| ## |
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 |
|
K |
292 |
73 |
6898 |
◊ |
J |
x,y,z |
1_555 |
303 |
85 |
13195 |
3156.0 |
-62.7 |
0.643 |
15 |
0 |
0 |
0.244 |
2 |
|
S |
289 |
71 |
7046 |
◊ |
R |
x,y,z |
1_555 |
291 |
87 |
13342 |
3073.4 |
-65.1 |
0.513 |
11 |
0 |
0 |
0.244 |
| Average: |
3114.7 |
-63.9 |
0.578 |
13 |
0 |
0 |
0.244 |
| 2 |
3 |
|
H |
325 |
95 |
18020 |
◊ |
A |
x,y,z |
1_555 |
298 |
70 |
10843 |
3009.9 |
-65.1 |
0.634 |
12 |
1 |
0 |
0.510 |
4 |
|
Q |
315 |
95 |
17852 |
◊ |
P |
x,y,z |
1_555 |
295 |
70 |
10866 |
2910.7 |
-63.2 |
0.661 |
14 |
0 |
0 |
0.510 |
| Average: |
2960.3 |
-64.1 |
0.648 |
13 |
1 |
0 |
0.510 |
| 3 |
5 |
|
5 |
282 |
75 |
13079 |
◊ |
4 |
x,y,z |
1_555 |
278 |
69 |
16702 |
2719.4 |
-17.7 |
0.644 |
48 |
18 |
0 |
1.000 |
6 |
|
F |
270 |
71 |
13137 |
◊ |
E |
x,y,z |
1_555 |
274 |
68 |
16903 |
2694.2 |
-18.4 |
0.609 |
38 |
16 |
0 |
1.000 |
| Average: |
2706.8 |
-18.0 |
0.627 |
43 |
17 |
0 |
1.000 |
| 4 |
7 |
|
C |
277 |
63 |
10796 |
◊ |
B |
x,y,z |
1_555 |
290 |
79 |
18709 |
2683.5 |
-19.4 |
0.263 |
32 |
14 |
0 |
0.421 |
8 |
|
2 |
256 |
62 |
10671 |
◊ |
1 |
x,y,z |
1_555 |
282 |
82 |
18870 |
2641.3 |
-20.4 |
0.210 |
33 |
12 |
0 |
0.421 |
| Average: |
2662.4 |
-19.9 |
0.236 |
33 |
13 |
0 |
0.421 |
| 5 |
9 |
|
M |
240 |
69 |
17689 |
◊ |
L |
x,y,z |
1_555 |
236 |
54 |
26825 |
2405.3 |
-45.3 |
0.185 |
15 |
3 |
0 |
0.329 |
10 |
|
U |
232 |
66 |
17766 |
◊ |
T |
x,y,z |
1_555 |
228 |
52 |
26747 |
2218.7 |
-45.4 |
0.136 |
10 |
3 |
0 |
0.329 |
| Average: |
2312.0 |
-45.3 |
0.160 |
13 |
3 |
0 |
0.329 |
| 6 |
11 |
|
R |
175 |
49 |
13342 |
◊ |
P |
x,y,z |
1_555 |
194 |
45 |
10866 |
1761.4 |
-40.5 |
0.895 |
5 |
0 |
0 |
0.313 |
12 |
|
J |
177 |
48 |
13195 |
◊ |
A |
x,y,z |
1_555 |
197 |
47 |
10843 |
1754.0 |
-39.8 |
0.903 |
7 |
0 |
0 |
0.313 |
| Average: |
1757.7 |
-40.2 |
0.899 |
6 |
0 |
0 |
0.313 |
| 7 |
13 |
|
N |
163 |
44 |
16439 |
◊ |
K |
x,y,z |
1_555 |
167 |
46 |
6898 |
1544.1 |
-32.5 |
0.344 |
10 |
0 |
0 |
0.232 |
14 |
|
V |
164 |
44 |
16873 |
◊ |
S |
x,y,z |
1_555 |
171 |
46 |
7046 |
1532.4 |
-32.8 |
0.366 |
8 |
0 |
0 |
0.232 |
| Average: |
1538.3 |
-32.7 |
0.355 |
9 |
0 |
0 |
0.232 |
| 8 |
15 |
|
O |
171 |
37 |
11686 |
◊ |
G |
x,y,z |
1_555 |
163 |
43 |
9525 |
1518.9 |
-18.7 |
0.400 |
15 |
2 |
0 |
0.277 |
16 |
|
9 |
176 |
39 |
11648 |
◊ |
6 |
x,y,z |
1_555 |
166 |
44 |
9509 |
1508.6 |
-19.0 |
0.394 |
17 |
1 |
0 |
0.277 |
| Average: |
1513.7 |
-18.8 |
0.397 |
16 |
2 |
0 |
0.277 |
| 9 |
17 |
|
D |
159 |
42 |
32228 |
◊ |
B |
x,y,z |
1_555 |
164 |
43 |
18709 |
1480.1 |
-14.7 |
0.106 |
9 |
3 |
0 |
