## |
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 |
|
W |
172 |
48 |
9902 |
◊ |
V |
x,y,z |
1_555 |
156 |
42 |
13166 |
1556.5 |
-14.0 |
0.289 |
29 |
17 |
0 |
1.000 |
2 |
|
I |
166 |
49 |
9947 |
◊ |
H |
x,y,z |
1_555 |
159 |
41 |
13063 |
1543.1 |
-13.3 |
0.292 |
27 |
15 |
0 |
1.000 |
Average: |
1549.8 |
-13.6 |
0.291 |
28 |
16 |
0 |
1.000 |
2 |
3 |
|
G |
158 |
40 |
12751 |
◊ |
A |
x,y,z |
1_555 |
144 |
38 |
13525 |
1435.5 |
-16.5 |
0.126 |
13 |
1 |
0 |
1.000 |
4 |
|
U |
154 |
39 |
12800 |
◊ |
O |
x,y,z |
1_555 |
142 |
37 |
13423 |
1400.5 |
-15.7 |
0.149 |
13 |
4 |
0 |
1.000 |
Average: |
1418.0 |
-16.1 |
0.138 |
13 |
3 |
0 |
1.000 |
3 |
5 |
|
C |
141 |
34 |
13222 |
◊ |
B |
x,y,z |
1_555 |
163 |
39 |
12134 |
1414.9 |
-11.4 |
0.221 |
15 |
2 |
0 |
1.000 |
6 |
|
Q |
143 |
32 |
13248 |
◊ |
P |
x,y,z |
1_555 |
160 |
39 |
12223 |
1407.8 |
-12.0 |
0.197 |
17 |
2 |
0 |
1.000 |
Average: |
1411.4 |
-11.7 |
0.209 |
16 |
2 |
0 |
1.000 |
4 |
7 |
|
L |
154 |
37 |
11789 |
◊ |
V |
x,y,z |
1_555 |
132 |
35 |
13166 |
1386.4 |
-5.7 |
0.518 |
20 |
5 |
0 |
0.588 |
8 |
|
Z |
153 |
38 |
11802 |
◊ |
H |
x,y,z |
1_555 |
131 |
34 |
13063 |
1376.3 |
-5.8 |
0.494 |
16 |
7 |
0 |
0.588 |
Average: |
1381.4 |
-5.8 |
0.506 |
18 |
6 |
0 |
0.588 |
5 |
9 |
|
U |
141 |
32 |
12800 |
◊ |
T |
x,y,z |
1_555 |
152 |
35 |
12050 |
1348.4 |
-13.3 |
0.187 |
16 |
2 |
0 |
1.000 |
10 |
|
G |
139 |
32 |
12751 |
◊ |
F |
x,y,z |
1_555 |
146 |
34 |
12137 |
1307.1 |
-12.4 |
0.198 |
17 |
3 |
0 |
1.000 |
Average: |
1327.8 |
-12.9 |
0.192 |
17 |
3 |
0 |
1.000 |
6 |
11 |
|
2 |
141 |
40 |
9716 |
◊ |
M |
x,y,z |
1_555 |
137 |
28 |
12568 |
1320.2 |
-6.7 |
0.447 |
26 |
8 |
0 |
1.000 |
12 |
|
N |
138 |
41 |
9648 |
◊ |
1 |
x,y,z |
1_555 |
131 |
28 |
12526 |
1317.7 |
-7.7 |
0.404 |
25 |
7 |
0 |
1.000 |
Average: |
1318.9 |
-7.2 |
0.426 |
26 |
8 |
0 |
1.000 |
7 |
13 |
|
R |
129 |
33 |
13025 |
◊ |
Q |
x,y,z |
1_555 |
139 |
38 |
13248 |
1283.7 |
-11.5 |
0.151 |
16 |
2 |
0 |
1.000 |
14 |
|
D |
126 |
33 |
13098 |
◊ |
C |
x,y,z |
1_555 |
138 |
37 |
13222 |
1240.7 |
-12.7 |
0.101 |
13 |
2 |
0 |
1.000 |
Average: |
1262.2 |
-12.1 |
0.126 |
15 |
2 |
0 |
1.000 |
