## |
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 |
|
N |
894 |
224 |
53313 |
◊ |
M |
x,y,z |
1_555 |
910 |
254 |
71092 |
8801.9 |
-103.8 |
0.059 |
95 |
23 |
0 |
0.692 |
2 |
|
B |
885 |
223 |
53719 |
◊ |
A |
x,y,z |
1_555 |
909 |
252 |
70985 |
8699.2 |
-103.9 |
0.058 |
94 |
20 |
0 |
0.692 |
Average: |
8750.6 |
-103.9 |
0.059 |
95 |
22 |
0 |
0.692 |
2 |
3 |
|
Q |
205 |
48 |
13401 |
◊ |
M |
x,y,z |
1_555 |
221 |
67 |
71092 |
2011.0 |
-20.2 |
0.302 |
19 |
5 |
0 |
0.305 |
4 |
|
E |
204 |
48 |
13424 |
◊ |
A |
x,y,z |
1_555 |
222 |
68 |
70985 |
2009.0 |
-20.2 |
0.311 |
19 |
5 |
0 |
0.305 |
Average: |
2010.0 |
-20.2 |
0.307 |
19 |
5 |
0 |
0.305 |
3 |
5 |
|
S |
202 |
56 |
9764 |
◊ |
P |
x,y,z |
1_555 |
194 |
55 |
11255 |
1893.7 |
-24.4 |
0.785 |
15 |
4 |
0 |
0.844 |
6 |
|
G |
200 |
56 |
9785 |
◊ |
D |
x,y,z |
1_555 |
188 |
55 |
11076 |
1862.9 |
-25.2 |
0.757 |
14 |
4 |
0 |
0.844 |
Average: |
1878.3 |
-24.8 |
0.771 |
15 |
4 |
0 |
0.844 |
4 |
7 |
|
R |
198 |
52 |
5745 |
◊ |
M |
x,y,z |
1_555 |
205 |
53 |
71092 |
1822.0 |
-21.6 |
0.515 |
14 |
4 |
0 |
0.313 |
8 |
|
F |
194 |
51 |
5747 |
◊ |
A |
x,y,z |
1_555 |
203 |
52 |
70985 |
1800.1 |
-20.6 |
0.525 |
15 |
4 |
0 |
0.313 |
Average: |
1811.0 |
-21.1 |
0.520 |
15 |
4 |
0 |
0.313 |
5 |
9 |
|
K |
174 |
44 |
8294 |
◊ |
C |
x,y,z |
1_555 |
169 |
51 |
16201 |
1821.1 |
-36.8 |
0.167 |
9 |
4 |
0 |
1.000 |
10 |
|
W |
171 |
45 |
8296 |
◊ |
O |
x,y,z |
1_555 |
166 |
51 |
16198 |
1818.4 |
-36.9 |
0.148 |
9 |
4 |
0 |
1.000 |
Average: |
1819.8 |
-36.9 |
0.157 |
9 |
4 |
0 |
1.000 |
6 |
11 |
|
O |
183 |
44 |
16198 |
◊ |
N |
x,y,z |
1_555 |
180 |
48 |
53313 |
1584.9 |
-7.7 |
0.907 |
20 |
9 |
0 |
0.309 |
12 |
|
C |
183 |
45 |
16201 |
◊ |
B |
x,y,z |
1_555 |
177 |
48 |
53719 |
1583.4 |
-7.7 |
0.906 |
20 |
8 |
0 |
0.309 |
Average: |
1584.2 |
-7.7 |
0.907 |
20 |
9 |
0 |
0.309 |
7 |
13 |
|
V |
139 |
31 |
4844 |
◊ |
N |
x,y,z |
1_555 |
178 |
55 |
53313 |
1479.2 |
-19.5 |
0.430 |
11 |
3 |
0 |
1.000 |
14 |
|
J |
141 |
31 |
4846 |
◊ |
B |
x,y,z |
1_555 |
177 |
54 |
53719 |
1478.9 |
-19.3 |
0.454 |
11 |
3 |
0 |
1.000 |
Average: |
1479.0 |
-19.4 |
0.442 |
11 |
3 |
0 |
1.000 |
8 |
15 |
|
U |
