MET CG Chemical Shift Outliers
Average chemical shift: 32.067
Standard deviation: 3.096
| Low-field shifts outside of three standard deviations from the average | Entry ID | Comp. index ID | Atom ID | Chemical Shift Value | Ambiguity code |
|---|---|---|---|---|
| 4150 | 1 | CG | 71.448 | |
| 4150 | 86 | CG | 68.897 | |
| 5179 | 16 | CG | 81.180 | |
| 6149 | 17 | CG | 51.7 | 1 |
| 7178 | 57 | CG | 43.2 | 1 |
| 15083 | 52 | CG | 55.272 | 1 |
| 15517 | 86 | CG | 45.500 | 1 |
| 15877 | 1 | CG | 61.859 | 1 |
| 16797 | 19 | CG | 43.060 | 1 |
| 16945 | 105 | CG | 41.840 | 1 |
| 17144 | 79 | CG | 67.1 | 1 |
| 19994 | 8 | CG | 61.491 | |
| 21010 | 19 | CG | 50.955 | 1 |
| 21010 | 2 | CG | 50.955 | 1 |
| 25382 | 21 | CG | 59.446 | |
| 25382 | 60 | CG | 60.279 | |
| 25382 | 66 | CG | 60.534 | |
| 25442 | 13 | CG | 332.686 | |
| 50153 | 5 | CG | 48.728 | 1 |
| 50153 | 9 | CG | 47.838 | 1 |
| High-field shifts outside of three standard deviations from the average | Entry ID | Comp. index ID | Atom ID | Chemical Shift Value | Ambiguity code |
|---|---|---|---|---|
| 4578 | 61 | CG | 22.54 | 1 |
| 4678 | 1 | CG | 20.83 | |
| 4717 | 101 | CG | 2.30 | |
| 4894 | 24 | CG | 16.0 | |
| 7119 | 117 | CG | 20.461 | 1 |
| 11034 | 1 | CG | 15.937 | 1 |
| 17694 | 87 | CG | 20.440 | |
| 18110 | 1 | CG | 22.681 | 1 |
| 18990 | 19 | CG | 19.0560 | 1 |
| 25371 | 100 | CG | 17.860 | |
| 25371 | 40 | CG | 18.115 | |
| 25371 | 92 | CG | 19.314 | |
| 25763 | 5 | CG | 20.5 | 1 |