8 |
15 |
|
F |
136 |
32 |
12137 |
◊ |
E |
x,y,z |
1_555 |
141 |
38 |
11970 |
1270.7 |
-11.5 |
0.199 |
11 |
3 |
0 |
1.000 |
16 |
|
T |
133 |
32 |
12050 |
◊ |
S |
x,y,z |
1_555 |
144 |
38 |
12039 |
1263.2 |
-11.5 |
0.202 |
14 |
3 |
0 |
1.000 |
Average: |
1267.0 |
-11.5 |
0.200 |
13 |
3 |
0 |
1.000 |
9 |
17 |
|
E |
134 |
37 |
11970 |
◊ |
D |
x,y,z |
1_555 |
125 |
36 |
13098 |
1257.9 |
-9.1 |
0.233 |
15 |
5 |
0 |
0.474 |
18 |
|
S |
128 |
36 |
12039 |
◊ |
R |
x,y,z |
1_555 |
129 |
38 |
13025 |
1189.1 |
-11.3 |
0.146 |
10 |
4 |
0 |
0.474 |
Average: |
1223.5 |
-10.2 |
0.190 |
13 |
5 |
0 |
0.474 |
10 |
19 |
|
P |
119 |
32 |
12223 |
◊ |
O |
x,y,z |
1_555 |
141 |
39 |
13423 |
1221.4 |
-13.1 |
0.178 |
13 |
1 |
0 |
1.000 |
20 |
|
B |
126 |
30 |
12134 |
◊ |
A |
x,y,z |
1_555 |
137 |
39 |
13525 |
1189.9 |
-13.0 |
0.229 |
13 |
1 |
0 |
1.000 |
Average: |
1205.7 |
-13.1 |
0.203 |
13 |
1 |
0 |
1.000 |
11 |
21 |
|
Y |
110 |
29 |
10264 |
◊ |
I |
x,y,z |
1_555 |
110 |
26 |
9947 |
1003.2 |
-4.5 |
0.492 |
19 |
5 |
0 |
0.259 |
22 |
|
K |
110 |
29 |
10286 |
◊ |
W |
x,y,z |
1_555 |
105 |
25 |
9902 |
994.9 |
-2.6 |
0.642 |
19 |
7 |
0 |
0.259 |
Average: |
999.1 |
-3.5 |
0.567 |
19 |
6 |
0 |
0.259 |
12 |
23 |
|
M |
99 |
29 |
12568 |
◊ |
L |
x,y,z |
1_555 |
97 |
30 |
11789 |
949.7 |
0.7 |
0.733 |
12 |
11 |
0 |
0.056 |
24 |
|
1 |
95 |
28 |
12526 |
◊ |
Z |
x,y,z |
1_555 |
101 |
30 |
11802 |
943.7 |
-1.2 |
0.628 |
15 |
9 |
0 |
0.056 |
Average: |
946.7 |
-0.2 |
0.681 |
14 |
10 |
0 |
0.056 |
13 |
25 |
|
M |
91 |
24 |
12568 |
◊ |
V |
x,y,z |
1_555 |
103 |
28 |
13166 |
919.2 |
-9.5 |
0.264 |
4 |
2 |
0 |
0.115 |
26 |
|
1 |
92 |
25 |
12526 |
◊ |
H |
x,y,z |
1_555 |
104 |
28 |
13063 |
907.4 |
-10.6 |
0.224 |
4 |
2 |
0 |
0.115 |
Average: |
913.3 |
-10.1 |
0.244 |
4 |
2 |
0 |
0.115 |
14 |
27 |
|
K |
94 |
23 |
10286 |
◊ |
X |
x,y,z |
1_555 |
83 |
19 |
10506 |
787.2 |
-2.2 |
0.545 |
11 |
10 |
0 |
0.184 |
28 |
|
Y |
89 |
23 |
10264 |
◊ |
J |
x,y,z |
1_555 |
85 |
19 |
10363 |
760.5 |
-2.0 |
0.573 |
14 |
11 |
0 |
0.184 |
Average: |
773.9 |
-2.1 |
0.559 |
13 |
11 |
0 |
0.184 |
15 |
29 |
|
L |
80 |
20 |
11789 |
◊ |
W |
x,y,z |
1_555 |
86 |
20 |
