| ## |
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 |
|
I |
348 |
98 |
23027 |
◊ |
H |
x,y,z |
1_555 |
392 |
101 |
23057 |
3526.1 |
-33.3 |
0.249 |
63 |
14 |
0 |
0.935 |
2 |
|
E |
349 |
97 |
23659 |
◊ |
B |
x,y,z |
1_555 |
394 |
102 |
23141 |
3525.1 |
-32.2 |
0.277 |
60 |
14 |
0 |
0.935 |
3 |
|
J |
395 |
103 |
23119 |
◊ |
F |
x,y,z |
1_555 |
353 |
98 |
23002 |
3524.5 |
-31.9 |
0.281 |
57 |
15 |
0 |
0.935 |
4 |
|
E |
387 |
101 |
23659 |
◊ |
D |
x,y,z |
1_555 |
345 |
95 |
23214 |
3510.9 |
-32.7 |
0.281 |
62 |
13 |
0 |
0.935 |
5 |
|
G |
347 |
97 |
23092 |
◊ |
F |
x,y,z |
1_555 |
391 |
101 |
23002 |
3503.7 |
-31.8 |
0.293 |
63 |
12 |
0 |
0.935 |
6 |
|
H |
351 |
97 |
23057 |
◊ |
G |
x,y,z |
1_555 |
383 |
100 |
23092 |
3492.8 |
-32.3 |
0.273 |
63 |
15 |
0 |
0.935 |
7 |
|
D |
380 |
97 |
23214 |
◊ |
C |
x,y,z |
1_555 |
351 |
97 |
23170 |
3491.7 |
-32.0 |
0.263 |
61 |
15 |
0 |
0.935 |
8 |
|
B |
352 |
97 |
23141 |
◊ |
A |
x,y,z |
1_555 |
382 |
102 |
22918 |
3489.2 |
-31.6 |
0.250 |
61 |
14 |
0 |
0.935 |
9 |
|
J |
343 |
95 |
23119 |
◊ |
I |
x,y,z |
1_555 |
391 |
102 |
23027 |
3476.4 |
-32.3 |
0.252 |
61 |
15 |
0 |
0.935 |
10 |
|
C |
383 |
99 |
23170 |
◊ |
A |
x,y,z |
1_555 |
345 |
94 |
22918 |
3430.8 |
-32.8 |
0.245 |
58 |
11 |
0 |
0.935 |
| Average: |
3497.1 |
-32.3 |
0.266 |
61 |
14 |
0 |
0.935 |
| 2 |
11 |
|
d |
206 |
54 |
12345 |
◊ |
c |
x,y,z |
1_555 |
223 |
61 |
11864 |
1905.2 |
-29.3 |
0.033 |
13 |
1 |
0 |
1.000 |
12 |
|
L |
205 |
56 |
12352 |
◊ |
K |
x,y,z |
1_555 |
209 |
61 |
11923 |
1879.6 |
-28.8 |
0.039 |
13 |
1 |
0 |
1.000 |
13 |
|
P |
198 |
55 |
12274 |
◊ |
O |
x,y,z |
1_555 |
213 |
63 |
11953 |
1870.1 |
-29.9 |
0.031 |
12 |
1 |
0 |
1.000 |
14 |
|
Z |
199 |
54 |
12292 |
◊ |
Y |
x,y,z |
1_555 |
208 |
61 |
12131 |
1865.2 |
-29.4 |
0.029 |
10 |
1 |
0 |
1.000 |
15 |
|
R |
205 |
54 |
12010 |
◊ |
Q |
x,y,z |
1_555 |
209 |
58 |
11843 |
1860.6 |
-26.5 |
0.052 |
14 |
1 |
0 |
1.000 |
16 |
|
V |
205 |
53 |
12316 |
◊ |
U |
x,y,z |
1_555 |
205 |
57 |
11986 |
1857.5 |
-27.8 |
0.050 |
12 |
1 |
0 |
1.000 |
17 |
|
T |
208 |
56 |
12138 |
◊ |
S |
x,y,z |
1_555 |
209 |
