Average chemical shift: 2.716
Standard deviation: 0.508
Low-field shifts outside of three standard deviations from the average | Entry ID | Comp. index ID | Atom ID | Chemical Shift Value | Ambiguity code |
---|---|---|---|---|
505 | 81 | HB2 | 37.4 | 2 |
811 | 83 | HB2 | 36.9 | 2 |
812 | 83 | HB2 | 36 | 1 |
813 | 83 | HB2 | 36.3 | 1 |
814 | 83 | HB2 | 36.5 | 1 |
1486 | 83 | HB2 | 36.9 | 2 |
1487 | 83 | HB2 | 37.2 | 1 |
1655 | 18 | HB2 | 6.6 | 2 |
4744 | 16 | HB2 | 5.068 | |
4744 | 2 | HB2 | 4.537 | |
4782 | 2 | HB2 | 4.47 | 2 |
4837 | 98 | HB2 | 5.56 | 1 |
4890 | 2 | HB2 | 4.58 | 1 |
5239 | 59 | HB2 | 5.35 | 2 |
5279 | 16 | HB2 | 5.179 | |
5279 | 2 | HB2 | 4.601 | |
5625 | 42 | HB2 | 4.34 | 2 |
6604 | 65 | HB2 | 4.335 | 2 |
6634 | 42 | HB2 | 4.33 | 2 |
6686 | 65 | HB2 | 6.77 | |
11495 | 70 | HB2 | 4.3 | 1 |
16822 | 10 | HB2 | 4.278 | 2 |
19497 | 27 | HB2 | 4.600 | 2 |
34460 | 79 | HB2 | 4.664 |
High-field shifts outside of three standard deviations from the average | Entry ID | Comp. index ID | Atom ID | Chemical Shift Value | Ambiguity code |
---|---|---|---|---|
4224 | 65 | HB2 | 1.07 | 1 |
4291 | 71 | HB2 | 0.745 | 1 |
4565 | 100 | HB2 | 0.59 | 2 |
5156 | 33 | HB2 | 0.85 | 2 |
5224 | 19 | HB2 | 0.65 | 2 |
5602 | 17 | HB2 | 1.045 | 2 |
6008 | 72 | HB2 | -0.39 | 2 |
6120 | 52 | HB2 | 0.88 | 2 |
6199 | 163 | HB2 | 1.10 | 2 |
6344 | 133 | HB2 | 1.03 | 2 |
6391 | 100 | HB2 | 0.81 | 2 |
6686 | 21 | HB2 | -5.2 | |
6686 | 25 | HB2 | 0.34 | |
6686 | 57 | HB2 | -1.17 | |
6686 | 59 | HB2 | 0.48 | |
6869 | 24 | HB2 | 1.12 | 1 |
6895 | 45 | HB2 | 0.923 | 2 |
6901 | 69 | HB2 | 0.578 | 2 |
6990 | 62 | HB2 | 0.032 | 2 |
7298 | 33 | HB2 | 1.075 | 2 |
10028 | 32 | HB2 | -0.023 | 2 |
10035 | 36 | HB2 | 0.811 | 2 |
10068 | 132 | HB2 | 0.521 | 2 |
10120 | 46 | HB2 | 0.629 | 2 |
11348 | 142 | HB2 | 1.062 | 2 |
12021 | 11 | HB2 | 0.332 | |
15100 | 66 | HB2 | 1.09 | 2 |
15295 | 85 | HB2 | 1.137 | 2 |
15338 | 36 | HB2 | 1.15 | 2 |
15350 | 60 | HB2 | 1.180 | 2 |
15407 | 57 | HB2 | 0.848 | 2 |
16365 | 131 | HB2 | 0.73 | 2 |
16572 | 21 | HB2 | 0.366 | 2 |
16923 | 74 | HB2 | -0.048 | 2 |
17755 | 19 | HB2 | 0.9140 | 2 |
18098 | 71 | HB2 | 0.857 | 2 |
18574 | 43 | HB2 | 0.956 | 2 |
18575 | 43 | HB2 | 0.960 | 2 |
19012 | 52 | HB2 | 0.830 | 2 |
19109 | 62 | HB2 | 1.164 | 2 |
25047 | 70 | HB2 | 0.943 | 2 |
25421 | 27 | HB2 | 1.191 | 2 |
25442 | 70 | HB2 | 0.987 | |
25831 | 28 | HB2 | 0.870 | 2 |
25927 | 12 | HB2 | 0.796 | 1 |
25945 | 14 | HB2 | 1.079 | 2 |
30317 | 27 | HB2 | 0.572 | |
30376 | 26 | HB2 | 1.022 | |
30377 | 26 | HB2 | 1.078 | |
30969 | 18 | HB2 | 0.96 | |
34057 | 44 | HB2 | 1.123 | |
34068 | 26 | HB2 | 1.083 | |
34226 | 94 | HB2 | 1.149 | 1 |
34717 | 80 | HB2 | 0.638 | 2 |
50412 | 11 | HB2 | 0.7563 | 2 |
51094 | 60 | HB2 | 1.054 | 2 |
51471 | 87 | HB2 | 1.126 | 2 |
52100 | 70 | HB2 | -0.070 |