0.070 |
18 |
|
3 |
156 |
40 |
32264 |
◊ |
1 |
x,y,z |
1_555 |
154 |
41 |
18870 |
1374.8 |
-15.9 |
0.066 |
8 |
2 |
0 |
0.070 |
| Average: |
1427.4 |
-15.3 |
0.086 |
9 |
3 |
0 |
0.070 |
| 10 |
19 |
|
O |
154 |
41 |
11686 |
◊ |
E |
x,y,z |
1_555 |
169 |
46 |
16903 |
1463.6 |
-10.1 |
0.642 |
26 |
4 |
0 |
0.110 |
20 |
|
9 |
149 |
37 |
11648 |
◊ |
4 |
x,y,z |
1_555 |
170 |
46 |
16702 |
1448.5 |
-11.0 |
0.618 |
23 |
6 |
0 |
0.110 |
| Average: |
1456.0 |
-10.6 |
0.630 |
25 |
5 |
0 |
0.110 |
| 11 |
21 |
|
G |
147 |
36 |
9525 |
◊ |
E |
x,y,z |
1_555 |
169 |
46 |
16903 |
1451.8 |
-16.8 |
0.226 |
14 |
10 |
0 |
0.264 |
22 |
|
6 |
147 |
36 |
9509 |
◊ |
4 |
x,y,z |
1_555 |
165 |
43 |
16702 |
1401.1 |
-19.5 |
0.126 |
14 |
11 |
0 |
0.264 |
| Average: |
1426.4 |
-18.2 |
0.176 |
14 |
11 |
0 |
0.264 |
| 12 |
23 |
|
N |
141 |
39 |
16439 |
◊ |
M |
x,y,z |
1_555 |
121 |
38 |
17689 |
1399.1 |
-35.8 |
0.006 |
1 |
0 |
0 |
0.231 |
24 |
|
V |
139 |
37 |
16873 |
◊ |
U |
x,y,z |
1_555 |
114 |
34 |
17766 |
1357.6 |
-35.6 |
0.004 |
2 |
0 |
0 |
0.231 |
| Average: |
1378.4 |
-35.7 |
0.005 |
2 |
0 |
0 |
0.231 |
| 13 |
25 |
|
H |
149 |
35 |
18020 |
◊ |
6 |
x,y,z |
1_555 |
148 |
35 |
9509 |
1329.5 |
-11.8 |
0.780 |
9 |
5 |
0 |
0.043 |
26 |
|
Q |
151 |
35 |
17852 |
◊ |
G |
x,y,z |
1_555 |
142 |
35 |
9525 |
1306.6 |
-9.7 |
0.814 |
7 |
9 |
0 |
0.043 |
| Average: |
1318.0 |
-10.8 |
0.797 |
8 |
7 |
0 |
0.043 |
| 14 |
27 |
|
V |
133 |
41 |
16873 |
◊ |
T |
x,y,z |
1_555 |
114 |
25 |
26747 |
1217.1 |
-28.2 |
0.100 |
3 |
0 |
0 |
0.187 |
28 |
|
N |
124 |
40 |
16439 |
◊ |
L |
x,y,z |
1_555 |
113 |
25 |
26825 |
1187.5 |
-27.0 |
0.109 |
5 |
0 |
0 |
0.187 |
| Average: |
1202.3 |
-27.6 |
0.105 |
4 |
0 |
0 |
0.187 |
| 15 |
29 |
|
Q |
128 |
30 |
17852 |
◊ |
E |
x,y,z |
1_555 |
123 |
35 |
16903 |
1192.8 |
-11.7 |
0.166 |
7 |
5 |
0 |
0.063 |
30 |
|
H |
134 |
31 |
18020 |
◊ |
4 |
x,y,z |
1_555 |
114 |
35 |
16702 |
1185.3 |
-13.5 |
0.091 |
8 |
5 |
0 |
0.063 |
| Average: |
1189.0 |
-12.6 |
0.128 |
8 |
5 |
0 |
0.063 |
| 16 |
31 |
|
4 |
100 |
29 |
16702 |
◊ |
3 |
x,y,z |
1_555 |
118 |
33 |
32264 |
1055.6 |
-22.8 |
0.001 |
5 |
1 |
0 |
0.095 |
32 |
|
E |
105 |
30 |
16903 |
◊ |
D |
x,y,z |
1_555 |
111 |
31 |
32228 |
1008.3 |
-21.7 |
0.001 |
5 |
1 |
0 |
0.095 |
| Average: |
1031.9 |
-22.2 |
0.001 |
5 |
1 |
0 |
0.095 |
| 17 |
33 |
|
N |
121 |
38 |
16439 |
◊ |
J |
x,y,z |
1_555 |
87 |
26 |
13195 |
1042.2 |
-26.8 |
0.205 |
2 |
2 |
0 |
0.156 |
34 |
|
V |
118 |
38 |
16873 |
◊ |
R |
x,y,z |
1_555 |
81 |
24 |
13342 |
1003.1 |
-25.4 |
0.230 |
1 |
3 |
0 |
0.156 |
| Average: |
1022.7 |
-26.1 |
0.217 |
2 |
