Average chemical shift: 38.535
Standard deviation: 1.974
Low-field shifts outside of three standard deviations from the average | Entry ID | Comp. index ID | Atom ID | Chemical Shift Value | Ambiguity code |
---|---|---|---|---|
4089 | 58 | CB | 44.6 | 1 |
4150 | 104 | CB | 80.980 | |
4150 | 15 | CB | 81.714 | |
4150 | 23 | CB | 81.806 | |
4150 | 33 | CB | 80.667 | |
4150 | 37 | CB | 78.897 | |
4150 | 38 | CB | 78.667 | |
4150 | 43 | CB | 78.961 | |
4150 | 56 | CB | 77.344 | |
4150 | 83 | CB | 83.177 | |
4232 | 19 | CB | 48.90 | 1 |
4232 | 37 | CB | 53.00 | 1 |
4232 | 61 | CB | 49.73 | 1 |
4232 | 62 | CB | 48.96 | 1 |
4232 | 73 | CB | 53.20 | 1 |
4318 | 5 | CB | 44.58 | 1 |
4426 | 29 | CB | 44.563 | 1 |
4697 | 55 | CB | 45.437 | |
4938 | 65 | CB | 44.9 | 1 |
5027 | 18 | CB | 45.45 | 1 |
5067 | 66 | CB | 44.71 | 1 |
5179 | 25 | CB | 87.680 | |
5179 | 43 | CB | 84.880 | |
5219 | 210 | CB | 45.7 | 1 |
5402 | 36 | CB | 45 | 1 |
5404 | 60 | CB | 45.309 | 1 |
5532 | 72 | CB | 44.847 | 1 |
5618 | 134 | CB | 44.66 | 1 |
5756 | 110 | CB | 44.8 | 1 |
5861 | 59 | CB | 45.58 | 1 |
6043 | 89 | CB | 45.157 | 1 |
6141 | 117 | CB | 51.876 | |
6142 | 60 | CB | 45.4 | 1 |
6182 | 110 | CB | 45.2 | 1 |
6232 | 80 | CB | 45.011 | 1 |
6253 | 39 | CB | 45.138 | 1 |
6542 | 86 | CB | 46.970 | 1 |
6628 | 217 | CB | 45.23 | 1 |
6910 | 102 | CB | 45.4 | 1 |
7112 | 45 | CB | 45.012 | 1 |
7121 | 41 | CB | 45.4 | 1 |
7188 | 44 | CB | 69.565 | 1 |
7219 | 75 | CB | 44.937 | 1 |
7220 | 111 | CB | 45.430 | 1 |
7395 | 64 | CB | 44.901 | |
10006 | 32 | CB | 44.840 | 1 |
11078 | 106 | CB | 44.567 | 1 |
11178 | 58 | CB | 44.684 | 1 |
11225 | 56 | CB | 44.511 | 1 |
11333 | 106 | CB | 44.530 | 1 |
11404 | 57 | CB | 45.013 | 1 |
15584 | 43 | CB | 55.387 | 1 |
15603 | 104 | CB | 44.583 | 1 |
15700 | 107 | CB | 44.460 | 1 |
15702 | 33 | CB | 44.5 | 1 |
15734 | 104 | CB | 44.700 | 1 |
15759 | 23 | CB | 44.64 | 1 |
15981 | 79 | CB | 45.181 | 1 |
16134 | 51 | CB | 45.745 | 1 |
16135 | 105 | CB | 44.74 | 1 |
16195 | 97 | CB | 44.849 | 1 |
16206 | 45 | CB | 44.49 | |
16265 | 149 | CB | 45.21 | 1 |
16336 | 131 | CB | 44.6 | 1 |
16365 | 41 | CB | 45.6 | 1 |
16463 | 54 | CB | 44.610 | 1 |
16607 | 50 | CB | 44.734 | 1 |
16729 | 208 | CB | 69.840 | 1 |
17232 | 55 | CB | 45.592 | 1 |
17405 | 90 | CB | 44.475 | 1 |
17576 | 40 | CB | 45.450 | 1 |
17582 | 40 | CB | 45.573 | 1 |
17640 | 81 | CB | 66.1230 | 1 |
18303 | 90 | CB | 45.698 | 1 |
18953 | 36 | CB | 45.7700 | 1 |
19108 | 96 | CB | 45.073 | |
19206 | 114 | CB | 44.599 | 1 |