60 |
12150 |
1849.3 |
-29.3 |
0.029 |
11 |
1 |
0 |
1.000 |
18 |
|
X |
207 |
53 |
12257 |
◊ |
W |
x,y,z |
1_555 |
206 |
59 |
12148 |
1844.1 |
-30.6 |
0.027 |
13 |
1 |
1 |
1.000 |
19 |
|
b |
202 |
53 |
12284 |
◊ |
a |
x,y,z |
1_555 |
201 |
57 |
12087 |
1829.4 |
-28.3 |
0.041 |
9 |
1 |
0 |
1.000 |
20 |
|
N |
200 |
51 |
12072 |
◊ |
M |
x,y,z |
1_555 |
198 |
55 |
11920 |
1793.3 |
-27.6 |
0.043 |
12 |
1 |
0 |
1.000 |
| Average: |
1855.4 |
-28.8 |
0.037 |
12 |
1 |
0 |
1.000 |
| 3 |
21 |
|
W |
86 |
29 |
12148 |
◊ |
K |
x-1,y,z |
1_455 |
88 |
30 |
11923 |
758.2 |
-2.4 |
0.546 |
5 |
3 |
0 |
0.000 |
| 4 |
22 |
|
R |
74 |
25 |
12010 |
◊ |
E |
x,y,z-1 |
1_554 |
62 |
17 |
23659 |
672.5 |
-11.5 |
0.089 |
2 |
0 |
0 |
0.027 |
23 |
|
d |
23 |
9 |
12345 |
◊ |
I |
x,y,z-1 |
1_554 |
26 |
8 |
23027 |
187.7 |
-2.5 |
0.320 |
0 |
0 |
0 |
0.027 |
| Average: |
430.1 |
-7.0 |
0.204 |
1 |
0 |
0 |
0.027 |
| 5 |
24 |
|
R |
70 |
16 |
12010 |
◊ |
D |
x,y,z |
1_555 |
70 |
17 |
23214 |
627.0 |
-3.9 |
0.609 |
18 |
0 |
0 |
0.000 |
25 |
|
X |
76 |
18 |
12257 |
◊ |
G |
x,y,z |
1_555 |
67 |
18 |
23092 |
616.6 |
-3.6 |
0.635 |
15 |
0 |
0 |
0.000 |
26 |
|
Z |
75 |
18 |
12292 |
◊ |
H |
x,y,z |
1_555 |
67 |
19 |
23057 |
612.5 |
-2.9 |
0.716 |
13 |
0 |
0 |
0.000 |
| Average: |
618.7 |
-3.5 |
0.653 |
15 |
0 |
0 |
0.000 |
| 6 |
27 |
|
L |
76 |
19 |
12352 |
◊ |
A |
x,y,z |
1_555 |
68 |
19 |
22918 |
620.9 |
-3.2 |
0.669 |
14 |
0 |
0 |
0.000 |
| 7 |
28 |
|
V |
74 |
17 |
12316 |
◊ |
F |
x,y,z |
1_555 |
63 |
16 |
23002 |
618.9 |
-3.1 |
0.677 |
16 |
0 |
0 |
0.000 |
29 |
|
N |
70 |
17 |
12072 |
◊ |
B |
x,y,z |
1_555 |
63 |
16 |
23141 |
617.3 |
-3.0 |
0.647 |
16 |
0 |
0 |
0.000 |
30 |
|
d |
73 |
17 |
12345 |
◊ |
J |
x,y,z |
1_555 |
67 |
17 |
23119 |
616.3 |
-2.7 |
0.686 |
15 |
0 |
0 |
0.000 |
31 |
|
b |
70 |
16 |
12284 |
◊ |
I |
x,y,z |
1_555 |
65 |
17 |
23027 |
612.1 |
-2.9 |
0.680 |
16 |
0 |
0 |
0.000 |
32 |
|
P |
72 |
17 |
12274 |
◊ |
C |
x,y,z |
1_555 |
67 |
17 |
23170 |
611.4 |
-3.2 |
0.684 |
15 |
0 |
0 |
0.000 |
33 |
|
T |
73 |
16 |
12138 |
◊ |
E |
x,y,z |
1_555 |
64 |
17 |
23659 |
610.3 |
-3.2 |
0.675 |
16 |
