| ## |
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 |
|
M |
300 |
83 |
21665 |
◊ |
L |
x,y,z |
1_555 |
299 |
81 |
21505 |
2736.6 |
-19.1 |
0.105 |
34 |
10 |
0 |
0.495 |
| 2 |
2 |
|
X |
255 |
70 |
21485 |
◊ |
T |
x,y,z |
1_555 |
244 |
70 |
21668 |
2379.2 |
-17.3 |
0.176 |
27 |
12 |
0 |
0.469 |
3 |
|
O |
256 |
68 |
21472 |
◊ |
K |
x,y,z |
1_555 |
246 |
71 |
21685 |
2359.0 |
-16.8 |
0.191 |
27 |
14 |
0 |
0.469 |
4 |
|
F |
245 |
64 |
21470 |
◊ |
B |
x,y,z |
1_555 |
240 |
69 |
21721 |
2284.3 |
-14.0 |
0.250 |
32 |
13 |
0 |
0.469 |
5 |
|
V |
235 |
69 |
21703 |
◊ |
U |
x,y,z |
1_555 |
232 |
65 |
21346 |
2112.6 |
-14.7 |
0.203 |
28 |
5 |
0 |
0.469 |
6 |
|
D |
217 |
64 |
21699 |
◊ |
C |
x,y,z |
1_555 |
227 |
64 |
21316 |
2013.7 |
-12.4 |
0.239 |
23 |
5 |
0 |
0.469 |
| Average: |
2229.8 |
-15.0 |
0.212 |
27 |
10 |
0 |
0.469 |
| 3 |
7 |
|
V |
249 |
73 |
21703 |
◊ |
S |
x,y,z |
1_555 |
241 |
62 |
21019 |
2259.1 |
-12.0 |
0.192 |
25 |
9 |
0 |
0.428 |
8 |
|
X |
251 |
73 |
21485 |
◊ |
U |
x,y,z |
1_555 |
239 |
65 |
21346 |
2254.4 |
-10.8 |
0.261 |
25 |
9 |
0 |
0.428 |
9 |
|
D |
243 |
74 |
21699 |
◊ |
A |
x,y,z |
1_555 |
246 |
64 |
21044 |
2250.5 |
-12.8 |
0.178 |
20 |
8 |
0 |
0.428 |
10 |
|
F |
241 |
75 |
21470 |
◊ |
C |
x,y,z |
1_555 |
233 |
67 |
21316 |
2203.7 |
-10.6 |
0.231 |
22 |
9 |
0 |
0.428 |
11 |
|
O |
237 |
68 |
21472 |
◊ |
L |
x,y,z |
1_555 |
234 |
63 |
21505 |
2158.5 |
-10.3 |
0.255 |
25 |
10 |
0 |
0.428 |
12 |
|
M |
228 |
69 |
21665 |
◊ |
J |
x,y,z |
1_555 |
237 |
63 |
21038 |
2140.2 |
-10.9 |
0.184 |
29 |
10 |
0 |
0.428 |
| Average: |
2211.1 |
-11.2 |
0.217 |
24 |
9 |
0 |
0.428 |
| 4 |
13 |
|
N |
217 |
60 |
21556 |
◊ |
J |
x,y,z |
1_555 |
227 |
66 |
21038 |
2092.5 |
-15.3 |
0.161 |
23 |
8 |
0 |
0.583 |
14 |
|
E |
198 |
57 |
21355 |
◊ |
A |
x,y,z |
1_555 |
209 |
60 |
21044 |
1891.4 |
-12.8 |
0.230 |
24 |
8 |
0 |
0.583 |
15 |
|
W |
194 |
55 |
21332 |
◊ |
S |
x,y,z |
1_555 |
209 |
59 |
21019 |
1863.9 |
-14.0 |
0.198 |
21 |
8 |
0 |
0.583 |
| Average: |
1949.3 |
-14.1 |
0.196 |
23 |
8 |
0 |
0.583 |
| 5 |
16 |
|
W |
198 |
60 |
21332 |
◊ |
T |
x,y,z |
1_555 |
193 |
54 |
21668 |
1840.7 |
-12.0 |
0.184 |
21 |
5 |
0 |
0.575 |
17 |
|
E |
193 |
59 |
21355 |
◊ |
B |
x,y,z |
1_555 |
191 |
54 |
21721 |
1836.3 |
-12.0 |
0.208 |
23 |
5 |
0 |
0.575 |
18 |
|
N |
189 |
58 |
21556 |
◊ |
K |
x,y,z |
1_555 |
191 |
52 |
21685 |
1782.1 |
-12.3 |
0.172 |
22 |
5 |
0 |
0.575 |
| Average: |