19443 | 38 | CB | 44.510 | |
19834 | 171 | CB | 45.525 | |
19834 | 189 | CB | 45.492 | |
19834 | 92 | CB | 48.652 | |
25108 | 25 | CB | 69.64 | 1 |
25132 | 106 | CB | 45.431 | 1 |
25166 | 52 | CB | 44.694 | 1 |
25382 | 10 | CB | 68.558 | |
25382 | 12 | CB | 68.105 | |
25382 | 37 | CB | 65.935 | |
25382 | 43 | CB | 69.214 | |
25382 | 50 | CB | 67.671 | |
25382 | 79 | CB | 68.710 | |
25382 | 81 | CB | 66.894 | |
25382 | 83 | CB | 65.926 | |
25442 | 12 | CB | 339.785 | |
25442 | 38 | CB | 338.695 | |
25463 | 39 | CB | 44.793 | 1 |
25564 | 26 | CB | 45.088 | 1 |
25677 | 9 | CB | 45.010 | 1 |
25913 | 22 | CB | 44.667 | 1 |
25914 | 22 | CB | 44.635 | 1 |
25985 | 94 | CB | 45.256 | 1 |
25993 | 35 | CB | 45.509 | 1 |
26557 | 88 | CB | 46.2 | |
26692 | 31 | CB | 44.664 | |
26717 | 167 | CB | 46.1 | 1 |
26753 | 106 | CB | 45.486 | 1 |
26772 | 25 | CB | 63.537 | 1 |
26860 | 38 | CB | 45.64654353 | |
26861 | 38 | CB | 45.73993613 | |
26871 | 101 | CB | 44.7565 | 1 |
26940 | 103 | CB | 44.788 | 1 |
26940 | 68 | CB | 44.461 | 1 |
26962 | 129 | CB | 44.584 | |
26962 | 212 | CB | 44.461 | |
27062 | 69 | CB | 45.309 | 1 |
27158 | 114 | CB | 45.4 | 1 |
27170 | 40 | CB | 46.027 | 1 |
27241 | 104 | CB | 44.768 | 1 |
27298 | 104 | CB | 44.875 | 1 |
27381 | 92 | CB | 44.588 | 1 |
27529 | 123 | CB | 44.944 | 1 |
27733 | 25 | CB | 45.5000 | 1 |
27737 | 25 | CB | 44.9940 | 1 |
27969 | 137 | CB | 45.490 | 1 |
30100 | 67 | CB | 45.036 | |
30139 | 146 | CB | 45.51 | 1 |
30285 | 72 | CB | 44.632 | 1 |
30901 | 43 | CB | 45.291 | 1 |
30969 | 28 | CB | 44.53 | |
34121 | 176 | CB | 44.621 | 1 |
34121 | 66 | CB | 44.647 | 1 |
34246 | 66 | CB | 45.183 | 1 |
34255 | 66 | CB | 45.149 | |
50173 | 49 | CB | 44.937 | 1 |
50241 | 145 | CB | 44.688 | 1 |
50452 | 58 | CB | 44.726 | 1 |
50765 | 74 | CB | 44.789 | 1 |
50969 | 25 | CB | 45.132 | 1 |
50993 | 25 | CB | 45.132 | 1 |
51379 | 110 | CB | 44.490 | 1 |
51471 | 80 | CB | 44.651 | 1 |
51489 | 42 | CB | 44.54 | |
51490 | 26 | CB | 51.78526161 | 1 |
52158 | 130 | CB | 44.581 | 1 |
52158 | 130 | CB | 44.633 | 1 |
High-field shifts outside of three standard deviations from the average | Entry ID | Comp. index ID | Atom ID | Chemical Shift Value | Ambiguity code |
---|---|---|---|---|
1580 | 59 | CB | 32.2 | 1 |
4127 | 80 | CB | 32.3 | 1 |
4136 | 5 | CB | 26.8 | 1 |
4144 | 44 | CB | 31.9 | 1 |
4152 | 90 | CB | 32.6 | 1 |
4239 | 68 | CB | 20.939 | |
4313 | 132 | CB | 29.2 | 1 |
4431 | 12 | CB | 30.8 | 1 |
4475 | 20 | CB | 29.7 | 1 |
4574 | 19 | CB | 32.4 | 1 |
4678 | 56 | CB | 28.27 | |
