Average chemical shift: 58.71
Standard deviation: 2.047
Low-field shifts outside of three standard deviations from the average | Entry ID | Comp. index ID | Atom ID | Chemical Shift Value | Ambiguity code |
---|---|---|---|---|
4060 | 11 | CA | 66.91 | 1 |
4061 | 93 | CA | 65.8 | 1 |
4232 | 15 | CA | 65.07 | 1 |
4232 | 15 | CA | 76.07 | 1 |
4232 | 2 | CA | 75.18 | 1 |
4232 | 38 | CA | 74.86 | 1 |
4232 | 70 | CA | 74.88 | 1 |
4413 | 51 | CA | 66.911 | 1 |
4854 | 170 | CA | 66.83 | |
4876 | 5 | CA | 65.00 | 1 |
4979 | 36 | CA | 68.4 | 1 |
4979 | 8 | CA | 65.3 | 1 |
5219 | 173 | CA | 64.9 | 1 |
5294 | 92 | CA | 65.74 | 1 |
5721 | 68 | CA | 65.4 | 1 |
5854 | 246 | CA | 65.550 | 1 |
5891 | 5 | CA | 65.125 | 1 |
6183 | 133 | CA | 66.408 | 1 |
6232 | 28 | CA | 67.362 | 1 |
6232 | 52 | CA | 65.725 | 1 |
6365 | 119 | CA | 65.4 | 1 |
6460 | 14 | CA | 65.250 | 1 |
6690 | 65 | CA | 64.858 | 1 |
6722 | 20 | CA | 66.616 | 1 |
10036 | 20 | CA | 64.900 | 1 |
11294 | 138 | CA | 65.318 | 1 |
11562 | 57 | CA | 66.66 | 1 |
15162 | 28 | CA | 64.90 | 1 |
15193 | 98 | CA | 64.9 | 1 |
15248 | 251 | CA | 65.432 | 1 |
15248 | 92 | CA | 66.99 | 1 |
15867 | 53 | CA | 65.0 | 1 |
15877 | 12 | CA | 86.841 | 1 |
15877 | 13 | CA | 89.546 | 1 |
15877 | 2 | CA | 88.436 | 1 |
16538 | 69 | CA | 65.594 | 1 |
16541 | 16 | CA | 65.48941 | 1 |
16542 | 69 | CA | 65.659 | 1 |
16729 | 148 | CA | 65.978 | 1 |
16729 | 332 | CA | 65.101 | 1 |
16729 | 49 | CA | 66.054 | 1 |
16783 | 74 | CA | 67.296 | 1 |
17126 | 121 | CA | 65.368 | 1 |
17492 | 21 | CA | 73.678 | |
17592 | 29 | CA | 175.20 | 1 |
17653 | 53 | CA | 65.94 | 1 |
17804 | 369 | CA | 65.321 | 1 |
17804 | 369 | CA | 65.325 | 1 |
17853 | 40 | CA | 66.792 | 1 |
18392 | 67 | CA | 65.92 | 1 |
18672 | 12 | CA | 73.191 | 1 |
18856 | 27 | CA | 64.966 | |
19107 | 47 | CA | 68.5000 | |
19156 | 142 | CA | 64.892 | 1 |
19520 | 28 | CA | 66.186 | 1 |
19522 | 28 | CA | 66.186 | 1 |
19720 | 79 | CA | 65.61 | |
19721 | 79 | CA | 65.71 | |
19722 | 79 | CA | 65.8 | |
19739 | 91 | CA | 65.621 | |
19803 | 109 | CA | 65.117 | 1 |
19803 | 230 | CA | 65.333 | 1 |
19803 | 73 | CA | 65.334 | 1 |
25292 | 164 | CA | 65.1260 | 1 |
25375 | 227 | CA | 64.897 | |
25442 | 16 | CA | 361.278 | |
25442 | 24 | CA | 356.122 | |
25514 | 86 | CA | 65.413 | |
25921 | 85 | CA | 65.062 | 1 |