155 |
38 |
9100 |
◊ |
M |
x,y,z |
1_555 |
157 |
39 |
71092 |
1431.9 |
-14.2 |
0.528 |
15 |
6 |
0 |
0.222 |
16 |
|
I |
153 |
37 |
9187 |
◊ |
A |
x,y,z |
1_555 |
158 |
39 |
70985 |
1429.9 |
-14.3 |
0.511 |
15 |
6 |
0 |
0.222 |
Average: |
1430.9 |
-14.3 |
0.519 |
15 |
6 |
0 |
0.222 |
9 |
17 |
|
I |
150 |
38 |
9187 |
◊ |
B |
x,y,z |
1_555 |
142 |
38 |
53719 |
1329.5 |
-12.2 |
0.594 |
4 |
2 |
0 |
0.132 |
18 |
|
U |
149 |
38 |
9100 |
◊ |
N |
x,y,z |
1_555 |
136 |
37 |
53313 |
1302.4 |
-12.7 |
0.548 |
4 |
2 |
0 |
0.132 |
Average: |
1315.9 |
-12.4 |
0.571 |
4 |
2 |
0 |
0.132 |
10 |
19 |
|
T |
145 |
34 |
8731 |
◊ |
M |
x,y,z |
1_555 |
131 |
40 |
71092 |
1301.4 |
-17.3 |
0.235 |
16 |
4 |
0 |
0.276 |
20 |
|
H |
144 |
33 |
8669 |
◊ |
A |
x,y,z |
1_555 |
127 |
39 |
70985 |
1288.4 |
-17.4 |
0.232 |
16 |
4 |
0 |
0.276 |
Average: |
1294.9 |
-17.3 |
0.233 |
16 |
4 |
0 |
0.276 |
11 |
21 |
|
J |
103 |
26 |
4846 |
◊ |
C |
x,y,z |
1_555 |
111 |
34 |
16201 |
1029.6 |
-10.0 |
0.809 |
11 |
3 |
0 |
0.266 |
22 |
|
V |
99 |
26 |
4844 |
◊ |
O |
x,y,z |
1_555 |
111 |
33 |
16198 |
1026.5 |
-9.8 |
0.807 |
11 |
3 |
0 |
0.266 |
Average: |
1028.1 |
-9.9 |
0.808 |
11 |
3 |
0 |
0.266 |
12 |
23 |
|
L |
96 |
23 |
4330 |
◊ |
B |
x,y,z |
1_555 |
104 |
31 |
53719 |
965.2 |
-0.2 |
0.897 |
13 |
9 |
0 |
0.063 |
24 |
|
X |
96 |
23 |
4328 |
◊ |
N |
x,y,z |
1_555 |
108 |
31 |
53313 |
962.2 |
-0.0 |
0.900 |
13 |
9 |
0 |
0.063 |
Average: |
963.7 |
-0.1 |
0.899 |
13 |
9 |
0 |
0.063 |
13 |
25 |
|
W |
83 |
24 |
8296 |
◊ |
M |
x,y,z |
1_555 |
89 |
29 |
71092 |
778.6 |
-6.5 |
0.684 |
5 |
3 |
0 |
0.027 |
26 |
|
K |
83 |
24 |
8294 |
◊ |
A |
x,y,z |
1_555 |
88 |
29 |
70985 |
776.5 |
-6.5 |
0.679 |
5 |
3 |
0 |
0.027 |
Average: |
777.6 |
-6.5 |
0.682 |
5 |
3 |
0 |
0.027 |
14 |
27 |
|
L |
40 |
9 |
4330 |
◊ |
C |
x,y,z |
1_555 |
69 |
19 |
16201 |
470.8 |
-4.2 |
0.623 |
5 |
2 |
0 |
0.058 |
28 |
|
X |
40 |
9 |
4328 |
◊ |
O |
x,y,z |
1_555 |
68 |
18 |
16198 |
470.0 |
-4.2 |
0.622 |
5 |
2 |
0 |
0.058 |
Average: |
470.4 |
-4.2 |
0.623 |
5 |
2 |
0 |
0.058 |
15 |
29 |
|
G |
52 |
16 |
9785 |
◊ |
A |
x,y,z |
1_555 |
40 |
13 |
70985 |
420.9 |
-6.6 |
0.346 |
4 |
0 |
0 |
0.035 |
30 |
