000 |
67 |
|
A |
10 |
5 |
19233 |
◊ |
P |
x,y,z-1 |
1_554 |
10 |
3 |
3218 |
80.8 |
0.3 |
0.630 |
1 |
1 |
0 |
0.000 |
68 |
|
R |
10 |
3 |
3222 |
◊ |
E |
x-1,y,z+1 |
1_456 |
9 |
5 |
19235 |
77.0 |
0.4 |
0.669 |
1 |
1 |
0 |
0.000 |
69 |
|
G |
9 |
5 |
19220 |
◊ |
N |
x-1,y,z |
1_455 |
10 |
3 |
3218 |
72.5 |
0.4 |
0.675 |
0 |
0 |
0 |
0.000 |
70 |
|
O |
10 |
3 |
3212 |
◊ |
I |
x,y,z |
1_555 |
10 |
7 |
19226 |
65.2 |
0.4 |
0.687 |
0 |
0 |
0 |
0.000 |
| Average: |
79.3 |
0.3 |
0.641 |
1 |
1 |
0 |
0.000 |
| 13 |
71 |
|
R |
11 |
4 |
3222 |
◊ |
B |
x,y-1,z+1 |
1_546 |
15 |
5 |
18934 |
92.2 |
-1.1 |
0.475 |
1 |
0 |
0 |
0.000 |
72 |
|
J |
14 |
4 |
18962 |
◊ |
N |
x,y-1,z |
1_545 |
8 |
3 |
3218 |
89.7 |
-1.3 |
0.396 |
1 |
0 |
0 |
0.000 |
73 |
|
L |
13 |
4 |
18955 |
◊ |
O |
x-1,y,z |
1_455 |
8 |
3 |
3212 |
87.6 |
-1.3 |
0.389 |
1 |
0 |
0 |
0.000 |
74 |
|
M |
10 |
4 |
3218 |
◊ |
H |
x,y,z |
1_555 |
14 |
5 |
18937 |
86.6 |
-0.8 |
0.513 |
0 |
0 |
0 |
0.000 |
75 |
|
F |
12 |
4 |
18962 |
◊ |
Q |
x,y,z-1 |
1_554 |
10 |
4 |
3212 |
79.2 |
-0.6 |
0.547 |
1 |
0 |
0 |
0.000 |
76 |
|
P |
9 |
4 |
3218 |
◊ |
D |
x-1,y,z+1 |
1_456 |
13 |
5 |
18958 |
77.9 |
-0.8 |
0.505 |
1 |
0 |
0 |
0.000 |
| Average: |
85.5 |
-1.0 |
0.471 |
1 |
0 |
0 |
0.000 |
| 14 |
77 |
|
[BEF]I:1002 |
4 |
1 |
181 |
f |
I |
x,y,z |
1_555 |
24 |
10 |
19226 |
88.7 |
2.3 |
0.666 |
5 |
0 |
0 |
0.000 |
78 |
|
[BEF]D:1002 |
4 |
1 |
182 |
f |
D |
x,y,z |
1_555 |
23 |
10 |
18958 |
88.5 |
2.3 |
0.664 |
4 |
0 |
0 |
0.000 |
79 |
|
[BEF]A:1002 |
4 |
1 |
181 |
f |
A |
x,y,z |
1_555 |
23 |
10 |
19233 |
88.3 |
2.3 |
0.667 |
5 |
0 |
0 |
0.000 |
80 |
|
[BEF]K:1002 |
4 |
1 |
181 |
f |
K |
x,y,z |
1_555 |
23 |
10 |
19253 |
87.9 |
2.3 |
0.666 |
5 |
0 |
0 |
0.000 |
81 |
|
[BEF]J:1002 |
4 |
1 |
181 |
f |
J |
x,y,z |
1_555 |
24 |
10 |
18962 |
87.6 |
2.2 |
0.663 |
4 |
0 |
0 |
0.000 |
82 |
|
[BEF]E:1002 |
4 |
1 |
181 |
f |
E |
x,y,z |
1_555 |
23 |
10 |
19235 |
87.6 |
2.3 |
0.666 |
5 |
0 |
0 |
0.000 |
83 |
|
[BEF]F:1002 |
4 |
1 |
182 |
f |
F |
x,y,z |
1_555 |
23 |
10 |
18962 |
87.5 |
2.2 |
0.664 |
5 |
0 |
0 |
0.000 |
84 |
|
[BEF]L:1002 |
4 |
1 |
182 |
f |
L |
x,y,z |
1_555 |
22 |
10 |
18955 |
87.3 |
2.3 |
0.665 |
4 |
0 |
0 |
0.000 |
85 |
|
[BEF]G:1002 |
4 |
1 |
182 |
f |
G |
x,y,z |
1_555 |
23 |
10 |
19220 |
87.0 |
2.2 |
0.663 |
5 |
0 |
0 |
0.000 |
86 |
|
[BEF]C:1002 |
4 |
1 |
180 |
f |
C |
x,y,z |
1_555 |
23 |
10 |
19235 |
86.5 |
2.2 |
0.664 |
5 |
0 |
0 |
0.000 |
87 |
|
[BEF]B:1002 |
4 |
1 |
182 |
f |
B |
x,y,z |
