| ## |
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 |
|
B |
55 |
15 |
9367 |
◊ |
A |
x,y,z |
1_555 |
50 |
17 |
9103 |
475.8 |
-15.1 |
0.040 |
0 |
0 |
0 |
0.000 |
| 2 |
2 |
|
A |
47 |
13 |
9103 |
x |
A |
x-1/2,y+1/2,z |
3_455 |
35 |
11 |
9103 |
387.0 |
-4.4 |
0.870 |
3 |
0 |
0 |
0.000 |
3 |
|
B |
46 |
14 |
9367 |
x |
B |
x-1/2,y-1/2,z |
3_445 |
35 |
10 |
9367 |
330.0 |
-5.0 |
0.779 |
0 |
0 |
0 |
0.000 |
| Average: |
358.5 |
-4.7 |
0.825 |
2 |
0 |
0 |
0.000 |
| 3 |
4 |
|
[26G]A:203 |
18 |
1 |
452 |
f |
A |
x,y,z |
1_555 |
56 |
19 |
9103 |
315.7 |
-0.7 |
0.766 |
2 |
0 |
0 |
0.000 |
5 |
|
[26G]B:206 |
18 |
1 |
454 |
f |
B |
x,y,z |
1_555 |
58 |
19 |
9367 |
307.1 |
-0.7 |
0.757 |
2 |
0 |
0 |
0.000 |
| Average: |
311.4 |
-0.7 |
0.762 |
2 |
0 |
0 |
0.000 |
| 4 |
6 |
|
[P6G]B:226 |
19 |
1 |
557 |
f |
B |
x,y,z |
1_555 |
33 |
16 |
9367 |
280.9 |
-4.8 |
0.206 |
0 |
0 |
0 |
0.000 |
| 5 |
7 |
|
[P6G]A:220 |
19 |
1 |
549 |
f |
A |
x,y,z |
1_555 |
28 |
12 |
9103 |
276.1 |
-3.0 |
0.268 |
0 |
0 |
0 |
0.000 |
| 6 |
8 |
|
[BNG]B:201 |
17 |
1 |
547 |
f |
B |
x,y,z |
1_555 |
33 |
8 |
9367 |
238.6 |
3.1 |
0.517 |
1 |
0 |
0 |
0.000 |
| 7 |
9 |
|
[P6G]A:221 |
19 |
1 |
553 |
f |
A |
x,y,z |
1_555 |
38 |
13 |
9103 |
232.7 |
-1.3 |
0.444 |
1 |
0 |
0 |
0.000 |
| 8 |
10 |
|
[P6G]B:225 |
16 |
1 |
537 |
f |
B |
x,y,z |
1_555 |
38 |
12 |
9367 |
227.4 |
-3.7 |
0.285 |
1 |
0 |
0 |
0.000 |
| 9 |
11 |
|
[PG4]A:210 |
13 |
1 |
386 |
f |
A |
x,y,z |
1_555 |
33 |
12 |
9103 |
224.0 |
4.0 |
0.399 |
3 |
0 |
0 |
0.000 |
| 10 |
12 |
|
[PG4]A:211 |
13 |
1 |
402 |
f |
A |
x,y,z |
1_555 |
20 |
9 |
9103 |
218.0 |
2.7 |
0.367 |
1 |
0 |
0 |
0.000 |
| 11 |
13 |
|
[BNG]B:203 |
18 |
1 |
552 |
f |
B |
x,y,z |
1_555 |
25 |
10 |
9367 |
214.4 |
0.1 |
0.141 |
0 |
0 |
0 |
0.000 |
| 12 |
14 |
|
[PG4]B:209 |
13 |
1 |
383 |
f |
B |
x,y,z |
1_555 |
32 |
11 |
9367 |
211.4 |
3.3 |
0.413 |
2 |
0 |
0 |
0.000 |
| 13 |
15 |
|
[P6G]A:218 |
17 |
1 |
521 |
f |
A |
x,y,z |
1_555 |
24 |
9 |
9103 |
203.8 |
-2.0 |
0.291 |
0 |
0 |
0 |
0.000 |
| 14 |
16 |
|
[P6G]B:224 |
16 |
1 |
480 |
f |
B |
x,y,z |
1_555 |
21 |
9 |
9367 |
201.4 |
-2.3 |
0.291 |
0 |
0 |
0 |
0.000 |
| 15 |