|
S |
49 |
15 |
9764 |
◊ |
M |
x,y,z |
1_555 |
40 |
11 |
71092 |
387.8 |
-6.3 |
0.374 |
2 |
0 |
0 |
0.035 |
Average: |
404.4 |
-6.5 |
0.360 |
3 |
0 |
0 |
0.035 |
16 |
31 |
|
K |
42 |
14 |
8294 |
◊ |
B |
x,y,z |
1_555 |
48 |
15 |
53719 |
414.6 |
-0.9 |
0.872 |
2 |
4 |
0 |
0.024 |
32 |
|
W |
40 |
14 |
8296 |
◊ |
N |
x,y,z |
1_555 |
51 |
15 |
53313 |
411.8 |
-0.8 |
0.872 |
2 |
4 |
0 |
0.024 |
Average: |
413.2 |
-0.9 |
0.872 |
2 |
4 |
0 |
0.024 |
17 |
33 |
|
T |
36 |
12 |
8731 |
◊ |
S |
-x+1,y-1/2,-z |
2_645 |
38 |
13 |
9764 |
369.2 |
-3.2 |
0.501 |
5 |
0 |
0 |
0.000 |
34 |
|
G |
31 |
12 |
9785 |
◊ |
H |
-x+1,y-1/2,-z+1 |
2_646 |
26 |
10 |
8669 |
309.6 |
-3.2 |
0.413 |
2 |
0 |
0 |
0.000 |
Average: |
339.4 |
-3.2 |
0.457 |
4 |
0 |
0 |
0.000 |
18 |
35 |
|
G |
36 |
11 |
9785 |
◊ |
F |
x,y,z |
1_555 |
33 |
14 |
5747 |
356.1 |
-5.2 |
0.442 |
1 |
0 |
0 |
0.024 |
36 |
|
S |
28 |
10 |
9764 |
◊ |
R |
x,y,z |
1_555 |
23 |
11 |
5745 |
262.8 |
-4.1 |
0.449 |
0 |
0 |
0 |
0.024 |
Average: |
309.4 |
-4.6 |
0.445 |
1 |
0 |
0 |
0.024 |
19 |
37 |
|
C |
33 |
8 |
16201 |
◊ |
A |
x,y,z |
1_555 |
37 |
10 |
70985 |
306.6 |
-2.9 |
0.621 |
2 |
0 |
0 |
0.014 |
38 |
|
O |
33 |
8 |
16198 |
◊ |
M |
x,y,z |
1_555 |
36 |
10 |
71092 |
305.8 |
-3.0 |
0.615 |
2 |
0 |
0 |
0.014 |
Average: |
306.2 |
-2.9 |
0.618 |
2 |
0 |
0 |
0.014 |
20 |
39 |
|
D |
21 |
8 |
11076 |
◊ |
B |
x,y,z |
1_555 |
23 |
8 |
53719 |
215.1 |
-4.0 |
0.327 |
4 |
0 |
0 |
0.014 |
40 |
|
P |
15 |
5 |
11255 |
◊ |
N |
x,y,z |
1_555 |
22 |
9 |
53313 |
182.4 |
-3.1 |
0.373 |
2 |
0 |
0 |
0.014 |
Average: |
198.7 |
-3.6 |
0.350 |
3 |
0 |
0 |
0.014 |
21 |
41 |
|
L |
22 |
9 |
4330 |
◊ |
D |
-x+1,y-1/2,-z+1 |
2_646 |
21 |
5 |
11076 |
193.8 |
-2.0 |
0.644 |
2 |
0 |
0 |
0.000 |
22 |
42 |
|
P |
19 |
4 |
11255 |
◊ |
X |
-x+1,y-1/2,-z |
2_645 |
23 |
9 |
4328 |
185.3 |
-2.2 |
0.603 |
1 |
0 |
0 |
0.000 |
23 |
43 |
|
H |
19 |
5 |
8669 |
◊ |
C |
x,y,z |
1_555 |
22 |
6 |
16201 |
182.7 |
-1.1 |
0.692 |
1 |
1 |
0 |
0.005 |
44 |
|
T |
19 |
5 |
8731 |
◊ |
O |
x,y,z |
1_555 |
22 |
6 |
16198 |
182.5 |
-1.1 |
0.688 |
1 |
1 |
0 |
0.005 |
Average: |
182.6 |
-1.1 |
0.690 |
1 |
1 |
0 |
0.005 |
24 |
45 |
|
O |
16 |