1819.7 |
-12.1 |
0.188 |
22 |
5 |
0 |
0.575 |
| 6 |
19 |
|
I |
122 |
26 |
4468 |
◊ |
G |
x,y,z |
1_555 |
123 |
34 |
14762 |
1140.8 |
-10.2 |
0.730 |
14 |
2 |
0 |
1.000 |
| 7 |
20 |
|
H |
92 |
28 |
7277 |
◊ |
G |
x,y,z |
1_555 |
103 |
28 |
14762 |
925.4 |
-15.8 |
0.256 |
8 |
0 |
0 |
1.000 |
| 8 |
21 |
|
Q |
64 |
25 |
6040 |
◊ |
P |
x,y,z |
1_555 |
72 |
20 |
14521 |
665.0 |
-11.7 |
0.325 |
4 |
0 |
0 |
1.000 |
| 9 |
22 |
|
L |
85 |
24 |
21505 |
◊ |
A |
-x,y-1/2,-z+1 |
2_546 |
84 |
24 |
21044 |
634.9 |
-0.2 |
0.607 |
9 |
2 |
0 |
0.000 |
| 10 |
23 |
|
1 |
55 |
19 |
2540 |
◊ |
Y |
x,y,z |
1_555 |
66 |
20 |
12963 |
591.0 |
-4.5 |
0.887 |
4 |
3 |
0 |
0.000 |
| 11 |
24 |
|
P |
59 |
22 |
14521 |
◊ |
M |
x,y,z |
1_555 |
61 |
19 |
21665 |
582.3 |
-5.3 |
0.327 |
3 |
2 |
0 |
0.042 |
25 |
|
G |
46 |
16 |
14762 |
◊ |
D |
x,y,z |
1_555 |
47 |
13 |
21699 |
503.9 |
-6.5 |
0.195 |
3 |
3 |
0 |
0.042 |
| Average: |
543.1 |
-5.9 |
0.261 |
3 |
3 |
0 |
0.042 |
| 12 |
26 |
|
I |
49 |
17 |
4468 |
◊ |
H |
x,y,z |
1_555 |
67 |
24 |
7277 |
566.6 |
-9.8 |
0.580 |
3 |
3 |
0 |
1.000 |
| 13 |
27 |
|
R |
52 |
19 |
3001 |
◊ |
P |
x,y,z |
1_555 |
63 |
21 |
14521 |
547.0 |
-6.9 |
0.755 |
4 |
1 |
0 |
0.099 |
| 14 |
28 |
|
G |
65 |
26 |
14762 |
◊ |
F |
x,y,z |
1_555 |
50 |
17 |
21470 |
533.0 |
-6.3 |
0.291 |
5 |
4 |
0 |
0.044 |
29 |
|
P |
51 |
23 |
14521 |
◊ |
O |
x,y,z |
1_555 |
44 |
15 |
21472 |
457.3 |
-6.0 |
0.243 |
1 |
3 |
0 |
0.044 |
| Average: |
495.2 |
-6.2 |
0.267 |
3 |
4 |
0 |
0.044 |
| 15 |
30 |
|
P |
47 |
15 |
14521 |
◊ |
N |
x,y,z |
1_555 |
53 |
18 |
21556 |
531.1 |
-7.4 |
0.119 |
7 |
4 |
0 |
0.153 |
| 16 |
31 |
|
G |
51 |
17 |
14762 |
◊ |
A |
x,y,z |
1_555 |
66 |
19 |
21044 |
524.4 |
-9.3 |
0.083 |
0 |
0 |
0 |
0.158 |
32 |
|
P |
47 |
20 |
14521 |
◊ |
J |
x,y,z |
1_555 |
55 |
18 |
21038 |
483.4 |
-6.0 |
0.203 |
0 |
5 |
0 |
0.158 |
| Average: |
503.9 |
-7.6 |
0.143 |
0 |
3 |
0 |
0.158 |
| 17 |
33 |
|
Y |
42 |
16 |
12963 |
◊ |
V |
x,y,z |
1_555 |
58 |
18 |
21703 |
484.5 |
-6.7 |
0.193 |
1 |
1 |
0 |
0.050 |
| 18 |
34 |
|
Y |
57 |
21 |
12963 |
◊ |
X |
x,y,z |
1_555 |
41 |
13 |
21485 |
476.5 |
-5.8 |
0.302 |
2 |
5 |
0 |
0.048 |
| 19 |
35 |
|
Y |
59 |
18 |
12963 |
◊ |
S |
x,y,z |
1_555 |
60 |
20 |
21019 |
468.8 |
-6.9 |
0.204 |
1 |
1 |
0 |
0.129 |
| 20 |
36 |
|
Y |
45 |
17 |
12963 |
◊ |
W |
x,y,z |
1_555 |
47 |
16 |
21332 |
442.9 |
-5.5 |
0.190 |
4 |
2 |
0 |
0.131 |
| 21 |
37 |
|
[ANP]V:600 |