9902 |
704.7 |
-3.7 |
0.426 |
8 |
7 |
0 |
0.120 |
30 |
|
Z |
80 |
20 |
11802 |
◊ |
I |
x,y,z |
1_555 |
87 |
20 |
9947 |
704.5 |
-3.3 |
0.432 |
7 |
6 |
0 |
0.120 |
Average: |
704.6 |
-3.5 |
0.429 |
8 |
7 |
0 |
0.120 |
16 |
31 |
|
X |
76 |
20 |
10506 |
◊ |
J |
x,y,z |
1_555 |
77 |
19 |
10363 |
685.7 |
-2.5 |
0.474 |
14 |
1 |
0 |
0.074 |
17 |
32 |
|
Z |
73 |
22 |
11802 |
◊ |
Y |
x,y,z |
1_555 |
74 |
21 |
10264 |
675.7 |
-2.4 |
0.372 |
13 |
6 |
0 |
0.107 |
33 |
|
L |
76 |
22 |
11789 |
◊ |
K |
x,y,z |
1_555 |
69 |
21 |
10286 |
660.6 |
-2.4 |
0.400 |
13 |
6 |
0 |
0.107 |
Average: |
668.2 |
-2.4 |
0.386 |
13 |
6 |
0 |
0.107 |
18 |
34 |
|
Y |
77 |
26 |
10264 |
◊ |
X |
x,y,z |
1_555 |
61 |
18 |
10506 |
673.3 |
-1.5 |
0.551 |
8 |
6 |
0 |
0.097 |
35 |
|
K |
74 |
23 |
10286 |
◊ |
J |
x,y,z |
1_555 |
61 |
18 |
10363 |
645.6 |
-0.7 |
0.647 |
10 |
4 |
0 |
0.097 |
Average: |
659.4 |
-1.1 |
0.599 |
9 |
5 |
0 |
0.097 |
19 |
36 |
|
H |
66 |
18 |
13063 |
◊ |
A |
x,y,z |
1_555 |
77 |
21 |
13525 |
659.4 |
-5.1 |
0.475 |
10 |
3 |
0 |
0.088 |
37 |
|
V |
61 |
17 |
13166 |
◊ |
O |
x,y,z |
1_555 |
73 |
19 |
13423 |
651.9 |
-4.0 |
0.491 |
10 |
1 |
0 |
0.088 |
Average: |
655.6 |
-4.6 |
0.483 |
10 |
2 |
0 |
0.088 |
20 |
38 |
|
H |
63 |
15 |
13063 |
◊ |
G |
x,y,z |
1_555 |
70 |
17 |
12751 |
651.7 |
-0.4 |
0.648 |
10 |
12 |
0 |
0.065 |
39 |
|
V |
66 |
15 |
13166 |
◊ |
U |
x,y,z |
1_555 |
70 |
17 |
12800 |
649.2 |
-0.8 |
0.609 |
10 |
13 |
0 |
0.065 |
Average: |
650.4 |
-0.6 |
0.628 |
10 |
13 |
0 |
0.065 |
21 |
40 |
|
N |
70 |
16 |
9648 |
◊ |
2 |
x,y,z |
1_555 |
72 |
16 |
9716 |
641.6 |
-4.3 |
0.378 |
9 |
6 |
0 |
0.044 |
22 |
41 |
|
M |
71 |
19 |
12568 |
◊ |
E |
x,y,z |
1_555 |
59 |
14 |
11970 |
610.9 |
-2.4 |
0.508 |
7 |
3 |
0 |
0.020 |
42 |
|
1 |
63 |
19 |
12526 |
◊ |
S |
x,y,z |
1_555 |
58 |
14 |
12039 |
582.5 |
-2.8 |
0.475 |
5 |
1 |
0 |
0.020 |
Average: |
596.7 |
-2.6 |
0.491 |
6 |
2 |
0 |
0.020 |
23 |
43 |
|
N |
66 |
19 |
9648 |
◊ |
M |
x,y,z |
1_555 |
70 |
21 |
12568 |
609.4 |
-1.7 |
0.586 |
7 |
2 |
0 |
0.048 |
44 |
|
2 |
65 |
19 |
9716 |
◊ |
1 |
x,y,z |
1_555 |
66 |
21 |
12526 |
606.1 |
-1.7 |
0.570 |
7 |
2 |
0 |
0.048 |