7 |
16198 |
◊ |
E |
-x,y-1/2,-z |
2_545 |
16 |
4 |
13424 |
152.5 |
-3.3 |
0.256 |
0 |
0 |
0 |
0.000 |
25 |
46 |
|
K |
18 |
6 |
8294 |
◊ |
H |
x,y,z |
1_555 |
17 |
6 |
8669 |
148.7 |
-1.3 |
0.609 |
0 |
0 |
0 |
0.003 |
47 |
|
W |
18 |
6 |
8296 |
◊ |
T |
x,y,z |
1_555 |
17 |
6 |
8731 |
148.6 |
-1.2 |
0.610 |
0 |
0 |
0 |
0.003 |
Average: |
148.7 |
-1.3 |
0.609 |
0 |
0 |
0 |
0.003 |
26 |
48 |
|
B |
16 |
4 |
53719 |
◊ |
H |
-x,y-1/2,-z+1 |
2_546 |
9 |
5 |
8669 |
140.0 |
-1.2 |
0.317 |
0 |
0 |
0 |
0.000 |
49 |
|
T |
10 |
5 |
8731 |
◊ |
N |
-x,y-1/2,-z |
2_545 |
16 |
5 |
53313 |
134.4 |
-1.0 |
0.416 |
1 |
0 |
0 |
0.000 |
Average: |
137.2 |
-1.1 |
0.366 |
1 |
0 |
0 |
0.000 |
27 |
50 |
|
B |
13 |
5 |
53719 |
◊ |
F |
-x+1,y-1/2,-z+1 |
2_646 |
15 |
4 |
5747 |
126.7 |
0.2 |
0.478 |
0 |
0 |
0 |
0.000 |
51 |
|
R |
14 |
4 |
5745 |
◊ |
N |
-x+1,y-1/2,-z |
2_645 |
8 |
3 |
53313 |
101.9 |
0.3 |
0.446 |
1 |
0 |
0 |
0.000 |
Average: |
114.3 |
0.3 |
0.462 |
1 |
0 |
0 |
0.000 |
28 |
52 |
|
O |
12 |
4 |
16198 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
8 |
2 |
70985 |
103.5 |
-1.9 |
0.365 |
1 |
0 |
0 |
0.000 |
29 |
53 |
|
R |
13 |
4 |
5745 |
◊ |
Q |
x,y,z |
1_555 |
8 |
4 |
13401 |
92.0 |
-1.4 |
0.482 |
0 |
0 |
0 |
0.014 |
54 |
|
F |
13 |
4 |
5747 |
◊ |
E |
x,y,z |
1_555 |
8 |
4 |
13424 |
91.1 |
-1.4 |
0.479 |
0 |
0 |
0 |
0.014 |
Average: |
91.5 |
-1.4 |
0.481 |
0 |
0 |
0 |
0.014 |
30 |
55 |
|
T |
8 |
3 |
8731 |
◊ |
U |
-x,y-1/2,-z |
2_545 |
12 |
5 |
9100 |
84.6 |
-0.7 |
0.621 |
2 |
0 |
0 |
0.000 |
31 |
56 |
|
M |
7 |
2 |
71092 |
◊ |
X |
-x+1,y-1/2,-z |
2_645 |
11 |
4 |
4328 |
76.3 |
-0.9 |
0.463 |
1 |
0 |
0 |
0.000 |
57 |
|
L |
11 |
3 |
4330 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
7 |
3 |
70985 |
69.3 |
-0.9 |
0.458 |
1 |
0 |
0 |
0.000 |
Average: |
72.8 |
-0.9 |
0.461 |
1 |
0 |
0 |
0.000 |
32 |
58 |
|
S |
6 |
3 |
9764 |
◊ |
X |
-x+1,y-1/2,-z |
2_645 |
10 |
4 |
4328 |
75.4 |
-0.0 |
0.704 |
0 |
0 |
0 |
0.000 |
33 |
59 |
|
M |
7 |
4 |
71092 |
◊ |
A |
x,y,z |
1_555 |
7 |
3 |
70985 |
73.7 |
-0.8 |
0.466 |
0 |
0 |
0 |
0.000 |
34 |
60 |
|
B |
10 |
3 |
53719 |
◊ |
D |
-x+1,y-1/2,-z+1 |
2_646 |
7 |
2 |
11076 |
73.5 |