3 |
0 |
0.156 |
| 18 |
35 |
|
7 |
102 |
31 |
7978 |
◊ |
3 |
x,y,z |
1_555 |
109 |
28 |
32264 |
1016.1 |
-10.1 |
0.190 |
11 |
10 |
0 |
0.058 |
36 |
|
I |
102 |
30 |
7727 |
◊ |
D |
x,y,z |
1_555 |
108 |
27 |
32228 |
1012.0 |
-8.4 |
0.272 |
10 |
12 |
0 |
0.058 |
| Average: |
1014.0 |
-9.3 |
0.231 |
11 |
11 |
0 |
0.058 |
| 19 |
37 |
|
F |
99 |
24 |
13137 |
◊ |
D |
x,y,z |
1_555 |
124 |
35 |
32228 |
997.0 |
-5.8 |
0.350 |
17 |
5 |
0 |
0.051 |
38 |
|
5 |
94 |
25 |
13079 |
◊ |
3 |
x,y,z |
1_555 |
128 |
37 |
32264 |
988.5 |
-6.6 |
0.371 |
16 |
2 |
0 |
0.051 |
| Average: |
992.7 |
-6.2 |
0.360 |
17 |
4 |
0 |
0.051 |
| 20 |
39 |
|
H |
98 |
28 |
18020 |
◊ |
J |
x,y,z |
1_555 |
87 |
26 |
13195 |
964.9 |
-23.3 |
0.389 |
3 |
2 |
0 |
0.180 |
40 |
|
Q |
96 |
29 |
17852 |
◊ |
R |
x,y,z |
1_555 |
92 |
27 |
13342 |
928.6 |
-23.1 |
0.452 |
3 |
1 |
0 |
0.180 |
| Average: |
946.7 |
-23.2 |
0.420 |
3 |
2 |
0 |
0.180 |
| 21 |
41 |
|
7 |
80 |
20 |
7978 |
◊ |
2 |
x,y,z |
1_555 |
83 |
25 |
10671 |
778.9 |
-9.7 |
0.190 |
5 |
5 |
0 |
0.039 |
42 |
|
I |
67 |
19 |
7727 |
◊ |
C |
x,y,z |
1_555 |
75 |
23 |
10796 |
695.4 |
-11.3 |
0.106 |
5 |
3 |
0 |
0.039 |
| Average: |
737.1 |
-10.5 |
0.148 |
5 |
4 |
0 |
0.039 |
| 22 |
43 |
|
X |
78 |
23 |
6672 |
◊ |
D |
x,y,z |
1_555 |
78 |
22 |
32228 |
737.5 |
-9.3 |
0.146 |
5 |
2 |
0 |
0.032 |
44 |
|
W |
78 |
23 |
6835 |
◊ |
3 |
x,y,z |
1_555 |
71 |
21 |
32264 |
707.5 |
-8.2 |
0.186 |
4 |
7 |
0 |
0.032 |
| Average: |
722.5 |
-8.8 |
0.166 |
5 |
5 |
0 |
0.032 |
| 23 |
45 |
|
W |
84 |
24 |
6835 |
◊ |
5 |
x,y,z |
1_555 |
72 |
19 |
13079 |
699.2 |
-6.5 |
0.400 |
4 |
2 |
0 |
0.023 |
46 |
|
X |
78 |
21 |
6672 |
◊ |
F |
x,y,z |
1_555 |
68 |
18 |
13137 |
650.6 |
-7.5 |
0.334 |
2 |
1 |
0 |
0.023 |
| Average: |
674.9 |
-7.0 |
0.367 |
3 |
2 |
0 |
0.023 |
| 24 |
47 |
|
Q |
71 |
16 |
17852 |
◊ |
O |
x,y,z |
1_555 |
72 |
19 |
11686 |
696.8 |
-12.2 |
0.386 |
3 |
1 |
0 |
0.043 |
48 |
|
H |
73 |
19 |
18020 |
◊ |
9 |
x,y,z |
1_555 |
75 |
20 |
11648 |
692.8 |
-11.2 |
0.502 |
2 |
3 |
0 |
0.043 |
| Average: |
694.8 |
-11.7 |
0.444 |
3 |
2 |
0 |
0.043 |
| 25 |
49 |
|
P |
66 |
18 |
10866 |
◊ |
G |
x,y,z |
1_555 |
77 |
19 |
9525 |
619.0 |
-2.3 |
0.954 |
7 |
1 |
0 |
0.006 |
50 |
|
A |
58 |
16 |
10843 |
◊ |
6 |
x,y,z |
1_555 |
70 |
21 |
9509 |
555.9 |
-2.1 |
0.939 |
7 |
2 |
0 |
0.006 |
| Average: |
587.5 |
-2.2 |
0.946 |
7 |
2 |
0 |
0.006 |
| 26 |
51 |
|
O |
69 |
21 |
11686 |
◊ |
F |
x,y,z |
1_555 |
63 |
14 |
13137 |
594.4 |
-5.8 |
0.492 |
7 |
7 |
0 |
0.049 |
52 |
|
9 |
75 |
21 |
11648 |
◊ |
5 |
x,y,z |
1_555 |
61 |
15 |
13079 |
585.5 |
-5.4 |
0.548 |