1_555 |
22 |
10 |
18934 |
86.4 |
2.2 |
0.662 |
4 |
0 |
0 |
0.000 |
88 |
|
[BEF]H:1002 |
4 |
1 |
181 |
f |
H |
x,y,z |
1_555 |
22 |
10 |
18937 |
86.3 |
2.2 |
0.661 |
5 |
0 |
0 |
0.000 |
| Average: |
87.5 |
2.2 |
0.664 |
5 |
0 |
0 |
0.000 |
| 15 |
89 |
|
Y |
7 |
3 |
1318 |
◊ |
D |
x,y,z |
1_555 |
11 |
4 |
18958 |
65.2 |
-3.3 |
0.400 |
1 |
0 |
0 |
0.015 |
90 |
|
Z |
7 |
3 |
1320 |
◊ |
J |
x,y,z |
1_555 |
8 |
3 |
18962 |
63.0 |
-3.0 |
0.416 |
2 |
0 |
0 |
0.015 |
| Average: |
64.1 |
-3.1 |
0.408 |
2 |
0 |
0 |
0.015 |
| 16 |
91 |
|
J |
5 |
1 |
18962 |
◊ |
S |
x,y-1,z |
1_545 |
5 |
1 |
3205 |
45.5 |
1.3 |
0.843 |
1 |
5 |
0 |
0.000 |
92 |
|
L |
4 |
1 |
18955 |
◊ |
T |
x-1,y,z |
1_455 |
5 |
1 |
3204 |
44.8 |
0.9 |
0.792 |
0 |
2 |
0 |
0.000 |
93 |
|
U |
5 |
1 |
3198 |
◊ |
H |
x,y,z |
1_555 |
3 |
1 |
18937 |
43.3 |
1.2 |
0.862 |
1 |
3 |
0 |
0.000 |
94 |
|
F |
3 |
1 |
18962 |
◊ |
V |
x,y,z-1 |
1_554 |
4 |
1 |
3212 |
41.0 |
1.2 |
0.890 |
1 |
3 |
0 |
0.000 |
95 |
|
W |
1 |
1 |
3166 |
◊ |
B |
x,y-1,z+1 |
1_546 |
3 |
1 |
18934 |
18.1 |
0.1 |
0.407 |
0 |
0 |
0 |
0.000 |
96 |
|
X |
1 |
1 |
3164 |
◊ |
D |
x-1,y,z+1 |
1_456 |
2 |
1 |
18958 |
16.2 |
0.1 |
0.442 |
0 |
0 |
0 |
0.000 |
| Average: |
34.8 |
0.8 |
0.706 |
1 |
2 |
0 |
0.000 |
| 17 |
97 |
|
[BEF]J:1002 |
4 |
1 |
181 |
f |
[ADP]J:1000 |
x,y,z |
1_555 |
5 |
1 |
549 |
41.3 |
-1.9 |
0.295 |
0 |
0 |
0 |
0.051 |
98 |
|
[BEF]D:1002 |
4 |
1 |
182 |
f |
[ADP]D:1000 |
x,y,z |
1_555 |
5 |
1 |
548 |
41.3 |
-2.0 |
0.302 |
0 |
0 |
0 |
0.051 |
99 |
|
[BEF]L:1002 |
4 |
1 |
182 |
f |
[ADP]L:1000 |
x,y,z |
1_555 |
5 |
1 |
549 |
41.2 |
-1.9 |
0.301 |
0 |
0 |
0 |
0.051 |
100 |
|
[BEF]B:1002 |
4 |
1 |
182 |
f |
[ADP]B:1000 |
x,y,z |
1_555 |
5 |
1 |
548 |
41.1 |
-1.9 |
0.303 |
0 |
0 |
0 |
0.051 |
101 |
|
[BEF]K:1002 |
4 |
1 |
181 |
f |
[ADP]K:1000 |
x,y,z |
1_555 |
5 |
1 |
548 |
41.0 |
-2.0 |
0.300 |
0 |
0 |
0 |
0.051 |
102 |
|
[BEF]F:1002 |
4 |
1 |
182 |
f |
[ADP]F:1000 |
x,y,z |
1_555 |
5 |
1 |
548 |
41.0 |
-1.9 |
0.305 |
0 |
0 |
0 |
0.051 |
103 |
|
[BEF]A:1002 |
4 |
1 |
181 |
f |
[ADP]A:1000 |
x,y,z |
1_555 |
5 |
1 |
549 |
40.9 |
-1.9 |
0.305 |
0 |
0 |
0 |
0.051 |
104 |
|
[BEF]H:1002 |
4 |
1 |
181 |
f |
[ADP]H:1000 |
x,y,z |
1_555 |
5 |
1 |
547 |
40.9 |
-1.9 |
0.295 |
0 |
0 |
0 |
0.051 |
105 |
|
[BEF]I:1002 |
4 |
1 |
181 |
f |
[ADP]I:1000 |
x,y,z |
1_555 |
5 |
1 |
550 |
40.6 |
-1.9 |
0.306 |
0 |
0 |
0 |
0.051 |
106 |
|
[BEF]E:1002 |
4 |
1 |
181 |
f |
[ADP]E:1000 |
x,y,z |
1_555 |
5 |
1 |
550 |
40.5 |
-1.9 |