17 |
|
[BNG]A:202 |
14 |
1 |
562 |
◊ |
A |
x,y,z |
1_555 |
26 |
9 |
9103 |
200.5 |
2.7 |
0.444 |
0 |
0 |
0 |
0.000 |
| 16 |
18 |
|
[P6G]A:219 |
16 |
1 |
559 |
◊ |
A |
x,y,z |
1_555 |
22 |
8 |
9103 |
193.4 |
1.3 |
0.555 |
2 |
0 |
0 |
0.000 |
| 17 |
19 |
|
[BNG]B:202 |
17 |
1 |
545 |
◊ |
B |
x,y,z |
1_555 |
30 |
8 |
9367 |
193.0 |
2.5 |
0.242 |
2 |
0 |
0 |
0.000 |
| 18 |
20 |
|
[BNG]A:201 |
19 |
1 |
531 |
◊ |
[BNG]A:201 |
-x+1,y,-z+1 |
2_656 |
19 |
1 |
531 |
191.3 |
7.4 |
0.123 |
0 |
0 |
0 |
0.000 |
| 19 |
21 |
|
[BNG]B:204 |
15 |
1 |
557 |
◊ |
B |
x,y,z |
1_555 |
26 |
10 |
9367 |
189.2 |
3.0 |
0.448 |
0 |
0 |
0 |
0.000 |
| 20 |
22 |
|
[BNG]B:205 |
14 |
1 |
560 |
◊ |
B |
x,y,z |
1_555 |
25 |
7 |
9367 |
169.8 |
0.7 |
0.244 |
0 |
0 |
0 |
0.000 |
| 21 |
23 |
|
[PG4]A:207 |
12 |
1 |
411 |
◊ |
A |
x,y,z |
1_555 |
18 |
9 |
9103 |
163.2 |
2.0 |
0.241 |
0 |
0 |
0 |
0.000 |
| 22 |
24 |
|
[PG4]A:206 |
12 |
1 |
404 |
◊ |
A |
x,y,z |
1_555 |
17 |
5 |
9103 |
155.3 |
2.6 |
0.266 |
0 |
0 |
0 |
0.000 |
| 23 |
25 |
|
[1PE]B:222 |
16 |
1 |
463 |
f |
B |
x,y,z |
1_555 |
21 |
7 |
9367 |
155.1 |
-0.8 |
0.730 |
0 |
0 |
0 |
0.000 |
| 24 |
26 |
|
[PG4]B:208 |
11 |
1 |
415 |
◊ |
B |
x,y,z |
1_555 |
17 |
7 |
9367 |
154.7 |
2.6 |
0.319 |
0 |
0 |
0 |
0.000 |
| 25 |
27 |
|
[PG4]A:205 |
9 |
1 |
394 |
f |
A |
x,y,z |
1_555 |
24 |
9 |
9103 |
151.8 |
0.8 |
0.379 |
0 |
0 |
0 |
0.000 |
| 26 |
28 |
|
[BNG]A:201 |
17 |
1 |
531 |
◊ |
A |
x,y,z |
1_555 |
19 |
10 |
9103 |
151.1 |
1.9 |
0.268 |
0 |
0 |
0 |
0.000 |
| 27 |
29 |
|
B |
15 |
6 |
9367 |
◊ |
B |
-x+1,y,-z |
2_655 |
15 |
6 |
9367 |
139.9 |
-3.0 |
0.399 |
0 |
0 |
0 |
0.000 |
30 |
|
A |
14 |
5 |
9103 |
◊ |
A |
-x+1,y,-z+1 |
2_656 |
14 |
5 |
9103 |
137.3 |
-3.4 |
0.369 |
0 |
0 |
0 |
0.000 |
| Average: |
138.6 |
-3.2 |
0.384 |
0 |
0 |
0 |
0.000 |
| 28 |
31 |
|
[BNG]A:201 |
18 |
1 |
531 |
f |
A |
-x+1,y,-z+1 |
2_656 |
15 |
7 |
9103 |
138.3 |
1.2 |
0.162 |
0 |
0 |
0 |
0.000 |
| 29 |
32 |
|
[BNG]B:201 |
14 |
1 |
547 |
◊ |
A |
x,y,z |
1_555 |
19 |
6 |
9103 |
137.2 |
1.1 |
0.255 |
0 |
0 |
0 |
0.000 |
| 30 |
33 |
|
[PG4]B:207 |
11 |
1 |
415 |
◊ |
B |
x,y,z |
1_555 |
14 |
6 |
9367 |
134.1 |
2.6 |