0 |
0 |
0.000 |
| Average: |
614.4 |
-3.0 |
0.675 |
16 |
0 |
0 |
0.000 |
| 8 |
34 |
|
R |
37 |
13 |
12010 |
◊ |
L |
x-1,y,z-1 |
1_454 |
33 |
11 |
12352 |
355.7 |
-5.5 |
0.256 |
1 |
0 |
0 |
0.000 |
| 9 |
35 |
|
W |
38 |
14 |
12148 |
◊ |
L |
x-1,y,z |
1_455 |
33 |
11 |
12352 |
333.9 |
2.4 |
0.888 |
2 |
0 |
0 |
0.000 |
| 10 |
36 |
|
I |
32 |
11 |
23027 |
◊ |
C |
-x+2,y-1/2,-z+1 |
2_746 |
32 |
11 |
23170 |
309.0 |
-3.4 |
0.374 |
3 |
0 |
0 |
0.000 |
37 |
|
J |
32 |
11 |
23119 |
◊ |
D |
-x+2,y-1/2,-z+1 |
2_746 |
35 |
13 |
23214 |
300.7 |
-3.7 |
0.361 |
3 |
0 |
0 |
0.000 |
38 |
|
H |
26 |
9 |
23057 |
◊ |
A |
-x+2,y-1/2,-z+1 |
2_746 |
32 |
11 |
22918 |
292.7 |
-3.1 |
0.377 |
3 |
0 |
0 |
0.000 |
39 |
|
G |
31 |
11 |
23092 |
◊ |
B |
-x+2,y-1/2,-z+1 |
2_746 |
26 |
8 |
23141 |
288.5 |
-3.4 |
0.343 |
3 |
0 |
0 |
0.000 |
40 |
|
F |
31 |
11 |
23002 |
◊ |
E |
-x+2,y-1/2,-z+1 |
2_746 |
27 |
10 |
23659 |
286.4 |
-3.1 |
0.393 |
5 |
0 |
0 |
0.000 |
| Average: |
295.5 |
-3.3 |
0.370 |
3 |
0 |
0 |
0.000 |
| 11 |
41 |
|
V |
31 |
16 |
12316 |
◊ |
H |
x,y,z-1 |
1_554 |
34 |
17 |
23057 |
270.7 |
1.0 |
0.835 |
3 |
0 |
0 |
0.000 |
| 12 |
42 |
|
N |
32 |
13 |
12072 |
◊ |
L |
x-1,y,z |
1_455 |
29 |
9 |
12352 |
270.2 |
-1.3 |
0.646 |
5 |
0 |
0 |
0.000 |
| 13 |
43 |
|
P |
24 |
9 |
12274 |
◊ |
B |
x,y,z-1 |
1_554 |
16 |
6 |
23141 |
208.8 |
1.0 |
0.838 |
4 |
0 |
0 |
0.000 |
| 14 |
44 |
|
V |
27 |
10 |
12316 |
◊ |
d |
x-1,y,z |
1_455 |
19 |
6 |
12345 |
194.9 |
-1.5 |
0.608 |
1 |
0 |
0 |
0.000 |
| 15 |
45 |
|
N |
17 |
8 |
12072 |
◊ |
c |
x,y,z |
1_555 |
21 |
7 |
11864 |
193.2 |
-2.4 |
0.314 |
3 |
0 |
0 |
0.000 |
| 16 |
46 |
|
D |
25 |
7 |
23214 |
◊ |
B |
x,y,z |
1_555 |
19 |
5 |
23141 |
192.6 |
-4.5 |
0.108 |
0 |
0 |
0 |
0.066 |
47 |
|
C |
18 |
5 |
23170 |
◊ |
B |
x,y,z |
1_555 |
26 |
7 |
23141 |
192.4 |
-4.6 |
0.098 |
0 |
0 |
0 |
0.066 |
48 |
|
J |
20 |
5 |
23119 |
◊ |
G |
x,y,z |
1_555 |
24 |
7 |
23092 |
189.7 |
-4.4 |
0.120 |
0 |
0 |
0 |
0.066 |
49 |
|
J |
25 |
7 |
23119 |
◊ |
H |
x,y,z |
1_555 |
19 |
6 |
23057 |
189.6 |
-4.2 |
0.127 |
0 |
0 |
0 |
0.066 |
50 |
|
E |
19 |
5 |
23659 |
◊ |
C |
x,y,z |