4732 | 23 | CB | 31.8 | 1 |
4768 | 124 | CB | 27.4 | |
4819 | 52 | CB | 32.55 | 1 |
4829 | 51 | CB | 32.161 | 1 |
4831 | 58 | CB | 32.6 | |
4953 | 61 | CB | 31.522 | 1 |
5000 | 59 | CB | 30.23 | 1 |
5022 | 84 | CB | 32.361 | |
5040 | 77 | CB | 32.6 | 1 |
5267 | 104 | CB | 29.68 | 1 |
5368 | 73 | CB | 32.2 | 1 |
5455 | 136 | CB | 32.2 | 1 |
5474 | 261 | CB | 32.41 | 1 |
5514 | 167 | CB | 28.90 | 1 |
5547 | 174 | CB | 31.5 | 1 |
5552 | 125 | CB | 32.22 | 1 |
5552 | 63 | CB | 30.23 | 1 |
5678 | 16 | CB | 31.09 | 1 |
5752 | 130 | CB | 30.853 | 1 |
5752 | 163 | CB | 31.269 | 1 |
5772 | 21 | CB | 32.195 | 1 |
5797 | 92 | CB | 31.80 | 1 |
5816 | 87 | CB | 31.4 | 1 |
5928 | 16 | CB | 32.3 | 1 |
5935 | 92 | CB | 29.228 | 1 |
5955 | 33 | CB | 30.5 | 1 |
5959 | 99 | CB | 32.6 | 1 |
6021 | 195 | CB | 31.6 | 1 |
6129 | 25 | CB | 31.66 | |
6130 | 25 | CB | 32.02 | |
6331 | 85 | CB | 32.533 | 1 |
6346 | 37 | CB | 32.010 | 1 |
6348 | 16 | CB | 30.2 | |
6348 | 16 | CB | 31.1 | |
6433 | 79 | CB | 31.02 | 1 |
6484 | 83 | CB | 30.59 | 1 |
6531 | 80 | CB | 30.080 | |
6532 | 80 | CB | 31.770 | |
6546 | 158 | CB | 30.6 | 1 |
6586 | 129 | CB | 30.895 | 1 |
6586 | 17 | CB | 30.753 | 1 |
6586 | 50 | CB | 29.620 | 1 |
6586 | 53 | CB | 30.470 | 1 |
6586 | 72 | CB | 26.362 | 9 |
6586 | 77 | CB | 22.113 | 1 |
6586 | 99 | CB | 28.557 | 1 |
6700 | 158 | CB | 27.80 | |
6748 | 91 | CB | 30.5 | |
6787 | 33 | CB | 31.98 | 1 |
6850 | 27 | CB | 32.409 | 1 |
6883 | 173 | CB | 28.400 | 1 |
7089 | 159 | CB | 31.900 | 1 |
7184 | 49 | CB | 30.87 | 1 |
7218 | 27 | CB | 32.480 | |
7282 | 10 | CB | 30.165 | 1 |
7308 | 105 | CB | 30.6 | 1 |
7308 | 128 | CB | 28.3 | 1 |
7308 | 96 | CB | 32.5 | 1 |
7325 | 48 | CB | 30.942 | |
7359 | 40 | CB | 32.515 | 1 |
7360 | 40 | CB | 32.553 | 1 |
7406 | 148 | CB | 27.2 | 1 |
7406 | 74 | CB | 30.2 | 1 |
7414 | 149 | CB | 32.277 | 1 |
11011 | 24 | CB | 29.733 | 1 |
11453 | 49 | CB | 31.270 | 1 |
11492 | 60 | CB | 27.328 | 1 |
11492 | 61 | CB | 28.378 | 1 |
11492 | 93 | CB | 31.531 | 1 |
11596 | 70 | CB | 30.62 | 1 |
12009 | 235 | CB | 30.181 | 1 |
15010 | 17 | CB | 32.58 | 1 |
15120 | 155 | CB | 28.9 | |
15164 | 404 | CB | 32.062 | 1 |
15385 | 36 | CB | 32.010 | 1 |
15388 | 36 | CB | 30.149 | 1 |
15393 | 32 | CB | 32.5770 | |
15461 | 148 | CB | 27.2 | 1 |
15461 | 74 | CB | 30.2 | 1 |
15578 | 30 | CB | 32.607 | 1 |
15578 | 321 | CB | 32.594 | 1 |
15680 | 188 | CB | 31.540 | 1 |
15680 | 225 | CB | 31.446 | 1 |
15680 | 272 | CB | 31.733 | 1 |
15912 | 90 | CB | 31.92 | 1 |
16031 | 48 | CB | 32.462 | 1 |
