TRP HH2 Chemical Shift Outliers
Average chemical shift: 6.984
Standard deviation: 0.348
| Low-field shifts outside of three standard deviations from the average | Entry ID | Comp. index ID | Atom ID | Chemical Shift Value | Ambiguity code |
|---|---|---|---|---|
| 4307 | 10 | HH2 | 8.03 | 1 |
| 4475 | 24 | HH2 | 9.75 | 1 |
| 4498 | 42 | HH2 | 10.17 | |
| 5263 | 30 | HH2 | 8.065 | |
| 5902 | 36 | HH2 | 8.414 | 1 |
| 5988 | 11 | HH2 | 10.900 | 1 |
| 5988 | 28 | HH2 | 9.540 | 1 |
| 6868 | 60 | HH2 | 8.219 | 1 |
| 11299 | 43 | HH2 | 8.075 | 1 |
| 15375 | 37 | HH2 | 9.587 | 1 |
| 16849 | 37 | HH2 | 9.587 | 1 |
| 17091 | 1 | HH2 | 10.07 | 1 |
| 17808 | 61 | HH2 | 8.633 | |
| 17988 | 49 | HH2 | 8.797 | 1 |
| 19282 | 79 | HH2 | 8.263 | |
| High-field shifts outside of three standard deviations from the average | Entry ID | Comp. index ID | Atom ID | Chemical Shift Value | Ambiguity code |
|---|---|---|---|---|
| 131 | 64 | HH2 | 5.76 | 1 |
| 345 | 64 | HH2 | 5.7 | 1 |
| 349 | 31 | HH2 | 5.57 | 1 |
| 353 | 26 | HH2 | 5.27 | 1 |
| 367 | 62 | HH2 | 5.89 | 1 |
| 759 | 77 | HH2 | 5.82 | 1 |
| 922 | 64 | HH2 | 5.7 | 1 |
| 1163 | 133 | HH2 | 2.89 | 1 |
| 1163 | 158 | HH2 | 3.44 | 1 |
| 1163 | 21 | HH2 | 3.74 | 1 |
| 1163 | 5 | HH2 | 2.86 | 1 |
| 1164 | 133 | HH2 | 2.88 | 1 |
| 1164 | 158 | HH2 | 3.43 | 1 |
| 1164 | 21 | HH2 | 3.58 | 1 |
| 1164 | 5 | HH2 | 2.88 | 1 |
| 1165 | 133 | HH2 | 2.88 | 1 |
| 1165 | 158 | HH2 | 3.43 | 1 |
| 1165 | 21 | HH2 | 3.7 | 1 |
| 1165 | 5 | HH2 | 2.86 | 1 |
| 1166 | 133 | HH2 | 2.86 | 1 |
| 1166 | 5 | HH2 | 2.84 | 1 |
| 1167 | 133 | HH2 | 2.89 | 1 |
| 1167 | 158 | HH2 | 3.42 | 1 |
| 1167 | 21 | HH2 | 3.69 | 1 |
| 1167 | 5 | HH2 | 2.87 | 1 |
| 1168 | 133 | HH2 | 2.87 | 1 |
| 1168 | 158 | HH2 | 3.41 | 1 |
| 1168 | 21 | HH2 | 3.72 | 1 |
| 1168 | 5 | HH2 | 2.87 | 1 |
| 1170 | 59 | HH2 | 5.72 | 1 |
| 1333 | 77 | HH2 | 5.77 | 1 |
| 1346 | 133 | HH2 | 2.89 | 1 |
| 1346 | 21 | HH2 | 3.65 | 1 |
| 1347 | 133 | HH2 | 2.89 | 1 |
| 1347 | 158 | HH2 | 3.43 | 1 |
| 1347 | 21 | HH2 | 3.66 | 1 |
| 1347 | 5 | HH2 | 2.88 | 1 |
| 1348 | 133 | HH2 | 2.89 | 1 |
| 1348 | 158 | HH2 | 3.42 | 1 |
| 1348 | 21 | HH2 | 3.62 | 1 |
| 1348 | 5 | HH2 | 2.88 | 1 |
| 1379 | 91 | HH2 | 5.61 | 1 |
| 1474 | 29 | HH2 | 5.39 | 1 |
| 1476 | 31 | HH2 | 5.598 | 1 |
| 1477 | 31 | HH2 | 5.556 | 1 |
| 1991 | 36 | HH2 | 5.81 | 1 |
| 2261 | 26 | HH2 | 5.57 | 1 |
| 2852 | 95 | HH2 | 5.63 | 1 |
| 3322 | 4 | HH2 | 4.95 | 1 |
| 4049 | 69 | HH2 | 5.68 | 1 |