7 |
7 |
0 |
0.049 |
| Average: |
589.9 |
-5.6 |
0.520 |
7 |
7 |
0 |
0.049 |
| 27 |
53 |
|
O |
62 |
18 |
11686 |
◊ |
D |
x,y,z |
1_555 |
73 |
20 |
32228 |
586.1 |
-0.5 |
0.721 |
8 |
5 |
0 |
0.018 |
54 |
|
9 |
65 |
18 |
11648 |
◊ |
3 |
x,y,z |
1_555 |
68 |
18 |
32264 |
577.7 |
0.5 |
0.790 |
6 |
4 |
0 |
0.018 |
| Average: |
581.9 |
0.0 |
0.755 |
7 |
5 |
0 |
0.018 |
| 28 |
55 |
|
D |
60 |
15 |
32228 |
◊ |
C |
x,y,z |
1_555 |
61 |
17 |
10796 |
566.2 |
-6.0 |
0.254 |
11 |
0 |
0 |
0.031 |
56 |
|
3 |
60 |
15 |
32264 |
◊ |
2 |
x,y,z |
1_555 |
62 |
16 |
10671 |
558.5 |
-6.3 |
0.245 |
10 |
0 |
0 |
0.031 |
| Average: |
562.3 |
-6.1 |
0.250 |
11 |
0 |
0 |
0.031 |
| 29 |
57 |
|
W |
63 |
19 |
6835 |
◊ |
6 |
x,y,z |
1_555 |
65 |
20 |
9509 |
558.9 |
-1.1 |
0.728 |
11 |
7 |
0 |
0.016 |
58 |
|
X |
56 |
17 |
6672 |
◊ |
G |
x,y,z |
1_555 |
56 |
17 |
9525 |
483.9 |
-2.5 |
0.615 |
9 |
7 |
0 |
0.016 |
| Average: |
521.4 |
-1.8 |
0.672 |
10 |
7 |
0 |
0.016 |
| 30 |
59 |
|
I |
58 |
14 |
7727 |
◊ |
O |
x,y,z |
1_555 |
64 |
19 |
11686 |
550.0 |
-5.1 |
0.470 |
2 |
2 |
0 |
0.020 |
60 |
|
7 |
53 |
12 |
7978 |
◊ |
9 |
x,y,z |
1_555 |
61 |
18 |
11648 |
506.6 |
-5.3 |
0.405 |
2 |
1 |
0 |
0.020 |
| Average: |
528.3 |
-5.2 |
0.437 |
2 |
2 |
0 |
0.020 |
| 31 |
61 |
|
L |
46 |
12 |
26825 |
◊ |
K |
x,y,z |
1_555 |
41 |
13 |
6898 |
454.3 |
-2.7 |
0.801 |
3 |
2 |
0 |
0.032 |
62 |
|
T |
44 |
12 |
26747 |
◊ |
S |
x,y,z |
1_555 |
42 |
13 |
7046 |
444.1 |
-3.0 |
0.797 |
4 |
2 |
0 |
0.032 |
| Average: |
449.2 |
-2.9 |
0.799 |
4 |
2 |
0 |
0.032 |
| 32 |
63 |
|
B |
44 |
13 |
18709 |
◊ |
T |
x-1,y,z-1 |
1_454 |
52 |
16 |
26747 |
433.0 |
-0.4 |
0.857 |
0 |
1 |
0 |
0.000 |
64 |
|
L |
53 |
17 |
26825 |
◊ |
1 |
x,y,z-1 |
1_554 |
53 |
14 |
18870 |
422.5 |
-0.1 |
0.869 |
4 |
3 |
0 |
0.000 |
| Average: |
427.7 |
-0.3 |
0.863 |
2 |
2 |
0 |
0.000 |
| 33 |
65 |
|
[FMN]1:502 |
31 |
1 |
611 |
f |
1 |
x,y,z |
1_555 |
67 |
24 |
18870 |
429.6 |
-4.9 |
0.566 |
12 |
0 |
0 |
0.116 |
| 34 |
66 |
|
A |
48 |
15 |
10843 |
◊ |
4 |
x,y,z |
1_555 |
46 |
13 |
16702 |
428.2 |
-3.7 |
0.584 |
2 |
0 |
0 |
0.005 |
67 |
|
P |
47 |
13 |
10866 |
◊ |
E |
x,y,z |
1_555 |
44 |
12 |
16903 |
426.2 |
-3.6 |
0.635 |
3 |
0 |
0 |
0.005 |
| Average: |
427.2 |
-3.6 |
0.610 |
3 |
0 |
0 |
0.005 |
| 35 |
68 |
|
[FMN]B:502 |
31 |
1 |
610 |
f |
B |
x,y,z |
1_555 |
65 |
24 |
18709 |
418.9 |
-5.7 |
0.520 |
12 |
0 |
0 |
0.127 |
| 36 |
69 |
|
L |
40 |
10 |
26825 |
◊ |
J |
x,y,z |
1_555 |
39 |
13 |
13195 |
398.4 |
-7.7 |
0.574 |
1 |
0 |
0 |
0.048 |
70 |
|
T |
41 |
10 |
26747 |
◊ |
R |
x,y,z |
1_555 |
35 |
13 |
13342 |
382.7 |
-7.9 |