0.338 |
0 |
0 |
0 |
0.000 |
| 31 |
34 |
|
[PG4]A:208 |
12 |
1 |
398 |
◊ |
A |
x,y,z |
1_555 |
20 |
7 |
9103 |
129.7 |
3.3 |
0.386 |
0 |
0 |
0 |
0.000 |
| 32 |
35 |
|
[PEG]B:210 |
7 |
1 |
258 |
f |
B |
x,y,z |
1_555 |
15 |
6 |
9367 |
127.7 |
0.8 |
0.243 |
1 |
0 |
0 |
0.000 |
| 33 |
36 |
|
[BNG]B:203 |
16 |
1 |
552 |
◊ |
B |
-x+1,y,-z |
2_655 |
14 |
5 |
9367 |
127.2 |
0.7 |
0.134 |
0 |
0 |
0 |
0.000 |
| 34 |
37 |
|
[PEG]B:216 |
7 |
1 |
254 |
f |
B |
x,y,z |
1_555 |
20 |
6 |
9367 |
122.8 |
1.4 |
0.336 |
1 |
0 |
0 |
0.000 |
| 35 |
38 |
|
[PEG]B:214 |
6 |
1 |
260 |
f |
B |
x,y,z |
1_555 |
19 |
8 |
9367 |
118.5 |
3.4 |
0.624 |
1 |
0 |
0 |
0.000 |
| 36 |
39 |
|
[PEG]B:221 |
6 |
1 |
248 |
◊ |
B |
x,y,z |
1_555 |
12 |
6 |
9367 |
116.9 |
0.7 |
0.281 |
0 |
0 |
0 |
0.000 |
| 37 |
40 |
|
[BNG]B:202 |
14 |
1 |
545 |
◊ |
[BNG]A:202 |
x,y,z |
1_555 |
14 |
1 |
562 |
116.1 |
4.6 |
0.071 |
0 |
0 |
0 |
0.000 |
| 38 |
41 |
|
[PEG]A:212 |
7 |
1 |
258 |
f |
A |
x,y,z |
1_555 |
13 |
5 |
9103 |
115.6 |
1.3 |
0.293 |
0 |
0 |
0 |
0.000 |
| 39 |
42 |
|
[PEG]A:213 |
7 |
1 |
256 |
◊ |
A |
x,y,z |
1_555 |
13 |
6 |
9103 |
114.4 |
3.1 |
0.420 |
0 |
0 |
0 |
0.000 |
| 40 |
43 |
|
[PG0]A:217 |
8 |
1 |
287 |
f |
A |
x,y,z |
1_555 |
15 |
7 |
9103 |
114.3 |
2.9 |
0.180 |
2 |
0 |
0 |
0.000 |
| 41 |
44 |
|
[PG0]B:223 |
8 |
1 |
297 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
9367 |
114.1 |
2.2 |
0.130 |
0 |
0 |
0 |
0.000 |
| 42 |
45 |
|
[PG4]A:209 |
10 |
1 |
401 |
f |
A |
x,y,z |
1_555 |
18 |
6 |
9103 |
106.1 |
2.3 |
0.404 |
0 |
0 |
0 |
0.000 |
| 43 |
46 |
|
[PEG]B:211 |
6 |
1 |
258 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
9367 |
104.1 |
2.5 |
0.501 |
0 |
0 |
0 |
0.000 |
| 44 |
47 |
|
[PG4]A:204 |
7 |
1 |
411 |
f |
A |
x,y,z |
1_555 |
14 |
5 |
9103 |
94.8 |
-1.4 |
0.208 |
1 |
0 |
0 |
0.000 |
| 45 |
48 |
|
[PEG]B:217 |
7 |
1 |
257 |
◊ |
B |
x,y,z |
1_555 |
12 |
3 |
9367 |
91.7 |
1.3 |
0.274 |
0 |
0 |
0 |
0.000 |
| 46 |
49 |
|
[PEG]B:213 |
7 |
1 |
253 |
f |
B |
x,y,z |
1_555 |
14 |
6 |
9367 |
91.4 |
0.4 |
0.181 |
1 |
0 |
0 |
0.000 |
| 47 |
50 |
|
[PEG]B:218 |
7 |
1 |
258 |
f |
B |
x,y,z |
1_555 |
13 |
3 |
9367 |
88.2 |
1.0 |