| 4129 | 170 | HH2 | 5.80 | 1 |
| 4141 | 56 | HH2 | 5.74 | 1 |
| 4189 | 59 | HH2 | 5.72 | 1 |
| 4205 | 44 | HH2 | 5.80 | 1 |
| 4276 | 29 | HH2 | 4.94 | 1 |
| 4297 | 25 | HH2 | 5.89 | 1 |
| 4368 | 59 | HH2 | 5.74 | 1 |
| 4377 | 42 | HH2 | 5.60 | 1 |
| 4384 | 91 | HH2 | 5.403 | 1 |
| 4435 | 68 | HH2 | 3.97 | 1 |
| 4452 | 88 | HH2 | 5.4890 | 1 |
| 4471 | 57 | HH2 | 5.52 | 1 |
| 4510 | 40 | HH2 | 5.30 | 1 |
| 4628 | 107 | HH2 | 5.617 | |
| 4700 | 31 | HH2 | 5.415 | 1 |
| 4782 | 82 | HH2 | 5.26 | 1 |
| 4830 | 141 | HH2 | 5.26 | 1 |
| 4830 | 81 | HH2 | 5.61 | 1 |
| 4833 | 73 | HH2 | 4.96 | 1 |
| 4960 | 77 | HH2 | 5.62 | 1 |
| 5012 | 48 | HH2 | 5.60 | 1 |
| 5075 | 49 | HH2 | 4.92 | 1 |
| 5121 | 25 | HH2 | 5.873 | 1 |
| 5122 | 24 | HH2 | 5.868 | 1 |
| 5262 | 39 | HH2 | 5.28 | 1 |
| 5299 | 67 | HH2 | 5.010 | 1 |
| 5304 | 34 | HH2 | 5.91 | 1 |
| 5372 | 59 | HH2 | 5.69 | 1 |
| 5399 | 30 | HH2 | 5.75 | 1 |
| 5406 | 59 | HH2 | 5.701 | 1 |
| 5466 | 51 | HH2 | 5.60 | |
| 5524 | 76 | HH2 | 5.580 | 1 |
| 5558 | 53 | HH2 | 5.67 | 1 |
| 5628 | 124 | HH2 | 5.67 | 1 |
| 5880 | 51 | HH2 | 5.476 | 1 |
| 5981 | 113 | HH2 | 5.142 | 1 |
| 6221 | 31 | HH2 | 5.543 | 1 |
| 6298 | 153 | HH2 | 5.019 | |
| 6334 | 86 | HH2 | 5.616 | 1 |
| 6406 | 104 | HH2 | 5.336 | 1 |
| 6578 | 141 | HH2 | 5.3000 | 1 |
| 6620 | 191 | HH2 | 5.683 | 1 |
| 6829 | 37 | HH2 | 5.938 | 1 |
| 6840 | 67 | HH2 | 5.43 | 1 |
| 6910 | 48 | HH2 | 5.17 | 1 |
| 7118 | 7 | HH2 | 5.812 | |
| 7150 | 24 | HH2 | 5.78 | 1 |
| 7150 | 48 | HH2 | 5.67 | 1 |
| 7179 | 5 | HH2 | 5.19 | 1 |
| 7210 | 51 | HH2 | 5.846 | 1 |
| 7231 | 188 | HH2 | 5.691 | 1 |
| 7285 | 4 | HH2 | 4.93 | 1 |
| 7296 | 77 | HH2 | 5.643 | 1 |
| 10005 | 44 | HH2 | 5.83 | 1 |
| 10035 | 87 | HH2 | 5.455 | 1 |
| 10065 | 49 | HH2 | 5.200 | 1 |
| 10107 | 103 | HH2 | 5.814 | 1 |
| 10263 | 27 | HH2 | 5.081 | 1 |
| 10288 | 74 | HH2 | 5.879 | 1 |
| 11017 | 50 | HH2 | 5.87 | 1 |
| 11057 | 131 | HH2 | 5.780 | 1 |
| 11086 | 117 | HH2 | 5.694 | 1 |
| 11086 | 30 | HH2 | 5.666 | 1 |
| 11092 | 56 | HH2 | 5.911 | 1 |
| 11114 | 47 | HH2 | 4.392 | 1 |
| 11337 | 29 | HH2 | 5.763 | 1 |
| 11352 | 57 | HH2 | 5.887 | 1 |
| 11353 | 47 | HH2 | 5.862 | 1 |
| 11354 | 57 | HH2 | 5.872 | 1 |
| 11497 | 65 | HH2 | 5.336 | 1 |
| 11549 | 21 | HH2 | 5.894 | 1 |
| 15098 | 71 | HH2 | 5.203 | 1 |
| 15335 | 73 | HH2 | 5.925 | 1 |
| 15344 | 33 | HH2 | 5.911 | 1 |
| 15344 | 69 | HH2 | 4.530 | 1 |
| 15419 | 39 | HH2 | 5.110 | 1 |