0.565 |
1 |
0 |
0 |
0.048 |
| Average: |
390.5 |
-7.8 |
0.570 |
1 |
0 |
0 |
0.048 |
| 37 |
71 |
|
6 |
40 |
8 |
9509 |
◊ |
5 |
x,y,z |
1_555 |
45 |
20 |
13079 |
355.4 |
-3.4 |
0.502 |
3 |
0 |
0 |
0.055 |
72 |
|
G |
37 |
7 |
9525 |
◊ |
F |
x,y,z |
1_555 |
44 |
19 |
13137 |
323.1 |
-3.1 |
0.532 |
5 |
0 |
0 |
0.055 |
| Average: |
339.2 |
-3.3 |
0.517 |
4 |
0 |
0 |
0.055 |
| 38 |
73 |
|
K |
35 |
13 |
6898 |
◊ |
A |
x,y,z |
1_555 |
36 |
11 |
10843 |
337.8 |
-9.2 |
0.333 |
1 |
0 |
0 |
0.031 |
74 |
|
S |
31 |
11 |
7046 |
◊ |
P |
x,y,z |
1_555 |
36 |
9 |
10866 |
311.4 |
-9.1 |
0.254 |
2 |
0 |
0 |
0.031 |
| Average: |
324.6 |
-9.2 |
0.293 |
2 |
0 |
0 |
0.031 |
| 39 |
75 |
|
V |
27 |
9 |
16873 |
◊ |
P |
x,y,z |
1_555 |
31 |
7 |
10866 |
300.5 |
-7.3 |
0.247 |
2 |
1 |
0 |
0.026 |
76 |
|
N |
25 |
8 |
16439 |
◊ |
A |
x,y,z |
1_555 |
29 |
7 |
10843 |
281.8 |
-7.1 |
0.192 |
1 |
1 |
0 |
0.026 |
| Average: |
291.1 |
-7.2 |
0.220 |
2 |
1 |
0 |
0.026 |
| 40 |
77 |
|
I |
36 |
8 |
7727 |
◊ |
E |
x,y,z |
1_555 |
29 |
6 |
16903 |
290.2 |
-2.4 |
0.450 |
5 |
5 |
0 |
0.019 |
78 |
|
7 |
32 |
8 |
7978 |
◊ |
4 |
x,y,z |
1_555 |
28 |
6 |
16702 |
259.7 |
-2.4 |
0.450 |
3 |
3 |
0 |
0.019 |
| Average: |
274.9 |
-2.4 |
0.450 |
4 |
4 |
0 |
0.019 |
| 41 |
79 |
|
D |
37 |
13 |
32228 |
◊ |
3 |
x,y,z |
1_555 |
29 |
11 |
32264 |
289.3 |
3.4 |
0.875 |
1 |
0 |
0 |
0.000 |
80 |
|
D |
31 |
10 |
32228 |
◊ |
3 |
x-1,y,z |
1_455 |
30 |
9 |
32264 |
250.0 |
2.5 |
0.846 |
2 |
2 |
0 |
0.000 |
| Average: |
269.7 |
3.0 |
0.860 |
2 |
1 |
0 |
0.000 |
| 42 |
81 |
|
W |
32 |
9 |
6835 |
◊ |
D |
x,y,z |
1_555 |
25 |
9 |
32228 |
287.2 |
1.9 |
0.790 |
3 |
4 |
0 |
0.000 |
82 |
|
X |
29 |
8 |
6672 |
◊ |
3 |
x-1,y,z |
1_455 |
24 |
9 |
32264 |
240.9 |
1.7 |
0.768 |
3 |
4 |
0 |
0.000 |
| Average: |
264.0 |
1.8 |
0.779 |
3 |
4 |
0 |
0.000 |
| 43 |
83 |
|
[DCQ]E:501 |
21 |
1 |
582 |
◊ |
E |
x,y,z |
1_555 |
39 |
19 |
16903 |
281.1 |
-2.5 |
0.556 |
1 |
0 |
0 |
0.031 |
84 |
|
[DCQ]4:501 |
21 |
1 |
583 |
◊ |
4 |
x,y,z |
1_555 |
39 |
19 |
16702 |
276.1 |
-2.8 |
0.562 |
1 |
0 |
0 |
0.031 |
| Average: |
278.6 |
-2.6 |
0.559 |
1 |
0 |
0 |
0.031 |
| 44 |
85 |
|
[DCQ]4:501 |
21 |
1 |
583 |
f |
6 |
x,y,z |
1_555 |
36 |
10 |
9509 |
235.3 |
-4.6 |
0.324 |
0 |
0 |
0 |
0.048 |
86 |
|
[DCQ]E:501 |
21 |
1 |
582 |
f |
G |
x,y,z |
1_555 |
29 |
10 |
9525 |
224.4 |
-4.1 |
0.295 |
0 |
0 |
0 |
0.048 |
| Average: |
229.8 |
-4.4 |
0.310 |
0 |
0 |
0 |
0.048 |
| 45 |
87 |
|
[SF4]D:803 |
8 |
1 |
310 |
cf |
D |
x,y,z |
1_555 |
26 |
14 |
32228 |
195.0 |
-21.9 |
0.189 |
0 |
0 |
0 |
0.083 |
88 |
|
[SF4]3:803 |
8 |
1 |
308 |
cf |
3 |
