NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id cing stage position program type
9565 1oa5 cing 1-original 1 unknown chemical shift



! HN protons
3 HN    0.132
4 HN    0.279
5 HN    -0.002
6 HN    0.062
7 HN    0.022
10 HN   0.109
11 HN   0.185
12 HN   0.152
14 HN   0.084
15 HN   0.031
16 HN   0.003
17 HN   0.145
18 HN   0.073
19 HN   0.145
20 HN   0.044
21 HN   0.105
22 HN   -0.013
23 HN   0.098
24 HN   -0.004
25 HN   0.147
26 HN   0.178
27 HN   0.115
28 HN   0.057
29 HN   0.105
30 HN   0.04
31 HN   0.035
32 HN   0.098
33 HN   0.052
34 HN   0.158
35 HN   0.054
36 HN   0.153
38 HN   0
39 HN   -0.019
40 HN   -0.008
41 HN   0.104
42 HN   0.067
43 HN   0.053
44 HN   0.115
45 HN   0.015
46 HN   -0.016
47 HN   0.009
48 HN   0.003
49 HN   0.005
50 HN   0.081
51 HN   0.046
52 HN   0.057
53 HN   -0.022
54 HN   -0.008
55 HN   0.198
56 HN   0.167
57 HN   0.112
58 HN   0.121
! HA protons
2 HA    0.01
3 HA    -0.028
4 HA    -0.008
5 HA    -0.053
6 HA    0.019
7 HA    0.013
8 HA    -0.035
9 HA    -0.083
10 HA   -0.003
11 HA   -0.029
13 HA   -0.002
14 HA   0.034
15 HA   -0.01
16 HA   -0.025
17 HA   -0.042
18 HA   -0.05
19 HA   -0.028
20 HA   0.033
21 HA   -0.043
22 HA   -0.06
23 HA   -0.028
24 HA   -0.015
25 HA   -0.027
26 HA   -0.015
27 HA   -0.041
29 HA   -0.001
30 HA   0.037
31 HA   -0.008
32 HA   -0.054
33 HA   0.013
34 HA   -0.019
35 HA   -0.061
38 HA   -0.024
39 HA   0.051
40 HA   0.039
41 HA   -0.03
42 HA   -0.069
43 HA   0.039
44 HA   0.042
45 HA   -0.006
46 HA   -0.008
47 HA   -0.035
48 HA   -0.025
49 HA   0.025
50 HA   -0.03
51 HA   -0.168
52 HA   0.024
53 HA   -0.001
54 HA   0.039
55 HA   0.016
58 HA   -0.035
! Single Methyls
11 HG2# -0.006
16 HB# -0.014
18 HD1# -0.015
19 HD1# -0.019
25 HB# -0.02
27 HB#  -0.004
32 HG2# -0.021
40 HB#  -0.025
48 HB#  0.004
54 HG2#  0.02
58 HB#  -0.003
! Degenerate Methyl (summed shift)
6 HD## -0.028
! Degenerate Other (summed shift)
1 HB#  -0.033
1 HD#  -0.107
2 HD#  -0.028
3 HB#  -0.030
4 HB#  -0.012
5 HB#  -0.080
8 HB#  -0.039
8 HG#  -0.036
9 HB#  -0.046
9 HG#  -0.048
9 HD#  -0.140
10 HB#  -0.022
12 HA#  -0.031
13 HB#  -0.027
13 HD#  -0.050
14 HB#  -0.060
15 HB#  -0.038
18 HG1#  -0.059
20 HG#  -0.063
20 HD#  -0.059
22 HB#  0.034
23 HB#  0.058
24 HB#  -0.075
28 HA#  0.017
29 HB#  0.100
30 HB#  -0.02
35 HB#  -0.009
36 HA#  -0.034
37 HA#  -0.001
38 HB#  -0.001
42 HB#  -0.381
42 HG#  -0.078
42 HD#  -0.057
44 HB#  -0.008
45 HB#  -0.049
46 HB#  -0.002
47 HB#  -0.031
49 HB#  -0.033
49 HG#  0.225
50 HB#  0.026
51 HB#  -0.175
55 HB#  0.103
56 HA#  -0.046
57 HA#  -0.007


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