0.275 |
0 |
0 |
0 |
0.000 |
| 48 |
51 |
|
[1PE]B:222 |
9 |
1 |
463 |
◊ |
[BNG]B:203 |
-x+1,y,-z |
2_655 |
7 |
1 |
552 |
85.5 |
0.5 |
0.284 |
0 |
0 |
0 |
0.000 |
| 49 |
52 |
|
[PEG]A:215 |
7 |
1 |
249 |
◊ |
A |
x,y,z |
1_555 |
16 |
6 |
9103 |
83.2 |
1.0 |
0.350 |
0 |
0 |
0 |
0.000 |
| 50 |
53 |
|
[P6G]B:225 |
11 |
1 |
537 |
◊ |
[P6G]A:221 |
x,y,z |
1_555 |
11 |
1 |
553 |
82.7 |
1.4 |
0.322 |
0 |
0 |
0 |
0.000 |
| 51 |
54 |
|
[PEG]A:214 |
7 |
1 |
255 |
◊ |
A |
x,y,z |
1_555 |
13 |
6 |
9103 |
82.6 |
0.5 |
0.219 |
0 |
0 |
0 |
0.000 |
| 52 |
55 |
|
[BNG]B:205 |
8 |
1 |
560 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
9103 |
82.4 |
0.6 |
0.271 |
0 |
0 |
0 |
0.000 |
| 53 |
56 |
|
[PEG]B:219 |
7 |
1 |
255 |
f |
B |
x,y,z |
1_555 |
9 |
3 |
9367 |
81.4 |
-0.3 |
0.139 |
0 |
0 |
0 |
0.000 |
| 54 |
57 |
|
[PEG]B:220 |
6 |
1 |
251 |
◊ |
B |
x,y,z |
1_555 |
9 |
5 |
9367 |
81.2 |
1.0 |
0.284 |
1 |
0 |
0 |
0.000 |
| 55 |
58 |
|
[PEG]B:215 |
7 |
1 |
257 |
◊ |
B |
x,y,z |
1_555 |
9 |
4 |
9367 |
79.0 |
0.1 |
0.146 |
0 |
0 |
0 |
0.000 |
| 56 |
59 |
|
[P6G]B:225 |
13 |
1 |
537 |
◊ |
A |
x,y,z |
1_555 |
8 |
4 |
9103 |
78.2 |
-1.1 |
0.224 |
0 |
0 |
0 |
0.000 |
| 57 |
60 |
|
[PG4]A:204 |
9 |
1 |
411 |
◊ |
B |
x,y,z |
1_555 |
9 |
4 |
9367 |
77.1 |
1.4 |
0.282 |
0 |
0 |
0 |
0.000 |
| 58 |
61 |
|
A |
8 |
3 |
9103 |
f |
[PEG]A:216 |
x-1/2,y+1/2,z |
3_455 |
7 |
1 |
252 |
69.7 |
0.8 |
0.191 |
0 |
0 |
0 |
0.000 |
| 59 |
62 |
|
[PG4]B:209 |
4 |
1 |
383 |
f |
[26G]B:206 |
x,y,z |
1_555 |
11 |
1 |
454 |
68.1 |
0.4 |
0.305 |
0 |
0 |
0 |
0.000 |
| 60 |
63 |
|
[PG4]A:208 |
5 |
1 |
398 |
◊ |
[PG4]A:204 |
x,y,z |
1_555 |
9 |
1 |
411 |
67.2 |
4.0 |
0.218 |
0 |
0 |
0 |
0.000 |
| 61 |
64 |
|
[PEG]B:212 |
6 |
1 |
261 |
◊ |
B |
x,y,z |
1_555 |
7 |
4 |
9367 |
65.2 |
1.4 |
0.259 |
0 |
0 |
0 |
0.000 |
| 62 |
65 |
|
[P6G]A:221 |
7 |
1 |
553 |
f |
[PG4]A:205 |
x,y,z |
1_555 |
7 |
1 |
394 |
63.9 |
-1.8 |
0.067 |
1 |
0 |
0 |
0.000 |
| 63 |
66 |
|
[BNG]B:205 |
4 |
1 |
560 |
f |
[BNG]B:204 |
x,y,z |
1_555 |
11 |
1 |
557 |
62.2 |
1.6 |
0.111 |
1 |
0 |
0 |
0.000 |
| 64 |
67 |
|
[PG4]A:205 |
6 |
1 |
394 |
◊ |
B |
x,y,z |
1_555 |
5 |
3 |
9367 |
61.9 |
1.2 |