1_555 |
24 |
7 |
23170 |
188.1 |
-4.3 |
0.127 |
0 |
0 |
0 |
0.066 |
51 |
|
H |
23 |
7 |
23057 |
◊ |
F |
x,y,z |
1_555 |
19 |
5 |
23002 |
187.8 |
-4.4 |
0.113 |
0 |
0 |
0 |
0.066 |
52 |
|
I |
22 |
7 |
23027 |
◊ |
G |
x,y,z |
1_555 |
19 |
5 |
23092 |
182.6 |
-4.3 |
0.114 |
0 |
0 |
0 |
0.066 |
53 |
|
I |
18 |
5 |
23027 |
◊ |
F |
x,y,z |
1_555 |
22 |
7 |
23002 |
181.5 |
-4.1 |
0.123 |
0 |
0 |
0 |
0.066 |
54 |
|
E |
23 |
7 |
23659 |
◊ |
A |
x,y,z |
1_555 |
19 |
5 |
22918 |
178.2 |
-4.0 |
0.151 |
0 |
0 |
0 |
0.066 |
55 |
|
D |
18 |
5 |
23214 |
◊ |
A |
x,y,z |
1_555 |
22 |
6 |
22918 |
176.0 |
-4.1 |
0.124 |
0 |
0 |
0 |
0.066 |
| Average: |
185.9 |
-4.3 |
0.121 |
0 |
0 |
0 |
0.066 |
| 17 |
56 |
|
W |
20 |
9 |
12148 |
◊ |
c |
x-1,y,z |
1_455 |
18 |
8 |
11864 |
188.6 |
-1.0 |
0.494 |
0 |
0 |
0 |
0.000 |
| 18 |
57 |
|
U |
24 |
8 |
11986 |
◊ |
M |
x,y,z |
1_555 |
21 |
8 |
11920 |
186.3 |
-1.8 |
0.380 |
0 |
0 |
0 |
0.000 |
| 19 |
58 |
|
T |
14 |
7 |
12138 |
◊ |
K |
x-1,y,z |
1_455 |
19 |
9 |
11923 |
170.9 |
-0.6 |
0.404 |
1 |
0 |
0 |
0.000 |
| 20 |
59 |
|
U |
19 |
7 |
11986 |
◊ |
b |
x-1,y,z-1 |
1_454 |
20 |
10 |
12284 |
151.0 |
1.0 |
0.817 |
2 |
0 |
0 |
0.000 |
| 21 |
60 |
|
Y |
16 |
5 |
12131 |
◊ |
a |
x-1,y,z |
1_455 |
18 |
4 |
12087 |
142.5 |
3.4 |
0.936 |
2 |
3 |
0 |
0.000 |
| 22 |
61 |
|
Q |
13 |
4 |
11843 |
◊ |
Z |
x,y,z-1 |
1_554 |
13 |
4 |
12292 |
141.8 |
0.6 |
0.771 |
2 |
0 |
0 |
0.000 |
| 23 |
62 |
|
O |
19 |
10 |
11953 |
◊ |
Y |
x,y,z-1 |
1_554 |
17 |
6 |
12131 |
138.0 |
1.3 |
0.792 |
0 |
0 |
0 |
0.000 |
| 24 |
63 |
|
X |
12 |
6 |
12257 |
◊ |
c |
x-1,y,z |
1_455 |
14 |
7 |
11864 |
137.4 |
-0.2 |
0.335 |
1 |
0 |
0 |
0.000 |
| 25 |
64 |
|
T |
16 |
6 |
12138 |
◊ |
O |
x-1,y,z |
1_455 |
16 |
5 |
11953 |
136.9 |
1.8 |
0.841 |
2 |
0 |
0 |
0.000 |
65 |
|
X |
9 |
4 |
12257 |
◊ |
a |
x-1,y,z |
1_455 |
7 |
2 |
12087 |
77.8 |
1.3 |
0.840 |
0 |
0 |
0 |
0.000 |
| Average: |
107.3 |
1.5 |
0.840 |
1 |
0 |
0 |
0.000 |
| 26 |
66 |
|
S |
16 |
6 |
12150 |
◊ |
a |
x-1,y,z-1 |
1_454 |
17 |
6 |
12087 |
129.1 |
-0.8 |
0.478 |
0 |
0 |
0 |
0.000 |
| 27 |
67 |
|
S |
13 |
6 |
12150 |
◊ |