16045 | 29 | CB | 32.543 | 1 |
16114 | 32 | CB | 31.561 | 1 |
16115 | 129 | CB | 31.001 | 1 |
16123 | 18 | CB | 18.1 | 1 |
16204 | 31 | CB | 31.930 | 1 |
16205 | 31 | CB | 31.760 | 1 |
16337 | 14 | CB | 30.2 | 4 |
16396 | 16 | CB | 32.114 | 1 |
16402 | 45 | CB | 31.530 | 1 |
16701 | 157 | CB | 30.902 | 1 |
16729 | 129 | CB | 29.557 | 1 |
16729 | 134 | CB | 30.620 | 1 |
16729 | 170 | CB | 30.965 | 1 |
16729 | 55 | CB | 29.045 | 1 |
16787 | 13 | CB | 29.448 | 1 |
16796 | 16 | CB | 32.114 | 1 |
16809 | 88 | CB | 31.92 | 1 |
16864 | 15 | CB | 31.928 | |
16884 | 28 | CB | 32.2 | 1 |
16884 | 39 | CB | 32.3 | 1 |
16984 | 165 | CB | 32.276 | 1 |
17010 | 82 | CB | 29.54 | 1 |
17148 | 49 | CB | 32.265 | 1 |
17173 | 47 | CB | 32.075 | 1 |
17261 | 82 | CB | 32.4 | 1 |
17262 | 82 | CB | 32.2 | 1 |
17367 | 32 | CB | 24.748 | 1 |
17529 | 16 | CB | 31.975 | 1 |
17574 | 57 | CB | 31.682 | 1 |
17633 | 31 | CB | 30.610 | 1 |
17660 | 112 | CB | 31.743 | 1 |
17702 | 16 | CB | 32.114 | 1 |
17781 | 13 | CB | 32.293 | 1 |
17782 | 11 | CB | 31.918 | 1 |
18111 | 61 | CB | 32.420 | 1 |
18112 | 58 | CB | 30.657 | 1 |
18205 | 55 | CB | 32.341 | |
18344 | 53 | CB | 27.487 | 1 |
18373 | 248 | CB | 32.179 | 1 |
18488 | 31 | CB | 32.160 | 1 |
18588 | 264 | CB | 32.5 | 1 |
18603 | 234 | CB | 31.919 | 1 |
18609 | 164 | CB | 32.489 | 1 |
18612 | 159 | CB | 30.0000 | 1 |
18613 | 111 | CB | 26.230 | 1 |
18613 | 119 | CB | 32.547 | 1 |
18969 | 18 | CB | 29.901 | 1 |
19063 | 28 | CB | 24.854 | |
19063 | 33 | CB | 26.72 | |
19063 | 43 | CB | 30.521 | |
19063 | 75 | CB | 27.826 | |
19063 | 88 | CB | 29.623 | |
19126 | 136 | CB | 32.444 | 1 |
19209 | 190 | CB | 32.18 | 1 |
19223 | 266 | CB | 32.074 | 1 |
19321 | 54 | CB | 26.107 | 1 |
19395 | 34 | CB | 31.646 | |
19443 | 71 | CB | 25.880 | |
19458 | 116 | CB | 31.0460 | |
19458 | 81 | CB | 29.9300 | |
19560 | 92 | CB | 32.26 | 1 |
19736 | 106 | CB | 31.817 | 1 |
19844 | 105 | CB | 29.69 | |
19851 | 39 | CB | 31.159 | 1 |
19851 | 73 | CB | 32.494 | 1 |
19954 | 47 | CB | 32.038 | |
19996 | 99 | CB | 32.474 | 1 |
25021 | 99 | CB | 32.474 | 1 |
25157 | 107 | CB | 30.304 | 1 |
25157 | 129 | CB | 32.04 | 1 |
25157 | 72 | CB | 31.948 | 1 |
25247 | 283 | CB | 32.33 | 1 |
25266 | 126 | CB | 32.4000 | 1 |
25267 | 29 | CB | 32.38 | 1 |
25342 | 95 | CB | 31.783 | 1 |
25567 | 95 | CB | 31.929 | |
25573 | 13 | CB | 28.9027 | 1 |
25573 | 39 | CB | 31.4925 | 1 |
25712 | 203 | CB | 32.556 | 1 |
25727 | 146 | CB | 32.358 | |
25859 | 159 | CB | 31.900 | 1 |
25972 | 23 | CB | 32.098 | |