0.264 |
0 |
0 |
0 |
0.000 |
| 65 |
68 |
|
[P6G]B:225 |
6 |
1 |
537 |
◊ |
[PEG]B:217 |
x,y,z |
1_555 |
5 |
1 |
257 |
60.2 |
1.0 |
0.129 |
1 |
0 |
0 |
0.000 |
| 66 |
69 |
|
[P6G]A:221 |
8 |
1 |
553 |
◊ |
B |
x,y,z |
1_555 |
8 |
5 |
9367 |
60.2 |
-0.5 |
0.309 |
0 |
0 |
0 |
0.000 |
| 67 |
70 |
|
[BNG]B:202 |
6 |
1 |
545 |
f |
A |
x,y,z |
1_555 |
7 |
4 |
9103 |
60.1 |
-1.0 |
0.122 |
0 |
0 |
0 |
0.000 |
| 68 |
71 |
|
[PEG]A:215 |
5 |
1 |
249 |
◊ |
[BNG]B:205 |
x,y,z |
1_555 |
10 |
1 |
560 |
59.6 |
2.7 |
0.131 |
0 |
0 |
0 |
0.000 |
| 69 |
72 |
|
[PG4]A:204 |
6 |
1 |
411 |
f |
[BNG]B:205 |
x,y,z |
1_555 |
6 |
1 |
560 |
59.3 |
3.0 |
0.216 |
0 |
0 |
0 |
0.000 |
| 70 |
73 |
|
[P6G]A:219 |
7 |
1 |
559 |
◊ |
[P6G]A:218 |
x,y,z |
1_555 |
4 |
1 |
521 |
55.9 |
0.6 |
0.257 |
0 |
0 |
0 |
0.000 |
| 71 |
74 |
|
[PG4]B:208 |
7 |
1 |
415 |
◊ |
[PG4]A:204 |
x,y,z |
1_555 |
8 |
1 |
411 |
55.3 |
3.3 |
0.145 |
0 |
0 |
0 |
0.000 |
| 72 |
75 |
|
[1PE]B:222 |
6 |
1 |
463 |
f |
[PEG]B:210 |
x,y,z |
1_555 |
4 |
1 |
258 |
55.2 |
2.5 |
0.469 |
0 |
0 |
0 |
0.000 |
| 73 |
76 |
|
[PG4]A:206 |
5 |
1 |
404 |
f |
B |
x,y,z |
1_555 |
4 |
2 |
9367 |
51.9 |
1.0 |
0.220 |
0 |
0 |
0 |
0.000 |
| 74 |
77 |
|
[PEG]B:212 |
5 |
1 |
261 |
f |
[BNG]B:204 |
x,y,z |
1_555 |
10 |
1 |
557 |
50.1 |
2.0 |
0.090 |
0 |
0 |
0 |
0.000 |
| 75 |
78 |
|
[PEG]B:213 |
6 |
1 |
253 |
◊ |
A |
x,y,z |
1_555 |
6 |
4 |
9103 |
50.0 |
0.8 |
0.192 |
0 |
0 |
0 |
0.000 |
| 76 |
79 |
|
[P6G]A:221 |
10 |
1 |
553 |
f |
[PEG]B:217 |
x,y,z |
1_555 |
6 |
1 |
257 |
49.4 |
1.8 |
0.164 |
0 |
0 |
0 |
0.000 |
| 77 |
80 |
|
[P6G]B:224 |
5 |
1 |
480 |
◊ |
[PG4]B:207 |
x,y,z |
1_555 |
5 |
1 |
415 |
48.9 |
2.7 |
0.393 |
0 |
0 |
0 |
0.000 |
| 78 |
81 |
|
[PEG]B:220 |
4 |
1 |
251 |
◊ |
[PEG]B:219 |
x,y,z |
1_555 |
6 |
1 |
255 |
47.8 |
2.7 |
0.149 |
0 |
0 |
0 |
0.000 |
| 79 |
82 |
|
[1PE]B:222 |
3 |
1 |
463 |
◊ |
B |
-x+1,y,-z |
2_655 |
8 |
3 |
9367 |
46.1 |
-0.5 |
0.539 |
0 |
0 |
0 |
0.000 |
| 80 |
83 |
|
[PEG]A:215 |
6 |
1 |
249 |
f |
B |
x,y,z |
1_555 |
10 |
2 |
9367 |
45.5 |
-0.5 |
0.148 |
0 |
0 |
0 |
0.000 |
| 81 |
84 |
|
[BNG]B:201 |
8 |
1 |
547 |
f |
[BNG]A:202 |
x,y,z |
1_555 |
9 |
1 |
562 |