Average: |
607.8 |
-1.7 |
0.578 |
7 |
2 |
0 |
0.048 |
24 |
45 |
|
J |
61 |
22 |
10363 |
◊ |
I |
x,y,z |
1_555 |
65 |
25 |
9947 |
597.3 |
-4.6 |
0.291 |
7 |
3 |
0 |
0.181 |
46 |
|
X |
58 |
21 |
10506 |
◊ |
W |
x,y,z |
1_555 |
67 |
25 |
9902 |
587.7 |
-4.9 |
0.288 |
7 |
3 |
0 |
0.181 |
Average: |
592.5 |
-4.8 |
0.289 |
7 |
3 |
0 |
0.181 |
25 |
47 |
|
X |
56 |
15 |
10506 |
◊ |
P |
x,y,z |
1_555 |
50 |
11 |
12223 |
537.3 |
0.4 |
0.583 |
13 |
2 |
0 |
0.046 |
48 |
|
J |
56 |
15 |
10363 |
◊ |
B |
x,y,z |
1_555 |
52 |
12 |
12134 |
533.8 |
1.0 |
0.702 |
14 |
3 |
0 |
0.046 |
Average: |
535.5 |
0.7 |
0.643 |
14 |
3 |
0 |
0.046 |
26 |
49 |
|
Z |
57 |
15 |
11802 |
◊ |
R |
x,y,z |
1_555 |
59 |
15 |
13025 |
535.7 |
2.0 |
0.764 |
10 |
3 |
0 |
0.019 |
50 |
|
L |
58 |
14 |
11789 |
◊ |
D |
x,y,z |
1_555 |
57 |
15 |
13098 |
515.5 |
1.7 |
0.748 |
10 |
3 |
0 |
0.019 |
Average: |
525.6 |
1.9 |
0.756 |
10 |
3 |
0 |
0.019 |
27 |
51 |
|
I |
57 |
16 |
9947 |
◊ |
A |
x,y,z |
1_555 |
47 |
13 |
13525 |
521.1 |
-2.4 |
0.520 |
5 |
1 |
0 |
0.018 |
52 |
|
W |
56 |
16 |
9902 |
◊ |
O |
x,y,z |
1_555 |
48 |
12 |
13423 |
520.0 |
-2.0 |
0.555 |
6 |
1 |
0 |
0.018 |
Average: |
520.6 |
-2.2 |
0.537 |
6 |
1 |
0 |
0.018 |
28 |
53 |
|
N |
50 |
18 |
9648 |
◊ |
H |
x,y,z |
1_555 |
54 |
20 |
13063 |
495.6 |
-2.3 |
0.572 |
7 |
5 |
0 |
0.060 |
54 |
|
2 |
54 |
18 |
9716 |
◊ |
V |
x,y,z |
1_555 |
54 |
20 |
13166 |
493.9 |
-1.8 |
0.613 |
9 |
5 |
0 |
0.060 |
Average: |
494.8 |
-2.1 |
0.593 |
8 |
5 |
0 |
0.060 |
29 |
55 |
|
W |
48 |
11 |
9902 |
◊ |
P |
x,y,z |
1_555 |
54 |
13 |
12223 |
488.3 |
-3.2 |
0.415 |
8 |
0 |
0 |
0.049 |
56 |
|
I |
45 |
11 |
9947 |
◊ |
B |
x,y,z |
1_555 |
53 |
13 |
12134 |
477.1 |
-3.3 |
0.408 |
5 |
0 |
0 |
0.049 |
Average: |
482.7 |
-3.2 |
0.411 |
7 |
0 |
0 |
0.049 |
30 |
57 |
|
N |
60 |
17 |
9648 |
◊ |
F |
x,y,z |
1_555 |
47 |
11 |
12137 |
454.1 |
-2.6 |
0.492 |
7 |
2 |
0 |
0.020 |
58 |
|
2 |
54 |
17 |
9716 |
◊ |
T |
x,y,z |
1_555 |
43 |
11 |
12050 |
439.4 |
-3.0 |
0.432 |
5 |
1 |
0 |
0.020 |
Average: |
446.7 |
-2.8 |
0.462 |
6 |
2 |
0 |
0.020 |
31 |
59 |
|
P |
47 |
16 |
12223 |
◊ |
D |
-x,y-1/2,-z |
2_545 |
55 |
14 |