27050 | 98 | CA | 65.793 | 1 |
27080 | 113 | CA | 66.952 | 1 |
27314 | 96 | CA | 65.7017 | 1 |
27315 | 108 | CA | 123.360 | |
27392 | 330 | CA | 65.264 | 1 |
27446 | 108 | CA | 65.107 | 1 |
27623 | 74 | CA | 65.2960 | 1 |
27676 | 44 | CA | 64.86 | 1 |
27934 | 109 | CA | 65.200 | 1 |
28029 | 5 | CA | 65.200 | |
28029 | 5 | CA | 65.400 | |
30517 | 109 | CA | 65.45 | 1 |
30676 | 40 | CA | 65.084 | |
30925 | 40 | CA | 65.084 | |
34248 | 63 | CA | 65.442 | 1 |
50158 | 75 | CA | 65.483 | |
50173 | 21 | CA | 65.389 | 1 |
50210 | 205 | CA | 67.739 | 1 |
50270 | 164 | CA | 65.731 | 1 |
50393 | 130 | CA | 65.855 | 1 |
50676 | 262 | CA | 65.19 | |
50971 | 130 | CA | 65.816 | 1 |
51027 | 64 | CA | 65.21908476 | |
51179 | 36 | CA | 66.0192899112663 | |
51180 | 44 | CA | 64.86 | |
52197 | 67 | CA | 65.446 | 1 |
High-field shifts outside of three standard deviations from the average | Entry ID | Comp. index ID | Atom ID | Chemical Shift Value | Ambiguity code |
---|---|---|---|---|
4068 | 26 | CA | 45.43 | 1 |
4102 | 178 | CA | 52.5 | 1 |
4144 | 61 | CA | 52.4 | 1 |
4342 | 70 | CA | 51.7 | 1 |
4431 | 110 | CA | 51.8 | 1 |
4431 | 127 | CA | 50.2 | 1 |
4431 | 35 | CA | 51.1 | 1 |
4431 | 45 | CA | 48.9 | 1 |
4431 | 5 | CA | 51.1 | 1 |
4704 | 46 | CA | 52.300 | 1 |
4867 | 145 | CA | 51.3 | 1 |
4902 | 87 | CA | 52.52 | 1 |
5148 | 40 | CA | 51.341 | 1 |
5180 | 36 | CA | 51.94 | |
5511 | 41 | CA | 51.24 | 1 |
5511 | 86 | CA | 51.93 | 1 |
5514 | 65 | CA | 45.13 | 1 |
5514 | 99 | CA | 52.54 | 1 |
5594 | 16 | CA | 49.19 | 1 |
5742 | 27 | CA | 51.594 | |
5819 | 77 | CA | 51.2 | 1 |
5861 | 149 | CA | 51.40 | 1 |
5928 | 62 | CA | 51.8 | 1 |
6073 | 39 | CA | 51.81 | |
6159 | 177 | CA | 52.078 | 1 |
6242 | 90 | CA | 52.1 | 1 |
6317 | 27 | CA | 50.056 | 1 |
6356 | 83 | CA | 51.434 | |
6374 | 36 | CA | 51.52 | |
6444 | 125 | CA | 52.420 | |
6584 | 115 | CA | 51.707 | 1 |
6612 | 92 | CA | 51.4 | |
6903 | 18 | CA | 52.1270 | 1 |
6904 | 18 | CA | 52.510 | 1 |
7033 | 59 | CA | 51.224 | 1 |
7059 | 74 | CA | 51.796 | 1 |
7359 | 27 | CA | 52.467 | 1 |
7360 | 27 | CA | 52.481 | 1 |
7414 | 11 | CA | 52.550 | 1 |
10019 | 59 | CA | 51.390 | 1 |
10273 | 27 | CA | 52.526 | 1 |
11011 | 46 | CA | 49.932 | 1 |
11142 | 59 | CA | 51.943 | 1 |
11425 | 11 | CA | 52.508 | 1 |
15116 | 8 | CA | 24.402 | 1 |