44.9 |
1.1 |
0.068 |
3 |
0 |
0 |
0.000 |
| 82 |
85 |
|
[PEG]A:216 |
4 |
1 |
252 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
9103 |
44.0 |
1.3 |
0.354 |
1 |
0 |
0 |
0.000 |
| 83 |
86 |
|
[PG0]A:217 |
3 |
1 |
287 |
f |
[PG4]A:209 |
x,y,z |
1_555 |
4 |
1 |
401 |
42.8 |
2.2 |
0.184 |
1 |
0 |
0 |
0.000 |
| 84 |
87 |
|
[P6G]B:226 |
4 |
1 |
557 |
f |
[PEG]B:214 |
x,y,z |
1_555 |
2 |
1 |
260 |
42.1 |
1.6 |
0.393 |
0 |
0 |
0 |
0.000 |
| 85 |
88 |
|
[PEG]B:218 |
2 |
1 |
258 |
f |
[PEG]B:216 |
x,y,z |
1_555 |
4 |
1 |
254 |
40.7 |
1.6 |
0.180 |
0 |
0 |
0 |
0.000 |
| 86 |
89 |
|
[P6G]A:219 |
2 |
1 |
559 |
f |
A |
-x+1,y,-z+1 |
2_656 |
6 |
2 |
9103 |
39.7 |
-0.3 |
0.552 |
1 |
0 |
0 |
0.000 |
| 87 |
90 |
|
[PEG]B:212 |
5 |
1 |
261 |
◊ |
[PEG]A:214 |
x,y,z |
1_555 |
5 |
1 |
255 |
39.7 |
1.9 |
0.111 |
0 |
0 |
0 |
0.000 |
| 88 |
91 |
|
[P6G]B:225 |
6 |
1 |
537 |
◊ |
[PG4]A:205 |
x,y,z |
1_555 |
3 |
1 |
394 |
38.9 |
2.2 |
0.434 |
0 |
0 |
0 |
0.000 |
| 89 |
92 |
|
[PEG]B:212 |
6 |
1 |
261 |
◊ |
[PEG]A:215 |
x,y,z |
1_555 |
5 |
1 |
249 |
38.6 |
2.0 |
0.106 |
0 |
0 |
0 |
0.000 |
| 90 |
93 |
|
[PG0]A:217 |
6 |
1 |
287 |
◊ |
A |
x-1/2,y+1/2,z |
3_455 |
4 |
3 |
9103 |
38.0 |
1.0 |
0.082 |
0 |
0 |
0 |
0.000 |
| 91 |
94 |
|
[P6G]B:226 |
4 |
1 |
557 |
f |
[PEG]B:213 |
x,y,z |
1_555 |
2 |
1 |
253 |
36.7 |
2.1 |
0.497 |
0 |
0 |
0 |
0.000 |
| 92 |
95 |
|
[PEG]B:211 |
2 |
1 |
258 |
f |
[PG4]B:209 |
x,y,z |
1_555 |
4 |
1 |
383 |
36.1 |
1.3 |
0.243 |
0 |
0 |
0 |
0.000 |
| 93 |
96 |
|
[PEG]A:214 |
5 |
1 |
255 |
◊ |
[BNG]B:204 |
x,y,z |
1_555 |
4 |
1 |
557 |
35.1 |
1.0 |
0.109 |
0 |
0 |
0 |
0.000 |
| 94 |
97 |
|
[P6G]A:221 |
4 |
1 |
553 |
◊ |
[PEG]A:214 |
x,y,z |
1_555 |
2 |
1 |
255 |
34.4 |
1.6 |
0.435 |
0 |
0 |
0 |
0.000 |
| 95 |
98 |
|
[P6G]B:226 |
2 |
1 |
557 |
f |
[PEG]B:218 |
x,y,z |
1_555 |
2 |
1 |
258 |
33.9 |
1.2 |
0.426 |
0 |
0 |
0 |
0.000 |
| 96 |
99 |
|
[PG4]A:210 |
3 |
1 |
386 |
f |
[26G]A:203 |
x,y,z |
1_555 |
3 |
1 |
452 |
33.5 |
-2.1 |
0.128 |
0 |
0 |
0 |
0.000 |
| 97 |
100 |
|
[PG4]A:208 |
3 |
1 |
398 |
◊ |
[BNG]B:205 |
x,y,z |
1_555 |
4 |
1 |
560 |
33.0 |
2.0 |
0.291 |
0 |
0 |
0 |
0.000 |
| 98 |
101 |
|
[PEG]B:212 |
