MET N Chemical Shift Outliers
Average chemical shift: 120.102
Standard deviation: 3.412
| Low-field shifts outside of three standard deviations from the average | Entry ID | Comp. index ID | Atom ID | Chemical Shift Value | Ambiguity code |
|---|---|---|---|---|
| 434 | 44 | N | 131.3 | 1 |
| 435 | 43 | N | 131.3 | 1 |
| 968 | 22 | N | 130.9 | 1 |
| 969 | 22 | N | 130.9 | 1 |
| 970 | 22 | N | 130.6 | 1 |
| 971 | 22 | N | 130.7 | 1 |
| 4086 | 46 | N | 131.0 | 1 |
| 4215 | 26 | N | 131.405 | 1 |
| 4242 | 70 | N | 132.7 | 1 |
| 4300 | 99 | N | 130.62 | 1 |
| 4553 | 79 | N | 131.8 | 1 |
| 4681 | 11 | N | 131.5 | |
| 4681 | 11 | N | 131.6 | |
| 4682 | 11 | N | 131.6 | |
| 4701 | 54 | N | 131.0 | 1 |
| 5182 | 114 | N | 131.02 | 1 |
| 5239 | 11 | N | 133.1 | 1 |
| 5239 | 55 | N | 131.5 | 1 |
| 5261 | 30 | N | 130.473 | 1 |
| 5333 | 11 | N | 131.8 | 1 |
| 5497 | 54 | N | 130.404 | 1 |
| 5578 | 49 | N | 132.4 | |
| 5579 | 49 | N | 132.3 | |
| 5810 | 103 | N | 138.547 | 1 |
| 5815 | 21 | N | 179 | 1 |
| 5815 | 28 | N | 166.2 | 1 |
| 5877 | 19 | N | 175.5 | |
| 5877 | 42 | N | 221 | |
| 5981 | 139 | N | 133.156 | 1 |
| 6159 | 118 | N | 133.288 | 1 |
| 6269 | 16 | N | 132.5 | 1 |
| 6356 | 58 | N | 134.356 | |
| 6494 | 93 | N | 134.200 | 1 |
| 6495 | 93 | N | 134.800 | 1 |
| 6496 | 93 | N | 133.900 | 1 |
| 6603 | 69 | N | 130.658 | 1 |
| 6700 | 192 | N | 130.99 | |
| 6702 | 192 | N | 131.23 | |
| 6723 | 38 | N | 131.974 | |
| 6847 | 69 | N | 130.658 | 1 |
| 10176 | 16 | N | 130.364 | 1 |
| 10335 | 84 | N | 130.379 | 1 |
| 11053 | 97 | N | 135.656 | 1 |
| 15121 | 87 | N | 132.71 | 1 |
| 15139 | 88 | N | 130.5 | 1 |
| 15334 | 55 | N | 130.417 | 1 |
| 15431 | 51 | N | 132.5 | 1 |
| 15492 | 114 | N | 131.0 | 1 |
| 15493 | 114 | N | 130.9 | 1 |
| 15494 | 114 | N | 131.6 | 1 |
| 15495 | 114 | N | 131.9 | 1 |
| 15496 | 114 | N | 131.5 | 1 |
| 15966 | 1 | N | 131.202 | 1 |
| 16042 | 115 | N | 131.093 | 1 |
| 16046 | 115 | N | 130.630 | 1 |
| 16047 | 115 | N | 130.477 | 1 |
| 16048 | 115 | N | 130.821 | 1 |
| 16049 | 115 | N | 130.821 | 1 |
| 16276 | 165 | N | 137.322 | 1 |
| 16278 | 165 | N | 137.251 | 1 |
| 16359 | 26 | N | 135.474 | 1 |
| 16537 | 82 | N | 133.2 | 1 |
| 16768 | 21 | N | 131.9 | 1 |
| 17260 | 82 | N | 133.516 | 1 |
| 17384 | 94 | N | 131.7162 | 1 |
| 17643 | 261 | N | 132.595 | 1 |
| 17688 | 79 | N | 130.659 | 1 |
| 17905 | 67 | N | 130.695 | 1 |
| 18546 | 12 | N | 133.029 | 1 |
| 18553 | 53 | N | 130.814 | 1 |
| 18730 | 105 | N | 134.916 | 1 |
| 18823 | 78 | N | 130.950 | 1 |
| 18941 | 76 | N | 130.749 | 1 |