25973 | 23 | CB | 31.692 | |
25983 | 105 | CB | 29.922 | |
26600 | 133 | CB | 28.828 | 1 |
26601 | 135 | CB | 28.733 | 1 |
26624 | 32 | CB | 32.4373 | 1 |
26751 | 46 | CB | 31.3839 | 1 |
26766 | 115 | CB | 32.4000 | 1 |
26801 | 194 | CB | -34.477 | 1 |
26814 | 266 | CB | 31.893 | 1 |
26884 | 76 | CB | 31.812 | 1 |
26908 | 30 | CB | 32.53 | 1 |
26932 | 49 | CB | 29.49 | 1 |
26942 | 11 | CB | 30.314 | 1 |
27051 | 111 | CB | 30.355 | 1 |
27059 | 235 | CB | 30.100 | |
27059 | 259 | CB | 31.900 | |
27059 | 86 | CB | 31.000 | |
27080 | 117 | CB | 30.401 | 1 |
27121 | 226 | CB | 28.268 | |
27121 | 273 | CB | 30.855 | |
27122 | 273 | CB | 30.855 | |
27184 | 14 | CB | 32.295 | 1 |
27233 | 25 | CB | 32.1319 | 1 |
27271 | 32 | CB | 31.662 | 1 |
27279 | 135 | CB | 28.733 | 1 |
27457 | 29 | CB | 32.340 | 1 |
27466 | 83 | CB | 32.546 | 1 |
27527 | 30 | CB | 31.541 | |
27529 | 26 | CB | 29.727 | 1 |
27622 | 71 | CB | 32.37 | |
27643 | 39 | CB | 29.937 | |
27691 | 51 | CB | 32.188 | 1 |
27705 | 136 | CB | 32.002 | 1 |
28109 | 156 | CB | 31.962 | 1 |
30079 | 7 | CB | 32.606 | |
30150 | 185 | CB | 31.561 | 1 |
30469 | 92 | CB | 29.275 | |
30537 | 66 | CB | 32.3 | 1 |
30863 | 14 | CB | 32.304 | 1 |
30888 | 136 | CB | 32.002 | 1 |
31030 | 10 | CB | 32.130 | 1 |
34260 | 145 | CB | 32.608 | |
34260 | 47 | CB | 31.992 | |
34308 | 33 | CB | 32.044 | 1 |
34308 | 91 | CB | 32.569 | 1 |
34329 | 107 | CB | 32.412 | 1 |
34329 | 42 | CB | 32.260 | 1 |
34347 | 255 | CB | 31.964 | |
34347 | 91 | CB | 31.171 | |
34638 | 150 | CB | 30.760 | |
34667 | 16 | CB | 31.211 | |
36136 | 39 | CB | 28.968 | |
36343 | 14 | CB | 31.7 | 1 |
50022 | 167 | CB | 28.848 | |
50022 | 63 | CB | 32.157 | |
50022 | 71 | CB | 30.514 | |
50022 | 79 | CB | 32.037 | |
50022 | 98 | CB | 29.132 | |
50258 | 53 | CB | 32.344 | 1 |
50331 | 22 | CB | 29.029 | 1 |
50689 | 116 | CB | 32.349 | |
50691 | 134 | CB | 32.234 | |
50809 | 81 | CB | 30.124 | 1 |
50900 | 23 | CB | 18.854 | |
50917 | 172 | CB | 30.3 | 1 |
50936 | 46 | CB | 31.8910 | 1 |
50941 | 150 | CB | 30.070 | 1 |
50941 | 98 | CB | 30.373 | 1 |
51065 | 80 | CB | 31.584 | |
51066 | 73 | CB | 32.251 | |
51268 | 94 | CB | 30.081 | 1 |
51411 | 208 | CB | 31.58 | 1 |
51437 | 52 | CB | 30.171 | 1 |
51515 | 200 | CB | 31.99 | |
51607 | 139 | CB | 30.5813818 | |
51659 | 129 | CB | 31.08 | 1 |
51784 | 135 | CB | 32.008 | 1 |
51912 | 117 | CB | 32.3 | 1 |
51913 | 117 | CB | 32.2 | 1 |
51994 | 136 | CB | 32.453 | 1 |
52077 | 54 | CB | 32.080 | 1 |
52087 | 63 | CB | 32.409 | 1 |
52147 | 34 | CB | 32.601 |