K |
x-1,y,z |
1_455 |
17 |
8 |
11923 |
123.3 |
0.5 |
0.637 |
0 |
0 |
0 |
0.000 |
| 28 |
68 |
|
N |
19 |
7 |
12072 |
◊ |
a |
x,y,z |
1_555 |
14 |
6 |
12087 |
119.2 |
-1.4 |
0.382 |
1 |
0 |
0 |
0.000 |
| 29 |
69 |
|
Q |
14 |
7 |
11843 |
◊ |
D |
x,y,z |
1_555 |
12 |
4 |
23214 |
109.6 |
1.4 |
0.722 |
2 |
0 |
0 |
0.000 |
70 |
|
K |
14 |
6 |
11923 |
◊ |
A |
x,y,z |
1_555 |
8 |
2 |
22918 |
103.1 |
1.6 |
0.734 |
2 |
0 |
0 |
0.000 |
71 |
|
Y |
14 |
7 |
12131 |
◊ |
H |
x,y,z |
1_555 |
9 |
3 |
23057 |
101.8 |
1.5 |
0.644 |
1 |
0 |
0 |
0.000 |
72 |
|
W |
13 |
7 |
12148 |
◊ |
G |
x,y,z |
1_555 |
9 |
2 |
23092 |
101.4 |
1.6 |
0.745 |
2 |
0 |
0 |
0.000 |
| Average: |
104.0 |
1.5 |
0.711 |
2 |
0 |
0 |
0.000 |
| 30 |
73 |
|
U |
14 |
7 |
11986 |
◊ |
F |
x,y,z |
1_555 |
11 |
3 |
23002 |
107.9 |
1.7 |
0.780 |
3 |
0 |
0 |
0.000 |
74 |
|
M |
17 |
7 |
11920 |
◊ |
B |
x,y,z |
1_555 |
9 |
3 |
23141 |
107.6 |
2.2 |
0.805 |
3 |
0 |
0 |
0.000 |
75 |
|
O |
15 |
8 |
11953 |
◊ |
C |
x,y,z |
1_555 |
10 |
2 |
23170 |
105.1 |
1.7 |
0.746 |
2 |
0 |
0 |
0.000 |
76 |
|
S |
14 |
7 |
12150 |
◊ |
E |
x,y,z |
1_555 |
10 |
4 |
23659 |
104.9 |
2.0 |
0.778 |
2 |
0 |
0 |
0.000 |
77 |
|
a |
11 |
6 |
12087 |
◊ |
I |
x,y,z |
1_555 |
10 |
3 |
23027 |
101.0 |
1.9 |
0.780 |
2 |
0 |
0 |
0.000 |
78 |
|
c |
14 |
6 |
11864 |
◊ |
J |
x,y,z |
1_555 |
8 |
2 |
23119 |
97.1 |
1.5 |
0.735 |
2 |
0 |
0 |
0.000 |
| Average: |
103.9 |
1.8 |
0.771 |
2 |
0 |
0 |
0.000 |
| 31 |
79 |
|
d |
17 |
8 |
12345 |
◊ |
C |
-x+2,y-1/2,-z |
2_745 |
13 |
5 |
23170 |
105.2 |
0.1 |
0.723 |
0 |
0 |
0 |
0.000 |
| 32 |
80 |
|
W |
13 |
4 |
12148 |
◊ |
d |
x-1,y,z |
1_455 |
15 |
7 |
12345 |
102.5 |
0.7 |
0.768 |
1 |
0 |
0 |
0.000 |
| 33 |
81 |
|
W |
13 |
3 |
12148 |
◊ |
M |
x-1,y,z |
1_455 |
16 |
5 |
11920 |
101.0 |
-0.9 |
0.439 |
0 |
0 |
0 |
0.000 |
| 34 |
82 |
|
Q |
10 |
4 |
11843 |
◊ |
O |
x-1,y,z |
1_455 |
7 |
4 |
11953 |
81.9 |
2.1 |
0.907 |
1 |
2 |
0 |
0.000 |
| 35 |
83 |
|
N |
7 |
3 |
12072 |
◊ |
Y |
x,y,z |
1_555 |
7 |
4 |
12131 |
72.7 |
-0.7 |
0.423 |
2 |
0 |
0 |
0.000 |
| 36 |
84 |
|
X |
8 |
4 |
12257 |
◊ |
M |
x-1,y,z |
1_455 |
8 |
5 |