31 |
1 |
625 |
f |
V |
x,y,z |
1_555 |
62 |
22 |
21703 |
406.4 |
-1.2 |
0.494 |
9 |
0 |
0 |
0.147 |
38 |
|
[ANP]D:600 |
31 |
1 |
618 |
f |
D |
x,y,z |
1_555 |
61 |
19 |
21699 |
405.0 |
-1.8 |
0.501 |
13 |
0 |
0 |
0.147 |
39 |
|
[ANP]O:600 |
31 |
1 |
621 |
f |
O |
x,y,z |
1_555 |
58 |
20 |
21472 |
390.9 |
-2.8 |
0.439 |
12 |
0 |
0 |
0.147 |
40 |
|
[ANP]F:600 |
30 |
1 |
616 |
f |
F |
x,y,z |
1_555 |
59 |
19 |
21470 |
389.0 |
-2.3 |
0.479 |
11 |
0 |
0 |
0.147 |
41 |
|
[ANP]X:600 |
31 |
1 |
618 |
f |
X |
x,y,z |
1_555 |
61 |
20 |
21485 |
385.5 |
-2.2 |
0.483 |
14 |
0 |
0 |
0.147 |
42 |
|
[ANP]M:600 |
31 |
1 |
618 |
f |
M |
x,y,z |
1_555 |
59 |
22 |
21665 |
374.2 |
-2.1 |
0.469 |
15 |
0 |
0 |
0.147 |
| Average: |
391.8 |
-2.1 |
0.477 |
12 |
0 |
0 |
0.147 |
| 22 |
43 |
|
[ANP]U:600 |
30 |
1 |
620 |
f |
U |
x,y,z |
1_555 |
51 |
19 |
21346 |
380.6 |
-1.1 |
0.575 |
12 |
0 |
0 |
0.186 |
44 |
|
[ANP]L:600 |
30 |
1 |
623 |
f |
L |
x,y,z |
1_555 |
51 |
18 |
21505 |
377.9 |
-1.2 |
0.549 |
13 |
0 |
0 |
0.186 |
45 |
|
[ANP]C:600 |
31 |
1 |
624 |
f |
C |
x,y,z |
1_555 |
49 |
18 |
21316 |
376.2 |
-1.2 |
0.553 |
14 |
0 |
0 |
0.186 |
46 |
|
[ANP]B:600 |
30 |
1 |
622 |
f |
B |
x,y,z |
1_555 |
50 |
16 |
21721 |
366.9 |
-1.1 |
0.593 |
13 |
0 |
0 |
0.186 |
47 |
|
[ANP]J:600 |
31 |
1 |
623 |
f |
J |
x,y,z |
1_555 |
50 |
17 |
21038 |
366.3 |
-1.7 |
0.533 |
13 |
0 |
0 |
0.186 |
48 |
|
[ANP]K:600 |
30 |
1 |
621 |
f |
K |
x,y,z |
1_555 |
48 |
16 |
21685 |
364.1 |
-0.6 |
0.611 |
13 |
0 |
0 |
0.186 |
49 |
|
[ANP]S:600 |
29 |
1 |
618 |
f |
S |
x,y,z |
1_555 |
53 |
19 |
21019 |
354.3 |
-2.7 |
0.416 |
12 |
0 |
0 |
0.186 |
50 |
|
[ANP]A:600 |
28 |
1 |
620 |
f |
A |
x,y,z |
1_555 |
47 |
18 |
21044 |
348.2 |
-2.9 |
0.424 |
10 |
0 |
0 |
0.186 |
| Average: |
366.8 |
-1.6 |
0.532 |
13 |
0 |
0 |
0.186 |
| 23 |
51 |
|
G |
38 |
11 |
14762 |
◊ |
E |
x,y,z |
1_555 |
43 |
14 |
21355 |
369.9 |
-4.5 |
0.276 |
5 |
2 |
0 |
0.120 |
| 24 |
52 |
|
[ANP]T:600 |
31 |
1 |
612 |
f |
T |
x,y,z |
1_555 |
51 |
17 |
21668 |
358.7 |
0.1 |
0.634 |
12 |
0 |
0 |
0.135 |
| 25 |
53 |
|
G |
31 |
10 |
14762 |
◊ |
C |
x,y,z |
1_555 |
44 |
18 |
21316 |
321.7 |
-2.0 |
0.447 |
3 |
1 |
0 |
0.013 |
| 26 |
54 |
|
P |
29 |
13 |
14521 |
◊ |
K |
x,y,z |
1_555 |
39 |
16 |
21685 |
310.1 |
-1.0 |
0.576 |
3 |
2 |
0 |
0.030 |
| 27 |
55 |
|
X |
34 |
14 |
21485 |
◊ |
K |
x,y,z |
1_555 |
25 |
10 |
21685 |
293.3 |
-1.1 |
0.517 |
2 |
1 |
0 |
0.000 |