x,y,z |
1_555 |
26 |
14 |
32264 |
189.9 |
-21.6 |
0.200 |
0 |
0 |
0 |
0.083 |
| Average: |
192.4 |
-21.8 |
0.194 |
0 |
0 |
0 |
0.083 |
| 46 |
89 |
|
[SF4]D:802 |
8 |
1 |
310 |
f |
D |
x,y,z |
1_555 |
30 |
16 |
32228 |
193.2 |
-21.8 |
0.225 |
0 |
0 |
0 |
0.083 |
90 |
|
[SF4]3:802 |
8 |
1 |
309 |
f |
3 |
x,y,z |
1_555 |
30 |
15 |
32264 |
193.1 |
-21.8 |
0.290 |
0 |
0 |
0 |
0.083 |
| Average: |
193.2 |
-21.8 |
0.257 |
0 |
0 |
0 |
0.083 |
| 47 |
91 |
|
[SF4]O:201 |
8 |
1 |
310 |
f |
O |
x,y,z |
1_555 |
28 |
15 |
11686 |
192.6 |
-22.3 |
0.345 |
1 |
0 |
0 |
0.238 |
92 |
|
[SF4]9:201 |
8 |
1 |
310 |
f |
9 |
x,y,z |
1_555 |
27 |
15 |
11648 |
186.3 |
-22.1 |
0.365 |
1 |
0 |
0 |
0.238 |
| Average: |
189.4 |
-22.2 |
0.355 |
1 |
0 |
0 |
0.238 |
| 48 |
93 |
|
[SF4]9:202 |
8 |
1 |
310 |
f |
9 |
x,y,z |
1_555 |
27 |
15 |
11648 |
186.3 |
-21.3 |
0.382 |
1 |
0 |
0 |
0.233 |
94 |
|
[SF4]O:202 |
8 |
1 |
310 |
f |
O |
x,y,z |
1_555 |
26 |
15 |
11686 |
185.2 |
-21.4 |
0.392 |
2 |
0 |
0 |
0.233 |
| Average: |
185.8 |
-21.3 |
0.387 |
2 |
0 |
0 |
0.233 |
| 49 |
95 |
|
[SF4]1:501 |
8 |
1 |
310 |
f |
1 |
x,y,z |
1_555 |
25 |
14 |
18870 |
186.2 |
-21.3 |
0.327 |
0 |
0 |
0 |
0.243 |
96 |
|
[SF4]B:501 |
8 |
1 |
310 |
cf |
B |
x,y,z |
1_555 |
23 |
13 |
18709 |
179.8 |
-21.0 |
0.270 |
0 |
0 |
0 |
0.243 |
| Average: |
183.0 |
-21.2 |
0.298 |
0 |
0 |
0 |
0.243 |
| 50 |
97 |
|
R |
20 |
5 |
13342 |
◊ |
U |
x-1,y,z |
1_455 |
23 |
8 |
17766 |
182.8 |
-1.2 |
0.891 |
2 |
0 |
0 |
0.000 |
98 |
|
J |
18 |
5 |
13195 |
◊ |
M |
x-1,y,z |
1_455 |
20 |
7 |
17689 |
154.1 |
-0.8 |
0.894 |
1 |
0 |
0 |
0.000 |
| Average: |
168.5 |
-1.0 |
0.893 |
2 |
0 |
0 |
0.000 |
| 51 |
99 |
|
[SF4]3:801 |
8 |
1 |
310 |
f |
3 |
x,y,z |
1_555 |
29 |
13 |
32264 |
180.1 |
-18.8 |
0.232 |
2 |
0 |
0 |
0.074 |
100 |
|
[SF4]D:801 |
8 |
1 |
309 |
f |
D |
x,y,z |
1_555 |
29 |
13 |
32228 |
173.4 |
-18.8 |
0.209 |
1 |
0 |
0 |
0.074 |
| Average: |
176.8 |
-18.8 |
0.220 |
2 |
0 |
0 |
0.074 |
| 52 |
101 |
|
6 |
26 |
7 |
9509 |
◊ |
D |
x,y,z |
1_555 |
25 |
11 |
32228 |
174.0 |
-0.6 |
0.487 |
1 |
1 |
0 |
0.000 |
102 |
|
G |
20 |
6 |
9525 |
◊ |
3 |
x-1,y,z |
1_455 |
18 |
8 |
32264 |
132.7 |
0.5 |
0.736 |
1 |
1 |
0 |
0.000 |
| Average: |
153.4 |
-0.1 |
0.612 |
1 |
1 |
0 |
0.000 |
| 53 |
103 |
|
[SF4]G:201 |
8 |
1 |
311 |
f |
G |
x,y,z |
1_555 |
27 |
11 |
9525 |
167.3 |
-18.0 |
0.233 |
2 |
0 |
0 |
0.197 |
104 |
|
[SF4]6:201 |
8 |
1 |
308 |
f |
6 |
x,y,z |
1_555 |
28 |
12 |
9509 |
165.6 |
-17.8 |
0.242 |
2 |
0 |
0 |
0.197 |
| Average: |
166.4 |
-17.9 |
0.238 |
2 |
0 |
0 |
0.197 |
| 54 |
105 |
|
I |
9 |
2 |
7727 |