13098 |
440.4 |
-0.3 |
0.615 |
6 |
2 |
0 |
0.000 |
32 |
60 |
|
N |
48 |
13 |
9648 |
◊ |
G |
x,y,z |
1_555 |
48 |
13 |
12751 |
424.0 |
-2.3 |
0.453 |
3 |
2 |
0 |
0.041 |
61 |
|
2 |
50 |
13 |
9716 |
◊ |
U |
x,y,z |
1_555 |
47 |
13 |
12800 |
420.9 |
-2.7 |
0.421 |
4 |
2 |
0 |
0.041 |
Average: |
422.4 |
-2.5 |
0.437 |
4 |
2 |
0 |
0.041 |
33 |
62 |
|
K |
34 |
10 |
10286 |
◊ |
D |
x,y,z |
1_555 |
44 |
12 |
13098 |
422.2 |
-2.5 |
0.423 |
5 |
7 |
0 |
0.020 |
63 |
|
Y |
36 |
10 |
10264 |
◊ |
R |
x,y,z |
1_555 |
45 |
12 |
13025 |
414.0 |
-2.9 |
0.396 |
4 |
8 |
0 |
0.020 |
Average: |
418.1 |
-2.7 |
0.410 |
5 |
8 |
0 |
0.020 |
34 |
64 |
|
1 |
50 |
12 |
12526 |
◊ |
T |
x,y,z |
1_555 |
52 |
17 |
12050 |
411.7 |
-1.0 |
0.631 |
7 |
6 |
0 |
0.017 |
65 |
|
M |
46 |
12 |
12568 |
◊ |
F |
x,y,z |
1_555 |
52 |
17 |
12137 |
410.0 |
-0.3 |
0.650 |
7 |
7 |
0 |
0.017 |
Average: |
410.8 |
-0.6 |
0.641 |
7 |
7 |
0 |
0.017 |
35 |
66 |
|
X |
41 |
8 |
10506 |
◊ |
Q |
x,y,z |
1_555 |
47 |
11 |
13248 |
402.9 |
-3.3 |
0.247 |
6 |
3 |
0 |
0.045 |
67 |
|
J |
39 |
8 |
10363 |
◊ |
C |
x,y,z |
1_555 |
49 |
11 |
13222 |
400.6 |
-2.8 |
0.295 |
3 |
3 |
0 |
0.045 |
Average: |
401.7 |
-3.1 |
0.271 |
5 |
3 |
0 |
0.045 |
36 |
68 |
|
[L3T]K:213 |
34 |
1 |
948 |
f |
K |
x,y,z |
1_555 |
45 |
20 |
10286 |
401.3 |
-10.2 |
0.224 |
4 |
0 |
0 |
0.258 |
69 |
|
[L3T]Y:212 |
34 |
1 |
946 |
f |
Y |
x,y,z |
1_555 |
45 |
20 |
10264 |
394.9 |
-10.2 |
0.231 |
4 |
0 |
0 |
0.258 |
Average: |
398.1 |
-10.2 |
0.227 |
4 |
0 |
0 |
0.258 |
37 |
70 |
|
Z |
36 |
9 |
11802 |
◊ |
S |
x,y,z |
1_555 |
49 |
13 |
12039 |
360.2 |
1.4 |
0.671 |
4 |
2 |
0 |
0.004 |
71 |
|
L |
31 |
8 |
11789 |
◊ |
E |
x,y,z |
1_555 |
49 |
12 |
11970 |
353.1 |
0.4 |
0.600 |
4 |
2 |
0 |
0.004 |
Average: |
356.6 |
0.9 |
0.636 |
4 |
2 |
0 |
0.004 |
38 |
72 |
|
U |
42 |
15 |
12800 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
38 |
11 |
13525 |
350.0 |
4.0 |
0.908 |
5 |
2 |
0 |
0.000 |
39 |
73 |
|
T |
32 |
11 |
12050 |
◊ |
F |
-x+1,y-1/2,-z+1 |
2_646 |
32 |
10 |
12137 |
311.8 |
2.3 |
0.848 |
3 |
6 |
0 |
0.000 |
40 |
74 |
|
Y |
34 |
13 |
10264 |
◊ |
Q |
x,y,z |
1_555 |
33 |
10 |
13248 |
306.3 |