| 28 |
56 |
|
Y |
28 |
14 |
12963 |
◊ |
T |
x,y,z |
1_555 |
38 |
13 |
21668 |
292.0 |
-0.6 |
0.600 |
1 |
2 |
0 |
0.009 |
| 29 |
57 |
|
P |
28 |
10 |
14521 |
◊ |
L |
x,y,z |
1_555 |
37 |
13 |
21505 |
268.4 |
-1.7 |
0.474 |
1 |
0 |
0 |
0.007 |
| 30 |
58 |
|
M |
32 |
11 |
21665 |
◊ |
S |
-x+1,y-1/2,-z+1 |
2_646 |
28 |
9 |
21019 |
265.6 |
3.8 |
0.801 |
4 |
3 |
0 |
0.000 |
| 31 |
59 |
|
U |
24 |
7 |
21346 |
◊ |
D |
-x+1,y-1/2,-z+1 |
2_646 |
32 |
10 |
21699 |
265.5 |
2.3 |
0.832 |
5 |
1 |
0 |
0.000 |
| 32 |
60 |
|
U |
36 |
13 |
21346 |
◊ |
C |
-x+1,y-1/2,-z+1 |
2_646 |
30 |
10 |
21316 |
258.9 |
4.8 |
0.901 |
4 |
3 |
0 |
0.000 |
| 33 |
61 |
|
G |
28 |
10 |
14762 |
◊ |
B |
x,y,z |
1_555 |
31 |
11 |
21721 |
238.1 |
-1.0 |
0.560 |
1 |
2 |
0 |
0.012 |
| 34 |
62 |
|
A |
27 |
12 |
21044 |
◊ |
C |
x-1,y,z |
1_455 |
20 |
6 |
21316 |
224.5 |
-0.6 |
0.517 |
0 |
1 |
0 |
0.000 |
| 35 |
63 |
|
M |
22 |
8 |
21665 |
◊ |
W |
-x+1,y-1/2,-z+1 |
2_646 |
29 |
8 |
21332 |
222.4 |
0.7 |
0.675 |
0 |
3 |
0 |
0.000 |
| 36 |
64 |
|
B |
21 |
6 |
21721 |
◊ |
V |
x-1,y,z-1 |
1_454 |
22 |
8 |
21703 |
201.5 |
-2.4 |
0.286 |
0 |
0 |
0 |
0.000 |
| 37 |
65 |
|
H |
26 |
7 |
7277 |
◊ |
W |
x-1,y,z-1 |
1_454 |
20 |
5 |
21332 |
198.5 |
-3.6 |
0.299 |
0 |
0 |
0 |
0.000 |
| 38 |
66 |
|
Y |
28 |
11 |
12963 |
◊ |
U |
x,y,z |
1_555 |
28 |
11 |
21346 |
195.1 |
-0.3 |
0.592 |
1 |
0 |
0 |
0.003 |
| 39 |
67 |
|
R |
24 |
10 |
3001 |
◊ |
Q |
x,y,z |
1_555 |
19 |
12 |
6040 |
190.6 |
-4.4 |
0.663 |
0 |
0 |
0 |
0.049 |
| 40 |
68 |
|
H |
21 |
6 |
7277 |
◊ |
F |
x-1,y,z |
1_455 |
24 |
8 |
21470 |
172.2 |
0.9 |
0.888 |
1 |
0 |
0 |
0.000 |
| 41 |
69 |
|
[ANP]M:600 |
14 |
1 |
618 |
◊ |
L |
x,y,z |
1_555 |
21 |
6 |
21505 |
147.1 |
0.2 |
0.628 |
2 |
0 |
0 |
0.010 |
| 42 |
70 |
|
[ANP]X:600 |
13 |
1 |
618 |
◊ |
T |
x,y,z |
1_555 |
16 |
4 |
21668 |
125.8 |
-0.4 |
0.546 |
3 |
0 |
0 |
0.029 |
71 |
|
[ANP]O:600 |
10 |
1 |
621 |
◊ |
K |
x,y,z |
1_555 |
16 |
4 |
21685 |
125.8 |
-0.5 |
0.525 |
3 |
0 |
0 |
0.029 |
72 |
|
[ANP]F:600 |
11 |
1 |
616 |
◊ |
B |
x,y,z |
1_555 |
16 |
4 |
21721 |
122.8 |
-0.6 |
0.533 |
3 |
0 |
0 |
0.029 |
73 |
|
[ANP]V:600 |
10 |
1 |
625 |
◊ |
U |
x,y,z |
1_555 |
17 |
4 |
21346 |
104.2 |
1.0 |
0.659 |
2 |
0 |
0 |
0.029 |
74 |
|
[ANP]D:600 |
10 |
1 |
618 |
◊ |
C |
x,y,z |
1_555 |
17 |
5 |
21316 |
103.7 |
0.4 |
0.639 |
3 |
0 |
0 |
0.029 |
| Average: |
116.5 |
-0.0 |
0.580 |
3 |
0 |
0 |
0.029 |
| 43 |
75 |
|
M |
9 |