15578 | 103 | CA | 52.091 | 1 |
15578 | 125 | CA | 52.441 | 1 |
15736 | 135 | CA | 51.752 | 1 |
15820 | 23 | CA | 50.335 | |
15912 | 71 | CA | 51.67 | 1 |
16002 | 99 | CA | 52.3700 | 1 |
16019 | 67 | CA | 52.257 | 1 |
16108 | 192 | CA | 51.974 | 1 |
16164 | 89 | CA | 52.124 | 1 |
16317 | 78 | CA | 52.060 | 1 |
16537 | 76 | CA | 45.74 | 1 |
16600 | 68 | CA | 48.7 | 1 |
16729 | 107 | CA | 51.655 | 1 |
16729 | 172 | CA | 44.728 | 1 |
16729 | 236 | CA | 51.658 | 1 |
16729 | 247 | CA | 45.355 | 1 |
16729 | 339 | CA | 45.716 | 1 |
16809 | 69 | CA | 51.67 | 1 |
16840 | 18 | CA | 51.947 | 1 |
16884 | 40 | CA | 52.2 | 1 |
16884 | 59 | CA | 50.4 | 1 |
16940 | 249 | CA | 51.67 | 1 |
16940 | 58 | CA | 51.94 | 1 |
16984 | 69 | CA | 52.477 | 1 |
17016 | 73 | CA | 52.28 | 1 |
17135 | 79 | CA | 51.514 | 1 |
17388 | 85 | CA | 52.437 | 1 |
17443 | 120 | CA | 52.529 | 1 |
17443 | 97 | CA | 50.642 | 1 |
17626 | 73 | CA | 45.5 | 1 |
17723 | 81 | CA | 51.600 | 1 |
17755 | 89 | CA | 52.4970 | 1 |
17799 | 72 | CA | 51.994 | 1 |
17806 | 50 | CA | 52.442 | 1 |
17914 | 60 | CA | 50.34 | 1 |
18081 | 67 | CA | 51.222 | 1 |
18388 | 72 | CA | 52.116 | 1 |
18389 | 72 | CA | 52.457 | 1 |
18509 | 105 | CA | 52.550 | 1 |
18708 | 105 | CA | 52.550 | 1 |
18951 | 30 | CA | 32.065 | 1 |
18951 | 32 | CA | 32.525 | 1 |
18951 | 5 | CA | 32.148 | 1 |
18958 | 1 | CA | 52.119 | 1 |
18969 | 103 | CA | 39.241 | 1 |
18969 | 38 | CA | 51.199 | 1 |
19063 | 14 | CA | 47.87 | |
19063 | 25 | CA | 46.488 | |
19063 | 35 | CA | 51.05 | |
19063 | 44 | CA | 48.423 | |
19063 | 57 | CA | 47.94 | |
19063 | 64 | CA | 46.695 | |
19230 | 66 | CA | 51.558 | 1 |
19458 | 102 | CA | 51.5343 | |
19560 | 250 | CA | 52.37 | 1 |
19716 | 4 | CA | 29.1086 | 1 |
19775 | 124 | CA | 51.743 | 1 |
19775 | 4 | CA | 52.565 | 1 |
19778 | 124 | CA | 52.023 | |
19792 | 60 | CA | 50.137 | |
19954 | 25 | CA | 52.534 | |
19991 | 83 | CA | 51.642 | 1 |
25040 | 8 | CA | 51.369 | 1 |
25043 | 7 | CA | 51.422 | 1 |
25342 | 111 | CA | 51.314 | 1 |
25342 | 84 | CA | 51.324 | 1 |
25379 | 120 | CA | 52.343 | 1 |
25379 | 121 | CA | 52.455 | 1 |
25379 | 132 | CA | 51.359 | 1 |
25379 | 188 | CA | 51.034 | 1 |
25379 | 41 | CA | 50.753 | 1 |
25379 | 61 | CA | 51.92 | 1 |
25379 | 64 | CA | 52.444 | 1 |
25379 | 74 | CA | 50.557 | 1 |
25567 | 111 | CA | 51.630 | |