11920 |
72.5 |
1.5 |
0.880 |
1 |
1 |
0 |
0.000 |
| 37 |
85 |
|
d |
7 |
2 |
12345 |
◊ |
G |
x,y,z |
1_555 |
8 |
2 |
23092 |
69.0 |
-0.5 |
0.498 |
0 |
0 |
0 |
0.000 |
86 |
|
Z |
7 |
2 |
12292 |
◊ |
J |
x,y,z |
1_555 |
7 |
2 |
23119 |
68.0 |
-0.5 |
0.516 |
0 |
0 |
0 |
0.000 |
87 |
|
T |
7 |
2 |
12138 |
◊ |
C |
x,y,z |
1_555 |
7 |
2 |
23170 |
66.2 |
-0.5 |
0.503 |
0 |
0 |
0 |
0.000 |
88 |
|
b |
7 |
2 |
12284 |
◊ |
F |
x,y,z |
1_555 |
7 |
2 |
23002 |
65.8 |
-0.5 |
0.509 |
0 |
0 |
0 |
0.000 |
89 |
|
X |
7 |
2 |
12257 |
◊ |
I |
x,y,z |
1_555 |
8 |
2 |
23027 |
61.6 |
-0.5 |
0.533 |
0 |
0 |
0 |
0.000 |
90 |
|
R |
7 |
2 |
12010 |
◊ |
A |
x,y,z |
1_555 |
7 |
2 |
22918 |
55.3 |
-0.5 |
0.519 |
0 |
0 |
0 |
0.000 |
| Average: |
64.3 |
-0.5 |
0.513 |
0 |
0 |
0 |
0.000 |
| 38 |
91 |
|
P |
7 |
2 |
12274 |
◊ |
B |
x,y,z |
1_555 |
7 |
2 |
23141 |
67.6 |
-0.5 |
0.503 |
0 |
0 |
0 |
0.000 |
92 |
|
V |
7 |
2 |
12316 |
◊ |
H |
x,y,z |
1_555 |
7 |
1 |
23057 |
66.3 |
-0.4 |
0.533 |
0 |
0 |
0 |
0.000 |
93 |
|
N |
5 |
2 |
12072 |
◊ |
D |
x,y,z |
1_555 |
8 |
2 |
23214 |
62.9 |
-0.6 |
0.416 |
0 |
0 |
0 |
0.000 |
| Average: |
65.6 |
-0.5 |
0.484 |
0 |
0 |
0 |
0.000 |
| 39 |
94 |
|
L |
12 |
7 |
12352 |
◊ |
B |
x,y,z |
1_555 |
8 |
5 |
23141 |
67.4 |
1.2 |
0.796 |
1 |
0 |
0 |
0.000 |
| 40 |
95 |
|
L |
7 |
2 |
12352 |
◊ |
E |
x,y,z |
1_555 |
7 |
2 |
23659 |
64.3 |
-0.6 |
0.494 |
0 |
0 |
0 |
0.000 |
| 41 |
96 |
|
R |
9 |
5 |
12010 |
◊ |
B |
x-1,y,z-1 |
1_454 |
8 |
4 |
23141 |
58.6 |
0.5 |
0.722 |
0 |
0 |
0 |
0.000 |
| 42 |
97 |
|
X |
9 |
5 |
12257 |
◊ |
H |
x,y,z |
1_555 |
7 |
4 |
23057 |
52.3 |
0.9 |
0.794 |
1 |
0 |
0 |
0.000 |
98 |
|
T |
9 |
5 |
12138 |
◊ |
D |
x,y,z |
1_555 |
6 |
3 |
23214 |
42.2 |
0.8 |
0.789 |
1 |
0 |
0 |
0.000 |
99 |
|
b |
8 |
4 |
12284 |
◊ |
J |
x,y,z |
1_555 |
5 |
3 |
23119 |
40.0 |
0.7 |
0.780 |
1 |
0 |
0 |
0.000 |
100 |
|
Z |
8 |
4 |
12292 |
◊ |
I |
x,y,z |
1_555 |
5 |
2 |
23027 |
37.9 |
0.2 |
0.740 |
0 |
0 |
0 |
0.000 |
101 |
|
R |
8 |
4 |
12010 |
◊ |
C |
x,y,z |
1_555 |
4 |
2 |
23170 |
35.8 |
0.4 |
0.776 |
0 |
0 |
0 |
0.000 |
| Average: |
41.6 |
0.6 |
0.776 |
1 |
0 |
0 |