4 |
21665 |
◊ |
D |
-x+1,y-1/2,-z+1 |
2_646 |
17 |
5 |
21699 |
111.8 |
0.9 |
0.741 |
2 |
0 |
0 |
0.000 |
| 44 |
76 |
|
N |
22 |
12 |
21556 |
◊ |
E |
x,y,z |
1_555 |
10 |
5 |
21355 |
111.4 |
3.0 |
0.901 |
1 |
2 |
0 |
0.000 |
| 45 |
77 |
|
[PO4]N:800 |
5 |
1 |
189 |
f |
N |
x,y,z |
1_555 |
15 |
10 |
21556 |
109.6 |
-5.5 |
0.818 |
6 |
0 |
0 |
0.168 |
| 46 |
78 |
|
P |
13 |
5 |
14521 |
◊ |
J |
x-1,y,z |
1_455 |
11 |
4 |
21038 |
103.4 |
1.7 |
0.843 |
3 |
0 |
0 |
0.000 |
| 47 |
79 |
|
G |
11 |
3 |
14762 |
◊ |
W |
x-1,y,z-1 |
1_454 |
14 |
5 |
21332 |
92.1 |
1.3 |
0.804 |
1 |
0 |
0 |
0.000 |
| 48 |
80 |
|
N |
11 |
4 |
21556 |
◊ |
B |
x,y,z |
1_555 |
11 |
5 |
21721 |
91.2 |
0.7 |
0.693 |
1 |
0 |
0 |
0.000 |
| 49 |
81 |
|
X |
17 |
7 |
21485 |
◊ |
O |
x,y,z |
1_555 |
12 |
5 |
21472 |
86.6 |
1.1 |
0.676 |
0 |
0 |
0 |
0.000 |
| 50 |
82 |
|
O |
9 |
3 |
21472 |
◊ |
M |
x,y,z |
1_555 |
7 |
3 |
21665 |
85.7 |
-2.1 |
0.136 |
0 |
0 |
0 |
0.010 |
83 |
|
F |
2 |
1 |
21470 |
◊ |
D |
x,y,z |
1_555 |
2 |
1 |
21699 |
7.4 |
-0.2 |
0.382 |
0 |
0 |
0 |
0.010 |
84 |
|
X |
1 |
1 |
21485 |
◊ |
V |
x,y,z |
1_555 |
2 |
1 |
21703 |
1.8 |
-0.1 |
0.496 |
0 |
0 |
0 |
0.010 |
| Average: |
31.6 |
-0.8 |
0.338 |
0 |
0 |
0 |
0.010 |
| 51 |
85 |
|
E |
13 |
3 |
21355 |
◊ |
T |
x,y,z |
1_555 |
9 |
4 |
21668 |
80.7 |
-1.4 |
0.283 |
0 |
0 |
0 |
0.000 |
| 52 |
86 |
|
1 |
9 |
4 |
2540 |
◊ |
Z |
x,y,z |
1_555 |
12 |
5 |
1445 |
80.1 |
-2.3 |
0.688 |
0 |
0 |
0 |
0.000 |
| 53 |
87 |
|
G |
10 |
5 |
14762 |
◊ |
S |
x-1,y,z-1 |
1_454 |
8 |
3 |
21019 |
76.5 |
0.5 |
0.721 |
1 |
0 |
0 |
0.000 |
| 54 |
88 |
|
[ANP]U:600 |
9 |
1 |
620 |
◊ |
X |
x,y,z |
1_555 |
12 |
7 |
21485 |
75.7 |
0.1 |
0.611 |
0 |
0 |
0 |
0.000 |
89 |
|
[ANP]J:600 |
8 |
1 |
623 |
◊ |
M |
x,y,z |
1_555 |
12 |
6 |
21665 |
65.7 |
0.5 |
0.618 |
0 |
0 |
0 |
0.000 |
90 |
|
[ANP]S:600 |
8 |
1 |
618 |
◊ |
V |
x,y,z |
1_555 |
12 |
6 |
21703 |
63.6 |
0.4 |
0.579 |
0 |
0 |
0 |
0.000 |
91 |
|
[ANP]A:600 |
7 |
1 |
620 |
◊ |
D |
x,y,z |
1_555 |
10 |
6 |
21699 |
63.3 |
0.6 |
0.614 |
0 |
0 |
0 |
0.000 |
92 |
|
[ANP]L:600 |
10 |
1 |
623 |
◊ |
O |
x,y,z |
1_555 |
11 |
6 |
21472 |
62.6 |
0.6 |
0.647 |
0 |
0 |
0 |
0.000 |
93 |
|
[ANP]C:600 |
9 |
1 |
624 |
◊ |
F |
x,y,z |
1_555 |
11 |
6 |
21470 |
61.2 |
0.6 |
0.659 |
0 |
0 |
0 |
0.000 |
| Average: |
65.3 |
0.5 |
0.621 |
0 |
0 |
0 |
0.000 |
| 55 |
94 |
|
B |
6 |
4 |
21721 |
◊ |
S |
x-1,y,z-1 |
1_454 |
12 |
5 |
21019 |
67.6 |