-1.2 |
0.439 |
0 |
0 |
0 |
0.000 |
61 |
|
P |
6 |
2 |
11255 |
◊ |
N |
-x+1,y-1/2,-z |
2_645 |
9 |
3 |
53313 |
49.7 |
-0.9 |
0.481 |
0 |
0 |
0 |
0.000 |
Average: |
61.6 |
-1.1 |
0.460 |
0 |
0 |
0 |
0.000 |
35 |
62 |
|
I |
14 |
4 |
9187 |
◊ |
H |
-x,y-1/2,-z+1 |
2_546 |
9 |
4 |
8669 |
70.7 |
-1.1 |
0.519 |
1 |
0 |
0 |
0.000 |
36 |
63 |
|
L |
10 |
3 |
4330 |
◊ |
G |
-x+1,y-1/2,-z+1 |
2_646 |
5 |
2 |
9785 |
66.1 |
0.1 |
0.713 |
0 |
0 |
0 |
0.000 |
37 |
64 |
|
R |
7 |
3 |
5745 |
◊ |
N |
x,y,z |
1_555 |
7 |
4 |
53313 |
65.0 |
-0.6 |
0.529 |
0 |
0 |
0 |
0.002 |
65 |
|
F |
6 |
3 |
5747 |
◊ |
B |
x,y,z |
1_555 |
7 |
4 |
53719 |
59.7 |
-0.6 |
0.515 |
0 |
0 |
0 |
0.002 |
Average: |
62.4 |
-0.6 |
0.522 |
0 |
0 |
0 |
0.002 |
38 |
66 |
|
L |
8 |
4 |
4330 |
◊ |
J |
x,y,z |
1_555 |
4 |
2 |
4846 |
64.5 |
-0.8 |
0.397 |
0 |
0 |
0 |
0.007 |
67 |
|
X |
8 |
4 |
4328 |
◊ |
V |
x,y,z |
1_555 |
4 |
2 |
4844 |
63.3 |
-0.8 |
0.408 |
0 |
0 |
0 |
0.007 |
Average: |
63.9 |
-0.8 |
0.403 |
0 |
0 |
0 |
0.007 |
39 |
68 |
|
B |
8 |
2 |
53719 |
◊ |
G |
-x+1,y-1/2,-z+1 |
2_646 |
6 |
3 |
9785 |
59.2 |
0.0 |
0.695 |
0 |
0 |
0 |
0.000 |
40 |
69 |
|
D |
5 |
3 |
11076 |
◊ |
A |
x,y,z |
1_555 |
7 |
4 |
70985 |
56.5 |
-1.0 |
0.419 |
0 |
0 |
0 |
0.004 |
70 |
|
P |
4 |
2 |
11255 |
◊ |
M |
x,y,z |
1_555 |
5 |
3 |
71092 |
54.4 |
-1.0 |
0.372 |
0 |
0 |
0 |
0.004 |
Average: |
55.4 |
-1.0 |
0.395 |
0 |
0 |
0 |
0.004 |
41 |
71 |
|
[ZN]M:1802 |
1 |
1 |
98 |
f |
M |
x,y,z |
1_555 |
8 |
5 |
71092 |
51.1 |
-37.2 |
0.000 |
0 |
0 |
0 |
0.419 |
72 |
|
[ZN]A:1802 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
4 |
3 |
70985 |
49.2 |
-38.2 |
0.000 |
0 |
0 |
0 |
0.419 |
Average: |
50.2 |
-37.7 |
0.000 |
0 |
0 |
0 |
0.419 |
42 |
73 |
|
[ZN]U:202 |
1 |
1 |
98 |
f |
U |
x,y,z |
1_555 |
6 |
5 |
9100 |
50.7 |
-38.9 |
0.000 |
0 |
0 |
0 |
0.398 |
74 |
|
[ZN]I:202 |
1 |
1 |
98 |
f |
I |
x,y,z |
1_555 |
6 |
4 |
9187 |
50.6 |
-39.0 |
0.000 |
0 |
0 |
0 |
0.398 |
Average: |
50.6 |
-39.0 |
0.000 |
0 |
0 |
0 |
0.398 |
43 |
75 |
|
W |
7 |
4 |
8296 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
2 |
1 |
70985 |
42.4 |
-1.3 |
0.140 |
0 |
0 |
0 |
0.000 |
44 |
76 |
|
Q |
4 |
4 |