1.5 |
0.772 |
5 |
8 |
0 |
0.016 |
75 |
|
K |
31 |
13 |
10286 |
◊ |
C |
x,y,z |
1_555 |
29 |
10 |
13222 |
302.2 |
1.8 |
0.790 |
6 |
8 |
0 |
0.016 |
Average: |
304.3 |
1.7 |
0.781 |
6 |
8 |
0 |
0.016 |
41 |
76 |
|
U |
37 |
12 |
12800 |
◊ |
G |
-x+1,y-1/2,-z+1 |
2_646 |
31 |
14 |
12751 |
271.2 |
0.7 |
0.650 |
1 |
0 |
0 |
0.000 |
42 |
77 |
|
R |
41 |
13 |
13025 |
◊ |
B |
-x+1,y-1/2,-z |
2_645 |
21 |
9 |
12134 |
266.0 |
-0.6 |
0.476 |
4 |
2 |
0 |
0.000 |
43 |
78 |
|
[L3T]K:213 |
24 |
1 |
948 |
◊ |
L |
x,y,z |
1_555 |
42 |
12 |
11789 |
259.3 |
0.9 |
0.596 |
2 |
0 |
0 |
0.004 |
79 |
|
[L3T]Y:212 |
24 |
1 |
946 |
◊ |
Z |
x,y,z |
1_555 |
40 |
13 |
11802 |
257.9 |
0.5 |
0.533 |
2 |
0 |
0 |
0.004 |
Average: |
258.6 |
0.7 |
0.564 |
2 |
0 |
0 |
0.004 |
44 |
80 |
|
F |
26 |
7 |
12137 |
◊ |
A |
x,y,z |
1_555 |
22 |
5 |
13525 |
211.6 |
-2.7 |
0.339 |
2 |
0 |
0 |
0.088 |
81 |
|
T |
27 |
8 |
12050 |
◊ |
O |
x,y,z |
1_555 |
20 |
4 |
13423 |
209.4 |
-3.7 |
0.197 |
1 |
0 |
0 |
0.088 |
Average: |
210.5 |
-3.2 |
0.268 |
2 |
0 |
0 |
0.088 |
45 |
82 |
|
T |
20 |
7 |
12050 |
◊ |
E |
-x+1,y-1/2,-z+1 |
2_646 |
12 |
4 |
11970 |
169.2 |
-0.7 |
0.307 |
0 |
0 |
0 |
0.000 |
46 |
83 |
|
[MES]K:214 |
11 |
1 |
337 |
◊ |
K |
x,y,z |
1_555 |
27 |
8 |
10286 |
153.9 |
3.0 |
0.106 |
0 |
0 |
0 |
0.000 |
47 |
84 |
|
[MES]Y:213 |
10 |
1 |
337 |
◊ |
Y |
x,y,z |
1_555 |
26 |
8 |
10264 |
151.5 |
2.9 |
0.160 |
0 |
0 |
0 |
0.000 |
48 |
85 |
|
K |
13 |
3 |
10286 |
◊ |
V |
x,y,z |
1_555 |
9 |
2 |
13166 |
110.1 |
-1.7 |
0.317 |
0 |
0 |
0 |
0.021 |
86 |
|
Y |
14 |
3 |
10264 |
◊ |
H |
x,y,z |
1_555 |
8 |
2 |
13063 |
101.7 |
-2.2 |
0.200 |
0 |
0 |
0 |
0.021 |
Average: |
105.9 |
-2.0 |
0.259 |
0 |
0 |
0 |
0.021 |
49 |
87 |
|
T |
12 |
3 |
12050 |
◊ |
G |
-x+1,y-1/2,-z+1 |
2_646 |
8 |
4 |
12751 |
92.5 |
0.5 |
0.667 |
1 |
0 |
0 |
0.000 |
50 |
88 |
|
C |
12 |
3 |
13222 |
◊ |
A |
x,y,z |
1_555 |
8 |
2 |
13525 |
85.4 |
-1.5 |
0.308 |
0 |
0 |
0 |
0.038 |
89 |
|
Q |
11 |
2 |
13248 |
◊ |
O |
x,y,z |
1_555 |
8 |
2 |
13423 |
80.1 |
-1.4 |
0.327 |
0 |
0 |
0 |
0.038 |
Average: |
82.8 |
-1.4 |
0.317 |
0 |
0 |
0 |
0.038 |
51 |
90 |
|
[MES]K:214 |
9 |
1 |
337 |
◊ |