0.2 |
0.651 |
0 |
0 |
0 |
0.000 |
| 56 |
95 |
|
E |
6 |
3 |
21355 |
◊ |
K |
x,y,z |
1_555 |
10 |
5 |
21685 |
61.7 |
-0.9 |
0.354 |
0 |
0 |
0 |
0.000 |
| 57 |
96 |
|
A |
4 |
1 |
21044 |
◊ |
F |
x-1,y,z |
1_455 |
7 |
3 |
21470 |
45.4 |
0.7 |
0.773 |
1 |
1 |
0 |
0.000 |
| 58 |
97 |
|
[MG]L:700 |
1 |
1 |
98 |
f |
L |
x,y,z |
1_555 |
12 |
6 |
21505 |
45.1 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.115 |
98 |
|
[MG]J:700 |
1 |
1 |
98 |
f |
J |
x,y,z |
1_555 |
12 |
5 |
21038 |
43.1 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.115 |
99 |
|
[MG]C:700 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
10 |
5 |
21316 |
42.2 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.115 |
100 |
|
[MG]S:700 |
1 |
1 |
98 |
f |
S |
x,y,z |
1_555 |
12 |
5 |
21019 |
40.2 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.115 |
101 |
|
[MG]B:700 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
12 |
4 |
21721 |
39.7 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.115 |
102 |
|
[MG]U:700 |
1 |
1 |
98 |
f |
U |
x,y,z |
1_555 |
11 |
5 |
21346 |
39.3 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.115 |
103 |
|
[MG]T:700 |
1 |
1 |
98 |
f |
T |
x,y,z |
1_555 |
11 |
4 |
21668 |
37.8 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.115 |
104 |
|
[MG]K:700 |
1 |
1 |
98 |
f |
K |
x,y,z |
1_555 |
11 |
5 |
21685 |
36.8 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.115 |
105 |
|
[MG]A:700 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
21044 |
33.3 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.115 |
| Average: |
39.7 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.115 |
| 59 |
106 |
|
[ANP]A:600 |
7 |
1 |
620 |
f |
[MG]A:700 |
x,y,z |
1_555 |
1 |
1 |
98 |
42.5 |
-6.4 |
0.000 |
0 |
0 |
0 |
0.185 |
107 |
|
[ANP]K:600 |
4 |
1 |
621 |
f |
[MG]K:700 |
x,y,z |
1_555 |
1 |
1 |
98 |
40.0 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.185 |
108 |
|
[ANP]S:600 |
5 |
1 |
618 |
f |
[MG]S:700 |
x,y,z |
1_555 |
1 |
1 |
98 |
39.9 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.185 |
109 |
|
[ANP]T:600 |
4 |
1 |
612 |
f |
[MG]T:700 |
x,y,z |
1_555 |
1 |
1 |
98 |
39.8 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.185 |
110 |
|
[ANP]U:600 |
5 |
1 |
620 |
f |
[MG]U:700 |
x,y,z |
1_555 |
1 |
1 |
98 |
39.8 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.185 |
111 |
|
[ANP]B:600 |
4 |
1 |
622 |
f |
[MG]B:700 |
x,y,z |