0.308 |
0 |
0 |
0 |
0.051 |
107 |
|
[BEF]C:1002 |
4 |
1 |
180 |
f |
[ADP]C:1000 |
x,y,z |
1_555 |
5 |
1 |
546 |
40.5 |
-1.9 |
0.301 |
0 |
0 |
0 |
0.051 |
108 |
|
[BEF]G:1002 |
4 |
1 |
182 |
f |
[ADP]G:1000 |
x,y,z |
1_555 |
5 |
1 |
547 |
40.2 |
-1.9 |
0.305 |
0 |
0 |
0 |
0.051 |
| Average: |
40.9 |
-1.9 |
0.302 |
0 |
0 |
0 |
0.051 |
| 18 |
109 |
|
[MG]D:1001 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
11 |
6 |
18958 |
35.1 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.121 |
110 |
|
[MG]L:1001 |
1 |
1 |
98 |
f |
L |
x,y,z |
1_555 |
11 |
6 |
18955 |
34.7 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.121 |
111 |
|
[MG]J:1001 |
1 |
1 |
98 |
f |
J |
x,y,z |
1_555 |
11 |
6 |
18962 |
34.7 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.121 |
112 |
|
[MG]F:1001 |
1 |
1 |
98 |
f |
F |
x,y,z |
1_555 |
11 |
6 |
18962 |
34.6 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.121 |
113 |
|
[MG]H:1001 |
1 |
1 |
98 |
f |
H |
x,y,z |
1_555 |
11 |
6 |
18937 |
34.6 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.121 |
114 |
|
[MG]G:1001 |
1 |
1 |
98 |
f |
G |
x,y,z |
1_555 |
11 |
6 |
19220 |
34.5 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.121 |
115 |
|
[MG]A:1001 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
11 |
6 |
19233 |
34.5 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.121 |
116 |
|
[MG]B:1001 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
11 |
6 |
18934 |
34.4 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.121 |
117 |
|
[MG]I:1001 |
1 |
1 |
98 |
f |
I |
x,y,z |
1_555 |
10 |
6 |
19226 |
34.3 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.121 |
118 |
|
[MG]C:1001 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
10 |
6 |
19235 |
34.3 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.121 |
119 |
|
[MG]K:1001 |
1 |
1 |
98 |
f |
K |
x,y,z |
1_555 |
10 |
6 |
19253 |
34.3 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.121 |
120 |
|
[MG]E:1001 |
1 |
1 |
98 |
f |
E |
x,y,z |
1_555 |
10 |
6 |
19235 |
34.2 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.121 |
| Average: |
34.5 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.121 |
| 19 |
121 |
|
[BEF]G:1002 |
4 |
1 |
182 |
◊ |
L |
x,y,z |
1_555 |
6 |
2 |
18955 |
34.6 |
1.1 |
0.563 |
1 |
0 |
0 |
0.000 |
122 |
|
[BEF]C:1002 |
4 |
1 |
180 |
◊ |
B |
x,y,z |
1_555 |
6 |
2 |
18934 |
34.2 |
1.1 |
0.564 |
1 |
0 |
0 |
0.000 |
123 |
|
[BEF]H:1002 |
4 |
1 |
181 |
◊ |
G |
x,y,z |
1_555 |
6 |
2 |
19220 |