[L3T]K:213 |
x,y,z |
1_555 |
11 |
1 |
948 |
74.5 |
1.2 |
0.035 |
0 |
0 |
0 |
0.000 |
52 |
91 |
|
[MES]Y:213 |
8 |
1 |
337 |
◊ |
[L3T]Y:212 |
x,y,z |
1_555 |
11 |
1 |
946 |
70.3 |
1.4 |
0.069 |
0 |
0 |
0 |
0.000 |
53 |
92 |
|
M |
7 |
3 |
12568 |
◊ |
U |
x,y,z |
1_555 |
7 |
3 |
12800 |
69.1 |
0.9 |
0.720 |
1 |
0 |
0 |
0.000 |
93 |
|
1 |
8 |
3 |
12526 |
◊ |
G |
x,y,z |
1_555 |
7 |
3 |
12751 |
69.1 |
0.9 |
0.702 |
0 |
0 |
0 |
0.000 |
Average: |
69.1 |
0.9 |
0.711 |
1 |
0 |
0 |
0.000 |
54 |
94 |
|
U |
7 |
2 |
12800 |
◊ |
F |
-x+1,y-1/2,-z+1 |
2_646 |
9 |
3 |
12137 |
61.6 |
0.1 |
0.646 |
0 |
0 |
0 |
0.000 |
55 |
95 |
|
[MG]I:196 |
1 |
1 |
98 |
f |
I |
x,y,z |
1_555 |
16 |
8 |
9947 |
55.5 |
-8.1 |
0.000 |
0 |
0 |
0 |
0.171 |
56 |
96 |
|
[MG]F:242 |
1 |
1 |
98 |
f |
F |
x,y,z |
1_555 |
11 |
6 |
12137 |
55.3 |
-8.7 |
0.000 |
0 |
0 |
0 |
0.341 |
57 |
97 |
|
E |
8 |
2 |
11970 |
◊ |
A |
x,y,z |
1_555 |
5 |
1 |
13525 |
54.7 |
-0.4 |
0.467 |
0 |
0 |
0 |
0.008 |
98 |
|
S |
5 |
1 |
12039 |
◊ |
O |
x,y,z |
1_555 |
4 |
1 |
13423 |
45.2 |
-0.8 |
0.328 |
0 |
0 |
0 |
0.008 |
Average: |
49.9 |
-0.6 |
0.397 |
0 |
0 |
0 |
0.008 |
58 |
99 |
|
[MG]L:196 |
1 |
1 |
98 |
f |
L |
x,y,z |
1_555 |
10 |
6 |
11789 |
52.1 |
-8.3 |
0.000 |
0 |
0 |
0 |
0.267 |
59 |
100 |
|
[MG]L:195 |
1 |
1 |
98 |
f |
L |
x,y,z |
1_555 |
11 |
7 |
11789 |
51.8 |
-6.6 |
0.000 |
0 |
0 |
0 |
0.210 |
60 |
101 |
|
V |
5 |
1 |
13166 |
◊ |
P |
x,y,z |
1_555 |
9 |
3 |
12223 |
50.5 |
0.1 |
0.571 |
0 |
0 |
0 |
0.000 |
102 |
|
H |
5 |
1 |
13063 |
◊ |
B |
x,y,z |
1_555 |
8 |
4 |
12134 |
37.4 |
0.1 |
0.620 |
0 |
0 |
0 |
0.000 |
Average: |
43.9 |
0.1 |
0.595 |
0 |
0 |
0 |
0.000 |
61 |
103 |
|
[MG]G:241 |
1 |
1 |
98 |
f |
G |
x,y,z |
1_555 |
5 |
3 |
12751 |
49.9 |
-9.7 |
0.000 |
0 |
0 |
0 |
0.255 |
62 |
104 |
|
[MG]N:188 |
1 |
1 |
98 |
f |
N |
x,y,z |
1_555 |
10 |
7 |
9648 |
47.2 |
-7.5 |
0.000 |
0 |
0 |
0 |
0.251 |
63 |
105 |
|
[MG]K:212 |
1 |
1 |
98 |
f |
K |
x,y,z |
1_555 |
8 |
6 |
10286 |
41.1 |
-6.6 |
0.000 |
0 |
0 |
0 |
0.142 |
64 |
106 |
|
[MG]H:224 |
1 |
1 |
98 |
f |
H |
x,y,z |
1_555 |
11 |
7 |
13063 |
40.7 |
-6.6 |
0.000 |
0 |
0 |
0 |
0.279 |
65 |
107 |