| 19056 | 145 | N | 130.636 | 1 |
| 19152 | 11 | N | 130.850 | |
| 19321 | 20 | N | 131.057 | 1 |
| 19563 | 140 | N | 132.319 | 1 |
| 19564 | 140 | N | 132.600 | 1 |
| 19565 | 140 | N | 132.910 | 1 |
| 19566 | 140 | N | 132.294 | 1 |
| 19567 | 140 | N | 133.021 | 1 |
| 19615 | 120 | N | 130.373 | 1 |
| 19687 | 178 | N | 132.799 | 1 |
| 19699 | 126 | N | 134.100 | 1 |
| 19843 | 8 | N | 131.059 | |
| 19855 | 5 | N | 137.109 | 1 |
| 19855 | 9 | N | 132.812 | 1 |
| 19857 | 5 | N | 133.719 | 1 |
| 19857 | 64 | N | 130.719 | 1 |
| 19857 | 9 | N | 130.969 | 1 |
| 19858 | 5 | N | 132.844 | 1 |
| 19867 | 41 | N | 202.9 | |
| 19867 | 49 | N | 222.5 | |
| 19867 | 82 | N | 193.7 | |
| 19867 | 90 | N | 207.4 | |
| 19982 | 84 | N | 132.482 | 1 |
| 19990 | 21 | N | 130.4 | |
| 19991 | 58 | N | 134.496 | 1 |
| 19995 | 86 | N | 130.684 | |
| 25442 | 13 | N | 428.252 | |
| 25713 | 113 | N | 132.444 | 1 |
| 25714 | 113 | N | 132.363 | 1 |
| 25715 | 113 | N | 132.877 | 1 |
| 26518 | 31 | N | 130.758 | 1 |
| 26873 | 41 | N | 133.312 | 1 |
| 26927 | 41 | N | 133.683 | 1 |
| 26928 | 41 | N | 133.420 | 1 |
| 26933 | 42 | N | 133.094 | 1 |
| 26962 | 11 | N | 130.479 | |
| 27022 | 21 | N | 130.341 | 1 |
| 27096 | 121 | N | 131.593 | 1 |
| 27282 | 42 | N | 133.618 | 1 |
| 27540 | 31 | N | 131.663 | 1 |
| 27593 | 65 | N | 130.367 | 1 |
| 27666 | 160 | N | 131.628 | 1 |
| 27843 | 114 | N | 130.924 | 1 |
| 28046 | 98 | N | 131.387 | 1 |
| 28047 | 98 | N | 131.120 | 1 |
| 30208 | 50 | N | 131.45 | |
| 30273 | 16 | N | 131.180 | 1 |
| 30538 | 27 | N | 130.422 | 1 |
| 30551 | 30 | N | 130.595 | 1 |
| 30825 | 188 | N | 130.363 | 1 |
| 34131 | 106 | N | 131.970 | 1 |
| 34185 | 107 | N | 130.56 | 1 |
| 34261 | 21 | N | 131.010 | |
| 50094 | 84 | N | 130.663 | 1 |
| 50158 | 317 | N | 130.779 | |
| 50718 | 51 | N | 187.563 | |
| 50719 | 51 | N | 190.866 | |
| 50721 | 51 | N | 202.893 | |
| 50722 | 51 | N | 198.238 | |
| 50723 | 51 | N | 199.891 | |
| 50778 | 30 | N | 142.4 | |
| 51859 | 44 | N | 131.76 | |
| 51896 | 23 | N | 130.367 | 1 |
| 51919 | 44 | N | 131.57 | |
| 51938 | 44 | N | 131.96 | |
| 51950 | 44 | N | 131.262 | |
| 51950 | 44 | N | 131.33 | |
| 52137 | 82 | N | 133.501 | 1 |
| 52138 | 82 | N | 133.357 | 1 |
| 52158 | 152 | N | 130.811 | 1 |
| 52158 | 152 | N | 134.755 | 1 |
| 52297 | 257 | N | 130.759 | 1 |
| 52300 | 257 | N | 130.738 | 1 |
| 52302 | 257 | N | 130.753 | 1 |
| 52306 | 257 | N | 130.803 | 1 |
| 52339 | 257 | N | 130.735 | 1 |