◊ |
B |
x,y,z |
1_555 |
22 |
6 |
18709 |
135.8 |
-2.8 |
0.076 |
0 |
0 |
0 |
0.010 |
106 |
|
7 |
10 |
3 |
7978 |
◊ |
1 |
x,y,z |
1_555 |
21 |
6 |
18870 |
135.0 |
-2.8 |
0.099 |
0 |
0 |
0 |
0.010 |
| Average: |
135.4 |
-2.8 |
0.087 |
0 |
0 |
0 |
0.010 |
| 55 |
107 |
|
[FES]D:804 |
4 |
1 |
234 |
cf |
D |
x,y,z |
1_555 |
20 |
12 |
32228 |
126.8 |
-17.1 |
0.598 |
2 |
0 |
0 |
0.068 |
108 |
|
[FES]3:804 |
4 |
1 |
235 |
cf |
3 |
x,y,z |
1_555 |
19 |
11 |
32264 |
126.2 |
-17.2 |
0.599 |
1 |
0 |
0 |
0.068 |
| Average: |
126.5 |
-17.1 |
0.598 |
2 |
0 |
0 |
0.068 |
| 56 |
109 |
|
W |
13 |
3 |
6835 |
◊ |
9 |
x,y,z |
1_555 |
16 |
4 |
11648 |
126.6 |
0.4 |
0.758 |
5 |
0 |
0 |
0.004 |
110 |
|
X |
11 |
3 |
6672 |
◊ |
O |
x,y,z |
1_555 |
17 |
4 |
11686 |
126.0 |
0.6 |
0.794 |
4 |
0 |
0 |
0.004 |
| Average: |
126.3 |
0.5 |
0.776 |
5 |
0 |
0 |
0.004 |
| 57 |
111 |
|
[FES]C:201 |
4 |
1 |
235 |
f |
C |
x,y,z |
1_555 |
17 |
10 |
10796 |
115.5 |
-15.2 |
0.376 |
2 |
0 |
0 |
0.184 |
112 |
|
[FES]2:201 |
4 |
1 |
235 |
f |
2 |
x,y,z |
1_555 |
17 |
10 |
10671 |
115.1 |
-15.2 |
0.381 |
2 |
0 |
0 |
0.184 |
| Average: |
115.3 |
-15.2 |
0.379 |
2 |
0 |
0 |
0.184 |
| 58 |
113 |
|
U |
15 |
4 |
17766 |
◊ |
T |
x-1,y,z |
1_455 |
13 |
4 |
26747 |
113.3 |
0.1 |
0.832 |
1 |
2 |
0 |
0.000 |
114 |
|
M |
7 |
2 |
17689 |
◊ |
L |
x-1,y,z |
1_455 |
8 |
2 |
26825 |
76.4 |
0.3 |
0.764 |
1 |
1 |
0 |
0.000 |
| Average: |
94.8 |
0.2 |
0.798 |
1 |
2 |
0 |
0.000 |
| 59 |
115 |
|
N |
14 |
6 |
16439 |
◊ |
M |
x-1,y,z |
1_455 |
9 |
4 |
17689 |
71.3 |
-0.5 |
0.792 |
0 |
0 |
0 |
0.000 |
116 |
|
V |
14 |
6 |
16873 |
◊ |
U |
x-1,y,z |
1_455 |
7 |
3 |
17766 |
70.9 |
-0.5 |
0.781 |
0 |
0 |
0 |
0.000 |
| Average: |
71.1 |
-0.5 |
0.787 |
0 |
0 |
0 |
0.000 |
| 60 |
117 |
|
9 |
12 |
4 |
11648 |
◊ |
D |
x,y,z |
1_555 |
12 |
4 |
32228 |
56.5 |
-0.0 |
0.682 |
0 |
0 |
0 |
0.000 |
118 |
|
O |
10 |
4 |
11686 |
◊ |
3 |
x-1,y,z |
1_455 |
6 |
3 |
32264 |
40.0 |
0.3 |
0.763 |
0 |
0 |
0 |
0.000 |
| Average: |
48.3 |
0.1 |
0.723 |
0 |
0 |
0 |
0.000 |
| 61 |
119 |
|
[SF4]G:201 |
4 |
1 |
311 |
◊ |
E |
x,y,z |
1_555 |
10 |
4 |
16903 |
50.6 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.034 |
120 |
|
[SF4]6:201 |
4 |
1 |
308 |
◊ |
4 |
x,y,z |
1_555 |
12 |
4 |
16702 |
48.9 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.034 |
| Average: |
49.8 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.034 |
| 62 |
121 |
|
[SF4]3:801 |
5 |
1 |
310 |
◊ |
4 |
x,y,z |
1_555 |
9 |
4 |
16702 |
48.4 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.016 |
122 |
|
[SF4]D:801 |
5 |
1 |
309 |
◊ |
E |
x,y,z |
1_555 |