1_555 |
1 |
1 |
98 |
39.2 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.185 |
112 |
|
[ANP]C:600 |
3 |
1 |
624 |
f |
[MG]C:700 |
x,y,z |
1_555 |
1 |
1 |
98 |
38.8 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.185 |
113 |
|
[ANP]J:600 |
3 |
1 |
623 |
f |
[MG]J:700 |
x,y,z |
1_555 |
1 |
1 |
98 |
37.7 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.185 |
114 |
|
[ANP]L:600 |
3 |
1 |
623 |
f |
[MG]L:700 |
x,y,z |
1_555 |
1 |
1 |
98 |
37.2 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.185 |
115 |
|
[ANP]D:600 |
4 |
1 |
618 |
f |
[MG]D:700 |
x,y,z |
1_555 |
1 |
1 |
98 |
31.9 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.185 |
116 |
|
[ANP]V:600 |
5 |
1 |
625 |
f |
[MG]V:700 |
x,y,z |
1_555 |
1 |
1 |
98 |
31.3 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.185 |
117 |
|
[ANP]O:600 |
6 |
1 |
621 |
f |
[MG]O:700 |
x,y,z |
1_555 |
1 |
1 |
98 |
30.9 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.185 |
118 |
|
[ANP]F:600 |
4 |
1 |
616 |
f |
[MG]F:700 |
x,y,z |
1_555 |
1 |
1 |
98 |
30.6 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.185 |
119 |
|
[ANP]M:600 |
5 |
1 |
618 |
f |
[MG]M:700 |
x,y,z |
1_555 |
1 |
1 |
98 |
28.8 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.185 |
120 |
|
[ANP]X:600 |
3 |
1 |
618 |
f |
[MG]X:700 |
x,y,z |
1_555 |
1 |
1 |
98 |
28.2 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.185 |
| Average: |
35.8 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.185 |
| 60 |
121 |
|
[MG]F:700 |
1 |
1 |
98 |
f |
F |
x,y,z |
1_555 |
12 |
7 |
21470 |
40.7 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.100 |
122 |
|
[MG]V:700 |
1 |
1 |
98 |
f |
V |
x,y,z |
1_555 |
12 |
6 |
21703 |
40.2 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.100 |
123 |
|
[MG]M:700 |
1 |
1 |
98 |
f |
M |
x,y,z |
1_555 |
8 |
5 |
21665 |
39.9 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.100 |
124 |
|
[MG]O:700 |
1 |
1 |
98 |
f |
O |
x,y,z |
1_555 |
11 |
5 |
21472 |
39.8 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.100 |
125 |
|
[MG]D:700 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
11 |
6 |
21699 |
39.3 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.100 |
126 |
|
[MG]X:700 |
1 |
1 |
98 |
f |
X |
x,y,z |
1_555 |
8 |
6 |
21485 |
37.7 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.100 |
| Average: |
39.6 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.100 |
| 61 |