25567 | 84 | CA | 51.937 | |
25760 | 129 | CA | 52.327 | |
25836 | 49 | CA | 51.081 | |
25930 | 8 | CA | 47.787 | 1 |
26552 | 115 | CA | 28.8873 | |
26552 | 116 | CA | 27.3943 | |
26552 | 129 | CA | 25.7983 | |
26552 | 149 | CA | 26.4843 | |
26552 | 155 | CA | 27.3683 | |
26552 | 156 | CA | 26.9893 | |
26552 | 157 | CA | 29.5513 | |
26552 | 170 | CA | 29.4833 | |
26552 | 84 | CA | 27.7453 | |
26552 | 91 | CA | 30.4683 | |
26593 | 49 | CA | 4.331 | 1 |
26756 | 155 | CA | 52.134 | |
26757 | 155 | CA | 52.256 | |
26792 | 4 | CA | 50.9 | 1 |
26792 | 82 | CA | 50.2 | 1 |
26793 | 61 | CA | 52.4 | 1 |
26793 | 79 | CA | 52.3 | 1 |
26818 | 94 | CA | 51.853 | 1 |
26819 | 94 | CA | 52.116 | 1 |
27078 | 124 | CA | 51.2 | 1 |
27078 | 75 | CA | 47.5 | 1 |
27191 | 102 | CA | 45.9881 | 1 |
27195 | 69 | CA | 51.5558 | |
27210 | 108 | CA | 51.70 | 1 |
27224 | 235 | CA | 52.54 | 1 |
27266 | 103 | CA | 52.322 | |
27285 | 100 | CA | 52.280 | 1 |
27425 | 105 | CA | 52.277 | 1 |
27466 | 82 | CA | 52.566 | 1 |
27469 | 235 | CA | 52.46 | 1 |
27470 | 235 | CA | 52.52 | 1 |
27548 | 52 | CA | 51.787 | 1 |
30375 | 125 | CA | 51.426 | |
30375 | 48 | CA | 51.429 | |
34022 | 104 | CA | 25.7983 | |
34022 | 124 | CA | 26.4843 | |
34022 | 130 | CA | 27.3683 | |
34022 | 131 | CA | 26.9893 | |
34022 | 132 | CA | 29.5513 | |
34022 | 145 | CA | 29.4833 | |
34022 | 59 | CA | 27.7453 | |
34022 | 66 | CA | 30.4683 | |
34022 | 90 | CA | 28.8873 | |
34022 | 91 | CA | 27.3943 | |
36185 | 53 | CA | 51.633 | |
36368 | 59 | CA | 52.168 | 1 |
50022 | 129 | CA | 52.495 | |
50022 | 146 | CA | 42.567 | |
50022 | 164 | CA | 52.225 | |
50022 | 187 | CA | 51.954 | |
50022 | 190 | CA | 50.389 | |
50022 | 38 | CA | 52.255 | |
50022 | 43 | CA | 43.289 | |
50022 | 66 | CA | 51.051 | |
50022 | 95 | CA | 42.627 | |
50023 | 5 | CA | 45.736 | |
50381 | 136 | CA | 52.511 | 1 |
50381 | 273 | CA | 52.017 | 1 |
50381 | 4 | CA | 52.060 | 1 |
50537 | 49 | CA | 52.536 | 1 |
50538 | 51 | CA | 52.468 | 1 |
51411 | 99 | CA | 52.39 | 1 |
51515 | 121 | CA | 52.41 | |
51896 | 21 | CA | 51.416 | 1 |
51992 | 103 | CA | 52.228 | 1 |
52077 | 59 | CA | 39.410 | 1 |
52087 | 2 | CA | 49.330 | 1 |
52152 | 50 | CA | 52.12585553 | 1 |
52153 | 50 | CA | 52.3829511 | 1 |
52158 | 114 | CA | 41.075 | 1 |
52158 | 187 | CA | 41.580 | 1 |