0.000 |
| 43 |
102 |
|
N |
10 |
5 |
12072 |
◊ |
E |
x,y,z |
1_555 |
5 |
3 |
23659 |
43.8 |
0.5 |
0.779 |
0 |
0 |
0 |
0.000 |
103 |
|
d |
10 |
5 |
12345 |
◊ |
F |
x,y,z |
1_555 |
5 |
3 |
23002 |
38.9 |
0.4 |
0.771 |
0 |
0 |
0 |
0.000 |
104 |
|
P |
8 |
4 |
12274 |
◊ |
A |
x,y,z |
1_555 |
6 |
3 |
22918 |
38.6 |
0.3 |
0.757 |
0 |
0 |
0 |
0.000 |
105 |
|
V |
8 |
4 |
12316 |
◊ |
G |
x,y,z |
1_555 |
5 |
2 |
23092 |
34.4 |
0.3 |
0.751 |
0 |
0 |
0 |
0.000 |
| Average: |
38.9 |
0.4 |
0.765 |
0 |
0 |
0 |
0.000 |
| 44 |
106 |
|
S |
7 |
3 |
12150 |
◊ |
L |
x-1,y,z |
1_455 |
3 |
2 |
12352 |
30.4 |
-0.3 |
0.485 |
0 |
0 |
0 |
0.000 |
| 45 |
107 |
|
Q |
3 |
1 |
11843 |
◊ |
L |
x-1,y,z-1 |
1_454 |
5 |
2 |
12352 |
29.1 |
0.3 |
0.736 |
0 |
0 |
0 |
0.000 |
| 46 |
108 |
|
W |
3 |
2 |
12148 |
◊ |
S |
x,y,z |
1_555 |
2 |
1 |
12150 |
26.4 |
0.5 |
0.487 |
0 |
0 |
0 |
0.000 |
| 47 |
109 |
|
c |
3 |
1 |
11864 |
◊ |
I |
x,y,z-1 |
1_554 |
2 |
2 |
23027 |
17.5 |
-0.5 |
0.309 |
0 |
0 |
0 |
0.000 |
110 |
|
Q |
1 |
1 |
11843 |
◊ |
E |
x,y,z-1 |
1_554 |
1 |
1 |
23659 |
2.8 |
-0.1 |
0.403 |
0 |
0 |
0 |
0.000 |
| Average: |
10.2 |
-0.3 |
0.356 |
0 |
0 |
0 |
0.000 |
| 48 |
111 |
|
N |
3 |
2 |
12072 |
◊ |
K |
x-1,y,z |
1_455 |
1 |
1 |
11923 |
10.1 |
0.1 |
0.733 |
0 |
0 |
0 |
0.000 |
| 49 |
112 |
|
T |
4 |
2 |
12138 |
◊ |
W |
x,y,z |
1_555 |
3 |
2 |
12148 |
9.1 |
-0.2 |
0.562 |
0 |
0 |
0 |
0.000 |
| 50 |
113 |
|
Y |
2 |
1 |
12131 |
◊ |
K |
x-1,y,z |
1_455 |
1 |
1 |
11923 |
9.1 |
-0.2 |
0.366 |
0 |
0 |
0 |
0.000 |
| 51 |
114 |
|
X |
2 |
1 |
12257 |
◊ |
K |
x-1,y,z |
1_455 |
2 |
2 |
11923 |
7.6 |
0.0 |
0.565 |
0 |
0 |
0 |
0.000 |
| 52 |
115 |
|
F |
4 |
3 |
23002 |
◊ |
R |
-x+2,y-1/2,-z |
2_745 |
4 |
3 |
12010 |
3.6 |
0.0 |
0.666 |
0 |
0 |
0 |
0.000 |
| 53 |
116 |
|
L |
1 |
1 |
12352 |
◊ |
a |
x,y,z |
1_555 |
2 |
1 |
12087 |
3.1 |
-0.1 |
0.506 |
0 |
0 |
0 |
0.000 |
| 54 |
117 |
|
F |
1 |
1 |
23002 |
◊ |
D |
-x+2,y-1/2,-z+1 |
2_746 |
2 |
1 |
23214 |
2.3 |
-0.1 |
0.480 |
0 |
0 |
0 |
0.000 |
| 55 |
118 |
|
U |
1 |
1 |
11986 |
◊ |
I |
x,y,z-1 |
1_554 |
1 |
1 |
23027 |
0.3 |
-0.0 |
0.613 |
0 |
0 |
0 |
0.000 |
|