| 15806 | 21 | HH2 | 5.647 | 1 |
| 15941 | 87 | HH2 | 5.070 | 1 |
| 16174 | 44 | HH2 | 5.872 | 1 |
| 16174 | 55 | HH2 | 5.509 | 1 |
| 16255 | 18 | HH2 | 5.63 | 1 |
| 16312 | 78 | HH2 | 5.84 | 1 |
| 16406 | 70 | HH2 | 5.612 | 1 |
| 16426 | 47 | HH2 | 5.783 | 1 |
| 16466 | 29 | HH2 | 5.159 | 1 |
| 16473 | 54 | HH2 | 5.54 | 1 |
| 16491 | 70 | HH2 | 5.923 | 1 |
| 16692 | 9 | HH2 | 5.936 | 1 |
| 16772 | 141 | HH2 | 5.561 | 1 |
| 16773 | 141 | HH2 | 5.554 | 1 |
| 17062 | 28 | HH2 | 4.895 | 1 |
| 17139 | 15 | HH2 | 5.912 | 1 |
| 17146 | 58 | HH2 | 5.51 | 1 |
| 17232 | 132 | HH2 | 5.238 | 1 |
| 17305 | 72 | HH2 | 5.751 | 1 |
| 17420 | 30 | HH2 | 5.221 | 1 |
| 17713 | 70 | HH2 | 5.69 | 1 |
| 17818 | 83 | HH2 | 5.65 | 1 |
| 17890 | 125 | HH2 | 5.868 | 1 |
| 17902 | 125 | HH2 | 5.880 | 1 |
| 17904 | 64 | HH2 | 5.771 | |
| 17953 | 191 | HH2 | 5.743 | 1 |
| 18001 | 72 | HH2 | 5.84 | 1 |
| 18011 | 34 | HH2 | 5.425 | 1 |
| 18158 | 72 | HH2 | 5.76 | 1 |
| 18250 | 141 | HH2 | 5.405 | 1 |
| 18278 | 60 | HH2 | 5.441 | 1 |
| 18415 | 88 | HH2 | 5.736 | 1 |
| 18431 | 78 | HH2 | 5.170 | |
| 18433 | 93 | HH2 | 4.372 | |
| 18530 | 116 | HH2 | 5.917 | 1 |
| 18620 | 9 | HH2 | 5.83 | 1 |
| 18667 | 98 | HH2 | 5.360 | 1 |
| 18761 | 45 | HH2 | 5.751 | 1 |
| 18837 | 122 | HH2 | 5.108 | 1 |
| 18874 | 51 | HH2 | 5.827 | 1 |
| 18947 | 23 | HH2 | 5.86 | 1 |
| 18951 | 36 | HH2 | 5.897 | 1 |
| 19045 | 108 | HH2 | 5.809 | 1 |
| 19240 | 59 | HH2 | 5.641 | 1 |
| 19241 | 59 | HH2 | 5.641 | 1 |
| 19248 | 29 | HH2 | 5.843 | |
| 19320 | 76 | HH2 | 5.631 | 1 |
| 19354 | 66 | HH2 | 5.215 | 1 |
| 19551 | 175 | HH2 | 5.600 | 1 |
| 19842 | 163 | HH2 | 4.963 | 1 |
| 25102 | 30 | HH2 | 5.364 | 1 |
| 25188 | 104 | HH2 | 5.135 | 1 |
| 25239 | 101 | HH2 | 5.85 | 1 |
| 25294 | 16 | HH2 | 5.893 | |
| 25300 | 19 | HH2 | 5.865 | 1 |
| 25660 | 59 | HH2 | 5.578 | 1 |
| 25798 | 117 | HH2 | 5.302 | 1 |
| 25799 | 117 | HH2 | 5.423 | 1 |
| 25907 | 59 | HH2 | 5.683 | |
| 26047 | 63 | HH2 | 5.659 | 1 |
| 26333 | 175 | HH2 | 5.452 | 1 |
| 27477 | 32 | HH2 | 5.9258 | 1 |
| 27987 | 45 | HH2 | 4.481 | 1 |
| 28037 | 66 | HH2 | 5.456 | 1 |
| 28038 | 63 | HH2 | 5.533 | 1 |
| 30423 | 145 | HH2 | 4.781 | 1 |
| 34037 | 21 | HH2 | 5.616 | 1 |
| 34047 | 54 | HH2 | 5.562 | 1 |
| 34227 | 21 | HH2 | 5.481 | 1 |
| 34229 | 21 | HH2 | 5.481 | 1 |
| 34515 | 21 | HH2 | 5.446 | 1 |
| 34717 | 95 | HH2 | 5.731 | 1 |
| 34731 | 70 | HH2 | 5.480 | |
| 52100 | 147 | HH2 | 5.380 | |
| 52100 | 173 | HH2 | 5.060 | |