13401 |
◊ |
C |
-x+1,y-1/2,-z+1 |
2_646 |
5 |
3 |
16201 |
38.6 |
-0.9 |
0.392 |
0 |
0 |
0 |
0.000 |
45 |
77 |
|
S |
5 |
3 |
9764 |
◊ |
N |
-x+1,y-1/2,-z |
2_645 |
7 |
1 |
53313 |
35.5 |
0.1 |
0.659 |
0 |
0 |
0 |
0.000 |
46 |
78 |
|
S |
6 |
4 |
9764 |
◊ |
N |
x,y,z |
1_555 |
4 |
2 |
53313 |
29.6 |
-0.4 |
0.611 |
0 |
0 |
0 |
0.000 |
79 |
|
G |
4 |
3 |
9785 |
◊ |
B |
x,y,z |
1_555 |
4 |
2 |
53719 |
25.4 |
-0.4 |
0.539 |
0 |
0 |
0 |
0.000 |
Average: |
27.5 |
-0.4 |
0.575 |
0 |
0 |
0 |
0.001 |
47 |
80 |
|
A |
3 |
2 |
70985 |
◊ |
F |
-x+1,y-1/2,-z+1 |
2_646 |
4 |
1 |
5747 |
29.0 |
-0.3 |
0.445 |
0 |
0 |
0 |
0.000 |
81 |
|
R |
2 |
1 |
5745 |
◊ |
M |
-x+1,y-1/2,-z |
2_645 |
1 |
1 |
71092 |
10.0 |
-0.1 |
0.411 |
0 |
0 |
0 |
0.000 |
Average: |
19.5 |
-0.2 |
0.428 |
0 |
0 |
0 |
0.000 |
48 |
82 |
|
[ZN]B:1301 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
4 |
1 |
11076 |
20.0 |
-9.4 |
0.000 |
0 |
0 |
0 |
0.227 |
83 |
|
[ZN]N:1301 |
1 |
1 |
98 |
f |
P |
x,y,z |
1_555 |
2 |
1 |
11255 |
13.8 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.227 |
Average: |
16.9 |
-7.6 |
0.000 |
0 |
0 |
0 |
0.227 |
49 |
84 |
|
U |
3 |
1 |
9100 |
◊ |
B |
x,y,z |
1_555 |
3 |
2 |
53719 |
13.6 |
-0.0 |
0.634 |
0 |
0 |
0 |
0.000 |
50 |
85 |
|
T |
1 |
1 |
8731 |
◊ |
N |
x,y,z |
1_555 |
2 |
1 |
53313 |
12.7 |
0.2 |
0.502 |
0 |
0 |
0 |
0.000 |
86 |
|
H |
1 |
1 |
8669 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
53719 |
12.5 |
0.2 |
0.511 |
0 |
0 |
0 |
0.000 |
Average: |
12.6 |
0.2 |
0.507 |
0 |
0 |
0 |
0.000 |
51 |
87 |
|
Q |
2 |
1 |
13401 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
70985 |
12.1 |
0.0 |
0.401 |
0 |
0 |
0 |
0.000 |
52 |
88 |
|
N |
1 |
1 |
53313 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
70985 |
12.0 |
0.3 |
0.845 |
0 |
0 |
0 |
0.000 |
53 |
89 |
|
I |
2 |
2 |
9187 |
◊ |
P |
x-1,y,z |
1_455 |
3 |
1 |
11255 |
10.5 |
-0.0 |
0.595 |
0 |
0 |
0 |
0.000 |
54 |
90 |
|
U |
1 |
1 |
9100 |
◊ |
S |
x-1,y,z |
1_455 |
1 |
1 |
9764 |
0.9 |
0.0 |
0.718 |
0 |
0 |
0 |
0.000 |
55 |
91 |
|
[ZN]N:1301 |
1 |
1 |
98 |
◊ |
M |
x,y,z |
1_555 |
1 |
1 |
71092 |
0.9 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.001 |
|