33.9 |
1.0 |
0.563 |
1 |
0 |
0 |
0.000 |
124 |
|
[BEF]B:1002 |
4 |
1 |
182 |
◊ |
A |
x,y,z |
1_555 |
6 |
2 |
19233 |
33.8 |
1.0 |
0.563 |
1 |
0 |
0 |
0.000 |
125 |
|
[BEF]E:1002 |
4 |
1 |
181 |
◊ |
D |
x,y,z |
1_555 |
6 |
2 |
18958 |
33.6 |
1.1 |
0.565 |
1 |
0 |
0 |
0.000 |
126 |
|
[BEF]K:1002 |
4 |
1 |
181 |
◊ |
J |
x,y,z |
1_555 |
6 |
2 |
18962 |
33.4 |
1.0 |
0.562 |
1 |
0 |
0 |
0.000 |
127 |
|
[BEF]D:1002 |
3 |
1 |
182 |
◊ |
C |
x,y,z |
1_555 |
6 |
2 |
19235 |
33.3 |
1.1 |
0.369 |
1 |
0 |
0 |
0.000 |
128 |
|
[BEF]A:1002 |
3 |
1 |
181 |
◊ |
F |
x,y,z |
1_555 |
6 |
2 |
18962 |
33.2 |
1.0 |
0.367 |
1 |
0 |
0 |
0.000 |
129 |
|
[BEF]F:1002 |
4 |
1 |
182 |
◊ |
E |
x,y,z |
1_555 |
6 |
2 |
19235 |
33.2 |
1.0 |
0.565 |
1 |
0 |
0 |
0.000 |
130 |
|
[BEF]I:1002 |
3 |
1 |
181 |
◊ |
H |
x,y,z |
1_555 |
6 |
2 |
18937 |
33.2 |
1.1 |
0.369 |
1 |
0 |
0 |
0.000 |
131 |
|
[BEF]L:1002 |
3 |
1 |
182 |
◊ |
K |
x,y,z |
1_555 |
6 |
2 |
19253 |
33.1 |
1.0 |
0.367 |
1 |
0 |
0 |
0.000 |
132 |
|
[BEF]J:1002 |
4 |
1 |
181 |
◊ |
I |
x,y,z |
1_555 |
6 |
2 |
19226 |
32.8 |
1.1 |
0.567 |
1 |
0 |
0 |
0.000 |
| Average: |
33.5 |
1.1 |
0.499 |
1 |
0 |
0 |
0.000 |
| 20 |
133 |
|
[MG]A:1001 |
1 |
1 |
98 |
f |
[ADP]A:1000 |
x,y,z |
1_555 |
5 |
1 |
549 |
26.1 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.098 |
134 |
|
[MG]F:1001 |
1 |
1 |
98 |
f |
[ADP]F:1000 |
x,y,z |
1_555 |
4 |
1 |
548 |
25.9 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.098 |
135 |
|
[MG]J:1001 |
1 |
1 |
98 |
f |
[ADP]J:1000 |
x,y,z |
1_555 |
4 |
1 |
549 |
25.8 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.098 |
136 |
|
[MG]L:1001 |
1 |
1 |
98 |
f |
[ADP]L:1000 |
x,y,z |
1_555 |
4 |
1 |
549 |
25.8 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.098 |
137 |
|
[MG]E:1001 |
1 |
1 |
98 |
f |
[ADP]E:1000 |
x,y,z |
1_555 |
5 |
1 |
550 |
25.8 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.098 |
138 |
|
[MG]K:1001 |
1 |
1 |
98 |
f |
[ADP]K:1000 |
x,y,z |
1_555 |
5 |
1 |
548 |
25.8 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.098 |
139 |
|
[MG]I:1001 |
1 |
1 |
98 |
f |
[ADP]I:1000 |
x,y,z |
1_555 |
4 |
1 |
550 |
25.7 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.098 |
140 |
|
[MG]D:1001 |
1 |
1 |
98 |
f |
[ADP]D:1000 |
x,y,z |
1_555 |
4 |
1 |
548 |
25.7 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.098 |
141 |
|
[MG]C:1001 |
1 |
1 |
98 |
f |
[ADP]C:1000 |
x,y,z |
1_555 |
4 |
1 |
546 |
25.7 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.098 |