| High-field shifts outside of three standard deviations from the average | Entry ID | Comp. index ID | Atom ID | Chemical Shift Value | Ambiguity code |
|---|---|---|---|---|
| 915 | 1 | N | 39.9 | 1 |
| 2208 | 61 | N | 109.6 | 1 |
| 4737 | 66 | N | 107.8150 | 1 |
| 4782 | 33 | N | 108.12 | 1 |
| 4848 | 178 | N | 108.07 | |
| 4854 | 178 | N | 108.88 | |
| 5304 | 61 | N | 105.35 | 1 |
| 5333 | 69 | N | 106.7 | 1 |
| 5752 | 112 | N | 102.876 | 1 |
| 5807 | 34 | N | 106.3 | 1 |
| 6312 | 89 | N | 108.760 | 1 |
| 6348 | 1 | N | 87.6 | |
| 6572 | 69 | N | 107.91 | 1 |
| 6586 | 22 | N | 107.844 | 1 |
| 7016 | 34 | N | 0.2 | |
| 7016 | 49 | N | 0.2 | |
| 7016 | 69 | N | 0.2 | |
| 7016 | 70 | N | 0.2 | |
| 7395 | 73 | N | 107.550 | |
| 10060 | 78 | N | 108.585 | 1 |
| 11427 | 113 | N | 109.698 | 1 |
| 11467 | 159 | N | 108.475 | 1 |
| 12000 | 195 | N | 107.899 | 1 |
| 15156 | 1 | N | 39.95 | 1 |
| 15200 | 4 | N | 109.200 | 1 |
| 15283 | 1 | N | 38.953 | 1 |
| 15380 | 1 | N | 39.98 | 1 |
| 15380 | 1 | N | 40.04 | 1 |
| 15577 | 66 | N | 109.176 | 1 |
| 15683 | 3 | N | 108.9 | 1 |
| 16245 | 33 | N | 107.574 | 1 |
| 16340 | 1 | N | 37.995000 | 1 |
| 16571 | 64 | N | 109.03 | 1 |
| 16619 | 137 | N | 108.0069 | 1 |
| 16740 | 29 | N | 108.4 | |
| 16741 | 29 | N | 108.89 | |
| 16873 | 1 | N | 38.395 | 1 |
| 16873 | 1 | N | 40.32 | 1 |
| 16979 | 1 | N | 108.800 | 1 |
| 17064 | 92 | N | 108.9 | 1 |
| 17418 | 36 | N | 106.082 | |
| 17526 | 66 | N | 108.360 | 1 |
| 17810 | 1 | N | 39.95 | 1 |
| 18475 | 1 | N | 109.746 | 1 |
| 18595 | 92 | N | 108.929 | 1 |
| 18595 | 92 | N | 109.7 | 1 |
| 18596 | 27 | N | 109.5 | 1 |
| 18609 | 183 | N | 109.308 | 1 |
| 19616 | 250 | N | 109.547 | 1 |
| 19768 | 61 | N | 109.787 | 1 |
| 19855 | 18 | N | 104.492 | 1 |
| 19855 | 64 | N | 95.313 | 1 |
| 19858 | 18 | N | 107.469 | 1 |
| 19858 | 64 | N | 103.969 | 1 |
| 19892 | 118 | N | 109.702 | |
| 25048 | 191 | N | 109.46 | 1 |
| 25105 | 20 | N | 108.373 | |
| 25123 | 1 | N | 38.941 | 1 |
| 25290 | 92 | N | 109.427 | 1 |
| 26750 | 137 | N | 108.0 | 1 |
| 26750 | 385 | N | 106.9 | 1 |
| 26757 | 77 | N | 0.000 | |
| 26974 | 223 | N | 102.804 | |
| 27312 | 92 | N | 108.322 | 1 |
| 27783 | 363 | N | 108.6170 | 1 |
| 27784 | 363 | N | 108.4068 | 1 |
| 30088 | 1 | N | 106.349 | 1 |
| 30425 | 191 | N | 109.20885 | 1 |
| 30426 | 191 | N | 109.20885 | 1 |
| 30518 | 50 | N | 107.300 | 1 |
| 30905 | 68 | N | 108.936 | 1 |
| 30905 | 73 | N | 108.936 | 1 |
| 34146 | 61 | N | 109.671 | 2 |
| 50309 | 45 | N | 107.271 | 1 |
| 50476 | 75 | N | 109.648 | 1 |
| 50794 | 100 | N | 109.597 | 1 |
| 52146 | 30 | N | 109.4638137 | |