2 |
1 |
261 |
f |
[BNG]B:205 |
x,y,z |
1_555 |
6 |
1 |
560 |
32.9 |
1.8 |
0.244 |
0 |
0 |
0 |
0.000 |
| 99 |
102 |
|
[PG4]B:208 |
2 |
1 |
415 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
9103 |
32.7 |
0.3 |
0.289 |
0 |
0 |
0 |
0.000 |
| 100 |
103 |
|
[PEG]A:213 |
4 |
1 |
256 |
f |
[BNG]B:201 |
x,y,z |
1_555 |
3 |
1 |
547 |
32.7 |
0.8 |
0.124 |
0 |
0 |
0 |
0.000 |
| 101 |
104 |
|
[PEG]A:213 |
3 |
1 |
256 |
f |
B |
x,y,z |
1_555 |
4 |
2 |
9367 |
32.6 |
0.2 |
0.247 |
0 |
0 |
0 |
0.000 |
| 102 |
105 |
|
[PEG]B:215 |
2 |
1 |
257 |
f |
[BNG]B:202 |
x,y,z |
1_555 |
3 |
1 |
545 |
32.2 |
1.3 |
0.239 |
0 |
0 |
0 |
0.000 |
| 103 |
106 |
|
[PEG]B:214 |
5 |
1 |
260 |
f |
[PEG]B:213 |
x,y,z |
1_555 |
3 |
1 |
253 |
26.7 |
0.5 |
0.075 |
0 |
0 |
0 |
0.000 |
| 104 |
107 |
|
[PEG]B:221 |
4 |
1 |
248 |
f |
B |
-x+1,y,-z |
2_655 |
4 |
2 |
9367 |
26.2 |
0.1 |
0.243 |
0 |
0 |
0 |
0.000 |
| 105 |
108 |
|
[BNG]B:202 |
3 |
1 |
545 |
◊ |
[BNG]B:201 |
x,y,z |
1_555 |
3 |
1 |
547 |
25.1 |
0.8 |
0.214 |
0 |
0 |
0 |
0.000 |
| 106 |
109 |
|
[PG4]B:208 |
2 |
1 |
415 |
◊ |
[PG4]A:206 |
x,y,z |
1_555 |
2 |
1 |
404 |
24.0 |
1.2 |
0.230 |
0 |
0 |
0 |
0.000 |
| 107 |
110 |
|
[P6G]A:219 |
3 |
1 |
559 |
◊ |
[BNG]A:201 |
-x+1,y,-z+1 |
2_656 |
4 |
1 |
531 |
22.8 |
0.6 |
0.263 |
0 |
0 |
0 |
0.000 |
| 108 |
111 |
|
[BNG]B:203 |
2 |
1 |
552 |
◊ |
[BNG]B:203 |
-x+1,y,-z |
2_655 |
2 |
1 |
552 |
22.5 |
0.5 |
0.261 |
0 |
0 |
0 |
0.000 |
| 109 |
112 |
|
[PEG]B:213 |
4 |
1 |
253 |
f |
[PG4]A:206 |
x,y,z |
1_555 |
3 |
1 |
404 |
22.4 |
1.4 |
0.143 |
0 |
0 |
0 |
0.000 |
| 110 |
113 |
|
[BNG]A:202 |
6 |
1 |
562 |
f |
B |
x,y,z |
1_555 |
4 |
1 |
9367 |
21.9 |
0.7 |
0.314 |
0 |
0 |
0 |
0.000 |
| 111 |
114 |
|
[P6G]A:221 |
3 |
1 |
553 |
f |
[PG4]A:209 |
x,y,z |
1_555 |
5 |
1 |
401 |
20.8 |
1.2 |
0.321 |
0 |
0 |
0 |
0.000 |
| 112 |
115 |
|
[PEG]A:214 |
2 |
1 |
255 |
f |
B |
x,y,z |
1_555 |
3 |
2 |
9367 |
18.6 |
0.1 |
0.336 |
0 |
0 |
0 |
0.000 |
| 113 |
116 |
|
[P6G]B:226 |
2 |
1 |
557 |
f |
[PG4]A:206 |
x,y,z |
1_555 |
2 |
1 |
404 |
18.2 |
0.8 |
0.319 |
0 |
0 |
0 |
0.000 |
| 114 |
117 |
|
[PEG]A:215 |
2 |
1 |
249 |
f |
[PEG]A:214 |
x,y,z |
1_555 |