142 |
|
[MG]H:1001 |
1 |
1 |
98 |
f |
[ADP]H:1000 |
x,y,z |
1_555 |
4 |
1 |
547 |
25.7 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.098 |
143 |
|
[MG]B:1001 |
1 |
1 |
98 |
f |
[ADP]B:1000 |
x,y,z |
1_555 |
4 |
1 |
548 |
25.5 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.098 |
144 |
|
[MG]G:1001 |
1 |
1 |
98 |
f |
[ADP]G:1000 |
x,y,z |
1_555 |
4 |
1 |
547 |
25.3 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.098 |
| Average: |
25.7 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.098 |
| 21 |
145 |
|
[BEF]D:1002 |
3 |
1 |
182 |
f |
[MG]D:1001 |
x,y,z |
1_555 |
1 |
1 |
98 |
20.5 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.048 |
146 |
|
[BEF]F:1002 |
3 |
1 |
182 |
f |
[MG]F:1001 |
x,y,z |
1_555 |
1 |
1 |
98 |
20.5 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.048 |
147 |
|
[BEF]L:1002 |
3 |
1 |
182 |
f |
[MG]L:1001 |
x,y,z |
1_555 |
1 |
1 |
98 |
20.4 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.048 |
148 |
|
[BEF]H:1002 |
3 |
1 |
181 |
f |
[MG]H:1001 |
x,y,z |
1_555 |
1 |
1 |
98 |
20.4 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.048 |
149 |
|
[BEF]B:1002 |
3 |
1 |
182 |
f |
[MG]B:1001 |
x,y,z |
1_555 |
1 |
1 |
98 |
20.4 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.048 |
150 |
|
[BEF]J:1002 |
3 |
1 |
181 |
f |
[MG]J:1001 |
x,y,z |
1_555 |
1 |
1 |
98 |
20.3 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.048 |
151 |
|
[BEF]E:1002 |
3 |
1 |
181 |
f |
[MG]E:1001 |
x,y,z |
1_555 |
1 |
1 |
98 |
20.3 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.048 |
152 |
|
[BEF]C:1002 |
3 |
1 |
180 |
f |
[MG]C:1001 |
x,y,z |
1_555 |
1 |
1 |
98 |
20.3 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.048 |
153 |
|
[BEF]I:1002 |
3 |
1 |
181 |
f |
[MG]I:1001 |
x,y,z |
1_555 |
1 |
1 |
98 |
20.3 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.048 |
154 |
|
[BEF]K:1002 |
3 |
1 |
181 |
f |
[MG]K:1001 |
x,y,z |
1_555 |
1 |
1 |
98 |
20.2 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.048 |
155 |
|
[BEF]A:1002 |
3 |
1 |
181 |
f |
[MG]A:1001 |
x,y,z |
1_555 |
1 |
1 |
98 |
20.1 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.048 |
156 |
|
[BEF]G:1002 |
3 |
1 |
182 |
f |
[MG]G:1001 |
x,y,z |
1_555 |
1 |
1 |
98 |
20.0 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.048 |
| Average: |
20.3 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.048 |
| 22 |
157 |
|
X |
3 |
1 |
3164 |
◊ |
E |
x-1,y,z+1 |
1_456 |
4 |
2 |
19235 |
15.7 |
-0.1 |
0.555 |
