THR HG1 Chemical Shift Outliers
Average chemical shift: 5.07
Standard deviation: 1.318
| Low-field shifts outside of three standard deviations from the average | Entry ID | Comp. index ID | Atom ID | Chemical Shift Value | Ambiguity code |
|---|---|---|---|---|
| 274 | 19 | HG1 | 9.06 | 1 |
| 274 | 78 | HG1 | 9.65 | 1 |
| 1171 | 78 | HG1 | 9.51 | 1 |
| 1719 | 83 | HG1 | 9.23 | 1 |
| 4189 | 47 | HG1 | 9.49 | 1 |
| 4189 | 58 | HG1 | 11.01 | 1 |
| 5026 | 19 | HG1 | 9.07 | |
| 16107 | 40 | HG1 | 10.027 | 1 |
| 25111 | 48 | HG1 | 9.129 | 1 |
| 25908 | 49 | HG1 | 9.569 | |
| 27434 | 209 | HG1 | 9.7 | 1 |
| 34773 | 115 | HG1 | 9.703 | |
| High-field shifts outside of three standard deviations from the average | Entry ID | Comp. index ID | Atom ID | Chemical Shift Value | Ambiguity code |
|---|---|---|---|---|
| 1771 | 51 | HG1 | .32 | 1 |
| 4300 | 1 | HG1 | 0.43 | 9 |
| 4300 | 108 | HG1 | 1.11 | 1 |
| 4300 | 42 | HG1 | 1.03 | 1 |
| 4300 | 62 | HG1 | 0.98 | 1 |
| 4300 | 73 | HG1 | 0.96 | 1 |
| 4300 | 93 | HG1 | 1.05 | 1 |
| 5571 | 18 | HG1 | 0.87 | 2 |
| 5571 | 21 | HG1 | 0.34 | 2 |
| 5970 | 58 | HG1 | 0.699 | 1 |
| 6519 | 31 | HG1 | 0.930 | 1 |
| 15597 | 61 | HG1 | 0.467 | 1 |
| 15598 | 61 | HG1 | 0.467 | 1 |
| 16534 | 45 | HG1 | 0.329 | 1 |
| 17838 | 65 | HG1 | 0.72 | 1 |
| 17935 | 101 | HG1 | 0.989 | |
| 18283 | 13 | HG1 | 0.885 | 1 |
| 18321 | 267 | HG1 | 1.0735 | 1 |
| 18321 | 289 | HG1 | 0.6826 | 1 |
| 18613 | 142 | HG1 | 0.951 | 1 |
| 19458 | 74 | HG1 | 0.2650 | |
| 19458 | 76 | HG1 | 0.7701 | |
| 19955 | 95 | HG1 | 0.933 | 1 |
| 25417 | 67 | HG1 | 0.347 | 1 |
| 26771 | 16 | HG1 | -0.255 | 1 |
| 28117 | 54 | HG1 | 0.869 | 1 |
| 30100 | 29 | HG1 | 0.803 | |
| 30118 | 27 | HG1 | 0.9840 | 1 |
| 30450 | 34 | HG1 | 0.861 | 1 |
| 30821 | 34 | HG1 | 1.107 | 1 |
| 30951 | 39 | HG1 | 1.051 | 1 |
| 34101 | 167 | HG1 | 0.978 | 1 |
| 34101 | 170 | HG1 | 0.736 | 1 |
| 34108 | 10 | HG1 | 1.001 | 1 |
| 34131 | 11 | HG1 | -1.601 | 1 |
| 34131 | 124 | HG1 | -1.712 | 1 |
| 34131 | 16 | HG1 | -1.636 | 1 |
| 34131 | 33 | HG1 | -1.428 | 1 |
| 34131 | 66 | HG1 | -1.783 | 1 |
| 34477 | 14 | HG1 | 1.074 | |
| 34709 | 5 | HG1 | 0.963 | 1 |
| 34773 | 28 | HG1 | 0.795 | |
| 34803 | 73 | HG1 | 0.868 | |
| 50166 | 50 | HG1 | 1.099 | |
| 51128 | 123 | HG1 | 0.931 | 9 |
| 51128 | 56 | HG1 | 1.065 | 1 |
| 51128 | 67 | HG1 | 1.098 | 9 |