127 |
|
[PO4]N:800 |
4 |
1 |
189 |
◊ |
J |
x,y,z |
1_555 |
3 |
1 |
21038 |
40.3 |
-0.9 |
0.960 |
2 |
0 |
0 |
0.033 |
| 62 |
128 |
|
[ANP]K:600 |
5 |
1 |
621 |
◊ |
N |
x,y,z |
1_555 |
8 |
2 |
21556 |
40.1 |
-1.0 |
0.462 |
0 |
0 |
0 |
0.020 |
129 |
|
[ANP]B:600 |
6 |
1 |
622 |
◊ |
E |
x,y,z |
1_555 |
9 |
2 |
21355 |
39.7 |
-0.8 |
0.487 |
0 |
0 |
0 |
0.020 |
130 |
|
[ANP]T:600 |
5 |
1 |
612 |
◊ |
W |
x,y,z |
1_555 |
7 |
2 |
21332 |
28.8 |
-0.8 |
0.479 |
0 |
0 |
0 |
0.020 |
| Average: |
36.2 |
-0.8 |
0.476 |
0 |
0 |
0 |
0.020 |
| 63 |
131 |
|
P |
4 |
2 |
14521 |
◊ |
G |
-x-1,y-1/2,-z |
2_445 |
5 |
3 |
14762 |
38.3 |
-0.7 |
0.421 |
0 |
0 |
0 |
0.000 |
| 64 |
132 |
|
K |
5 |
1 |
21685 |
◊ |
Y |
x-1,y,z |
1_455 |
3 |
1 |
12963 |
32.2 |
-0.2 |
0.434 |
0 |
0 |
0 |
0.000 |
| 65 |
133 |
|
F |
4 |
2 |
21470 |
◊ |
W |
x,y,z-1 |
1_554 |
2 |
1 |
21332 |
28.8 |
0.1 |
0.665 |
0 |
0 |
0 |
0.000 |
| 66 |
134 |
|
J |
3 |
1 |
21038 |
◊ |
I |
-x,y-1/2,-z |
2_545 |
4 |
2 |
4468 |
20.9 |
0.1 |
0.659 |
0 |
0 |
0 |
0.000 |
| 67 |
135 |
|
H |
2 |
2 |
7277 |
◊ |
C |
x-1,y,z |
1_455 |
5 |
1 |
21316 |
19.9 |
-0.2 |
0.458 |
0 |
0 |
0 |
0.000 |
| 68 |
136 |
|
L |
1 |
1 |
21505 |
◊ |
W |
-x,y-1/2,-z+1 |
2_546 |
2 |
1 |
21332 |
16.3 |
0.2 |
0.323 |
0 |
0 |
0 |
0.000 |
| 69 |
137 |
|
T |
2 |
1 |
21668 |
◊ |
K |
x,y,z |
1_555 |
2 |
2 |
21685 |
15.4 |
0.7 |
0.858 |
0 |
0 |
0 |
0.000 |
| 70 |
138 |
|
[MG]X:700 |
1 |
1 |
98 |
◊ |
T |
x,y,z |
1_555 |
1 |
1 |
21668 |
10.0 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.008 |
139 |
|
[MG]D:700 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
21316 |
8.3 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.008 |
140 |
|
[MG]F:700 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
21721 |
6.5 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.008 |
141 |
|
[MG]V:700 |
1 |
1 |
98 |
◊ |
U |
x,y,z |
1_555 |
1 |
1 |
21346 |
6.4 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.008 |
142 |
|
[MG]O:700 |
1 |
1 |
98 |
◊ |
K |
x,y,z |
1_555 |
1 |
1 |
21685 |
6.0 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.008 |
143 |
|
[MG]M:700 |
1 |
1 |
98 |
◊ |
L |
x,y,z |
1_555 |
1 |
1 |
21505 |
5.0 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.008 |
| Average: |
7.1 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.008 |
| 71 |
144 |
|
I |
2 |
1 |
4468 |
◊ |
C |
x-1,y,z |
1_455 |
2 |
1 |
21316 |
8.7 |
0.2 |
0.733 |
0 |
0 |
0 |
0.000 |
|