|
[MG]I:195 |
1 |
1 |
98 |
f |
I |
x,y,z |
1_555 |
8 |
3 |
9947 |
40.1 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.106 |
66 |
108 |
|
[MG]F:243 |
1 |
1 |
98 |
f |
G |
x,y,z |
1_555 |
9 |
5 |
12751 |
36.0 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.113 |
67 |
109 |
|
[MG]F:243 |
1 |
1 |
98 |
◊ |
F |
x,y,z |
1_555 |
8 |
4 |
12137 |
34.9 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.090 |
68 |
110 |
|
[MG]L:195 |
1 |
1 |
98 |
◊ |
D |
x,y,z |
1_555 |
3 |
2 |
13098 |
28.7 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.008 |
69 |
111 |
|
[MG]K:212 |
1 |
1 |
98 |
◊ |
W |
x,y,z |
1_555 |
4 |
1 |
9902 |
28.2 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.066 |
70 |
112 |
|
[MG]H:224 |
1 |
1 |
98 |
◊ |
Z |
x,y,z |
1_555 |
5 |
2 |
11802 |
27.6 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.133 |
71 |
113 |
|
[MG]N:188 |
1 |
1 |
98 |
◊ |
1 |
x,y,z |
1_555 |
1 |
1 |
12526 |
21.7 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.085 |
72 |
114 |
|
[MG]I:196 |
1 |
1 |
98 |
◊ |
Y |
x,y,z |
1_555 |
3 |
2 |
10264 |
14.9 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.027 |
73 |
115 |
|
[MG]F:243 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
13525 |
14.1 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.039 |
74 |
116 |
|
[MG]L:196 |
1 |
1 |
98 |
◊ |
V |
x,y,z |
1_555 |
4 |
2 |
13166 |
13.3 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.032 |
75 |
117 |
|
P |
1 |
1 |
12223 |
◊ |
C |
-x,y-1/2,-z |
2_545 |
1 |
1 |
13222 |
3.5 |
0.1 |
0.562 |
0 |
0 |
0 |
0.000 |
76 |
118 |
|
S |
1 |
1 |
12039 |
◊ |
C |
-x+1,y-1/2,-z |
2_645 |
1 |
1 |
13222 |
2.3 |
0.1 |
0.730 |
0 |
0 |
0 |
0.000 |
77 |
119 |
|
U |
1 |
1 |
12800 |
◊ |
S |
x,y,z |
1_555 |
1 |
1 |
12039 |
1.0 |
-0.0 |
0.593 |
0 |
0 |
0 |
0.000 |
78 |
120 |
|
[MES]Y:213 |
1 |
1 |
337 |
f |
I |
x,y,z |
1_555 |
1 |
1 |
9947 |
1.0 |
0.0 |
0.298 |
0 |
0 |
0 |
0.000 |
79 |
121 |
|
R |
1 |
1 |
13025 |
◊ |
O |
x,y,z |
1_555 |
1 |
1 |
13423 |
0.5 |
0.0 |
0.701 |
0 |
0 |
0 |
0.000 |
80 |
122 |
|
[MES]K:214 |
1 |
1 |
337 |
f |
W |
x,y,z |
1_555 |
1 |
1 |
9902 |
0.2 |
0.0 |
0.324 |
0 |
0 |
0 |
0.000 |
|