3 |
1 |
255 |
17.8 |
0.1 |
0.134 |
0 |
0 |
0 |
0.000 |
| 115 |
118 |
|
[1PE]B:222 |
2 |
1 |
463 |
◊ |
[1PE]B:222 |
-x+1,y,-z |
2_655 |
2 |
1 |
463 |
17.6 |
0.3 |
0.641 |
1 |
0 |
0 |
0.000 |
| 116 |
119 |
|
[P6G]A:219 |
3 |
1 |
559 |
◊ |
[P6G]A:219 |
-x+1,y,-z+1 |
2_656 |
3 |
1 |
559 |
17.3 |
-0.1 |
0.335 |
0 |
0 |
0 |
0.000 |
| 117 |
120 |
|
[PEG]B:212 |
2 |
1 |
261 |
f |
A |
x,y,z |
1_555 |
1 |
1 |
9103 |
14.2 |
0.1 |
0.215 |
0 |
0 |
0 |
0.000 |
| 118 |
121 |
|
[PEG]B:215 |
2 |
1 |
257 |
f |
[PG4]A:205 |
x,y,z |
1_555 |
1 |
1 |
394 |
12.8 |
0.5 |
0.210 |
0 |
0 |
0 |
0.000 |
| 119 |
122 |
|
[PEG]B:220 |
3 |
1 |
251 |
f |
B |
x-1/2,y-1/2,z |
3_445 |
2 |
1 |
9367 |
12.2 |
0.0 |
0.225 |
0 |
0 |
0 |
0.000 |
| 120 |
123 |
|
[P6G]A:220 |
2 |
1 |
549 |
◊ |
[PG4]A:208 |
x,y,z |
1_555 |
2 |
1 |
398 |
10.7 |
0.6 |
0.326 |
0 |
0 |
0 |
0.000 |
| 121 |
124 |
|
[P6G]A:221 |
2 |
1 |
553 |
f |
[PG0]A:217 |
x,y,z |
1_555 |
3 |
1 |
287 |
9.9 |
0.5 |
0.651 |
0 |
0 |
0 |
0.000 |
| 122 |
125 |
|
[PG4]A:207 |
3 |
1 |
411 |
f |
[BNG]A:202 |
x,y,z |
1_555 |
5 |
1 |
562 |
8.9 |
0.3 |
0.124 |
0 |
0 |
0 |
0.000 |
| 123 |
126 |
|
[PEG]B:217 |
2 |
1 |
257 |
◊ |
[PEG]A:214 |
x,y,z |
1_555 |
1 |
1 |
255 |
8.5 |
0.4 |
0.171 |
0 |
0 |
0 |
0.000 |
| 124 |
127 |
|
[PEG]B:213 |
2 |
1 |
253 |
f |
[BNG]B:201 |
x,y,z |
1_555 |
2 |
1 |
547 |
8.1 |
0.1 |
0.145 |
0 |
0 |
0 |
0.000 |
| 125 |
128 |
|
[PEG]B:217 |
3 |
1 |
257 |
f |
[BNG]B:204 |
x,y,z |
1_555 |
1 |
1 |
557 |
8.0 |
0.1 |
0.156 |
0 |
0 |
0 |
0.000 |
| 126 |
129 |
|
[PEG]B:215 |
1 |
1 |
257 |
f |
A |
x,y,z |
1_555 |
1 |
1 |
9103 |
7.9 |
-0.3 |
0.219 |
0 |
0 |
0 |
0.000 |
| 127 |
130 |
|
[PG4]A:208 |
1 |
1 |
398 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
9367 |
5.4 |
0.1 |
0.356 |
0 |
0 |
0 |
0.000 |
| 128 |
131 |
|
[PEG]B:217 |
1 |
1 |
257 |
f |
A |
x,y,z |
1_555 |
1 |
1 |
9103 |
3.0 |
0.1 |
0.369 |
0 |
0 |
0 |
0.000 |
| 129 |
132 |
|
[PEG]B:221 |
1 |
1 |
248 |
f |
[PG4]B:207 |
x,y,z |
1_555 |
1 |
1 |
415 |
1.4 |
0.1 |
0.210 |
0 |
0 |
0 |
0.000 |
| 130 |
133 |
|
B |
1 |
1 |
9367 |
f |
[PG4]B:208 |
x-1/2,y-1/2,z |
3_445 |
1 |
1 |
415 |
1.0 |
-0.1 |
0.308 |
0 |
0 |
0 |
0.000 |
|