0 |
0 |
0 |
0.000 |
158 |
|
A |
2 |
1 |
19233 |
◊ |
V |
x,y,z-1 |
1_554 |
3 |
1 |
3212 |
9.4 |
-0.1 |
0.525 |
0 |
0 |
0 |
0.000 |
| Average: |
12.5 |
-0.1 |
0.540 |
0 |
0 |
0 |
0.000 |
| 23 |
159 |
|
W |
3 |
1 |
3166 |
◊ |
C |
x,y-1,z+1 |
1_546 |
4 |
2 |
19235 |
13.0 |
-0.1 |
0.570 |
0 |
0 |
0 |
0.000 |
160 |
|
U |
3 |
1 |
3198 |
◊ |
I |
x,y,z |
1_555 |
4 |
2 |
19226 |
11.3 |
-0.1 |
0.574 |
0 |
0 |
0 |
0.000 |
161 |
|
K |
4 |
2 |
19253 |
◊ |
S |
x,y-1,z |
1_545 |
3 |
1 |
3205 |
10.0 |
-0.1 |
0.583 |
0 |
0 |
0 |
0.000 |
162 |
|
G |
1 |
1 |
19220 |
◊ |
T |
x-1,y,z |
1_455 |
1 |
1 |
3204 |
2.3 |
-0.0 |
0.552 |
0 |
0 |
0 |
0.000 |
| Average: |
9.2 |
-0.1 |
0.570 |
0 |
0 |
0 |
0.000 |
| 24 |
163 |
|
[MG]I:1001 |
1 |
1 |
98 |
◊ |
H |
x,y,z |
1_555 |
1 |
1 |
18937 |
6.6 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.009 |
164 |
|
[MG]C:1001 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
18934 |
6.5 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.009 |
165 |
|
[MG]F:1001 |
1 |
1 |
98 |
◊ |
E |
x,y,z |
1_555 |
1 |
1 |
19235 |
6.4 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.009 |
166 |
|
[MG]B:1001 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
19233 |
6.4 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.009 |
167 |
|
[MG]J:1001 |
1 |
1 |
98 |
◊ |
I |
x,y,z |
1_555 |
1 |
1 |
19226 |
6.3 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.009 |
168 |
|
[MG]H:1001 |
1 |
1 |
98 |
◊ |
G |
x,y,z |
1_555 |
1 |
1 |
19220 |
6.3 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.009 |
169 |
|
[MG]G:1001 |
1 |
1 |
98 |
◊ |
L |
x,y,z |
1_555 |
1 |
1 |
18955 |
6.3 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.009 |
170 |
|
[MG]E:1001 |
1 |
1 |
98 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
18958 |
6.3 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.009 |
171 |
|
[MG]L:1001 |
1 |
1 |
98 |
◊ |
K |
x,y,z |
1_555 |
1 |
1 |
19253 |
6.2 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.009 |
172 |
|
[MG]K:1001 |
1 |
1 |
98 |
◊ |
J |
x,y,z |
1_555 |
1 |
1 |
18962 |
6.0 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.009 |
173 |
|
[MG]D:1001 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
19235 |
5.9 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.009 |
174 |
|
[MG]A:1001 |
1 |
1 |
98 |
◊ |
F |
x,y,z |
1_555 |
1 |
1 |
18962 |
5.9 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.009 |
| Average: |
6.3 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.009 |
|