9 |
4 |
16903 |
45.6 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.016 |
| Average: |
47.0 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.016 |
| 63 |
123 |
|
[FES]2:201 |
2 |
1 |
235 |
◊ |
1 |
x,y,z |
1_555 |
8 |
5 |
18870 |
30.9 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.037 |
124 |
|
[FES]C:201 |
2 |
1 |
235 |
◊ |
B |
x,y,z |
1_555 |
8 |
5 |
18709 |
30.7 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.037 |
| Average: |
30.8 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.037 |
| 64 |
125 |
|
A |
4 |
1 |
10843 |
◊ |
W |
x,y,z |
1_555 |
2 |
1 |
6835 |
30.4 |
1.5 |
0.944 |
0 |
0 |
0 |
0.000 |
| 65 |
126 |
|
S |
1 |
1 |
7046 |
◊ |
U |
x-1,y,z |
1_455 |
3 |
2 |
17766 |
26.4 |
0.1 |
0.673 |
0 |
0 |
0 |
0.000 |
127 |
|
K |
1 |
1 |
6898 |
◊ |
M |
x-1,y,z |
1_455 |
1 |
1 |
17689 |
10.0 |
-0.0 |
0.458 |
0 |
0 |
0 |
0.000 |
| Average: |
18.2 |
0.0 |
0.565 |
0 |
0 |
0 |
0.000 |
| 66 |
128 |
|
[SF4]6:201 |
4 |
1 |
308 |
◊ |
9 |
x,y,z |
1_555 |
2 |
1 |
11648 |
25.5 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.022 |
| 67 |
129 |
|
[SF4]G:201 |
4 |
1 |
311 |
◊ |
O |
x,y,z |
1_555 |
2 |
1 |
11686 |
24.5 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.022 |
| 68 |
130 |
|
Q |
3 |
2 |
17852 |
◊ |
V |
x-1,y,z |
1_455 |
4 |
1 |
16873 |
9.4 |
-0.3 |
0.632 |
0 |
0 |
0 |
0.000 |
131 |
|
H |
1 |
1 |
18020 |
◊ |
N |
x-1,y,z |
1_455 |
2 |
1 |
16439 |
6.6 |
-0.2 |
0.414 |
0 |
0 |
0 |
0.000 |
| Average: |
8.0 |
-0.3 |
0.523 |
0 |
0 |
0 |
0.000 |
| 69 |
132 |
|
[DCQ]E:501 |
2 |
1 |
582 |
◊ |
Q |
x,y,z |
1_555 |
1 |
1 |
17852 |
9.0 |
-0.0 |
0.706 |
0 |
0 |
0 |
0.000 |
133 |
|
[DCQ]4:501 |
1 |
1 |
583 |
◊ |
H |
x,y,z |
1_555 |
1 |
1 |
18020 |
3.9 |
-0.0 |
0.648 |
0 |
0 |
0 |
0.000 |
| Average: |
6.5 |
-0.0 |
0.677 |
0 |
0 |
0 |
0.000 |
| 70 |
134 |
|
[SF4]9:201 |
1 |
1 |
310 |
◊ |
4 |
x,y,z |
1_555 |
1 |
1 |
16702 |
6.0 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.004 |
135 |
|
[SF4]O:201 |
1 |
1 |
310 |
◊ |
E |
x,y,z |
1_555 |
1 |
1 |
16903 |
4.7 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.004 |
| Average: |
5.3 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.004 |
| 71 |
136 |
|
[SF4]9:202 |
1 |
1 |
310 |
◊ |
3 |
x,y,z |
1_555 |
1 |
1 |
32264 |
3.1 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.001 |
| 72 |
137 |
|
[FMN]B:502 |
1 |
1 |
610 |
f |
[SF4]B:501 |
x,y,z |
1_555 |
1 |
1 |
310 |
2.1 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.003 |
| 73 |
138 |
|
[SF4]9:201 |
1 |
1 |
310 |
◊ |
6 |
x,y,z |
1_555 |
1 |
1 |
9509 |
0.6 |
-0.0 |
0.000 |
0 |
0 |
0 |
0.000 |
|