REMARK SPARTA+ Protein Chemical Shift Prediction Table REMARK REMARK All chemical shifts are reported in ppm: REMARK REMARK SS_SHIFT is the predicted secondary chemical shift. REMARK SHIFT is the predicted chemical shift. REMARK RC_SHIFT is the random coil chemical shift. REMARK HM_SHIFT is the ring current shift; a correction REMARK of 0.6 times this value is applied. REMARK EF_SHIFT is the adjustment for electric field effect, REMARK applied to proton shifts only. REMARK SIGMA is the estimated prediction error. REMARK REMARK Reference: REMARK Y. Shen and A. Bax: SPARTA+: a modest improvement in empirical NMR REMARK chemical shift prediction by means of an artificial neural network. REMARK J. Biomol. NMR 48, 13-22 (2010). DATA SOURCE 1ocz_1_W DATA FIRST_RESID 1 DATA SEQUENCE FENRVAEKQK LFQEDNGLPV HLKGGATDNI LYRVTMTLCL GGTLYSLYCL DATA SEQUENCE GWASFP VARS RESID RESNAME ATOMNAME SS_SHIFT SHIFT RC_SHIFT HM_SHIFT EF_SHIFT SIGMA FORMAT %4d %4s %4s %9.3f %9.3f %9.3f %9.3f %9.3f %9.3f 1 F HA 0.000 nan 4.527 nan 0.000 0.279 1 F C 0.000 175.804 175.800 0.007 0.000 0.967 1 F CA 0.000 58.004 58.000 0.006 0.000 1.383 1 F CB 0.000 39.004 39.000 0.007 0.000 1.145 2 E N 1.386 121.590 120.200 0.006 0.000 1.983 2 E HA 0.014 4.364 4.350 0.000 0.000 0.202 2 E C 0.112 176.746 176.600 0.056 0.000 0.944 2 E CA 1.101 57.486 56.400 -0.024 0.000 0.903 2 E CB -0.267 29.409 29.700 -0.040 0.000 0.843 2 E HN 0.602 nan 8.360 nan 0.000 0.542 3 N N -0.251 118.505 118.700 0.093 0.000 3.006 3 N HA -0.154 4.586 4.740 0.000 0.000 0.246 3 N C -0.831 174.708 175.510 0.048 0.000 1.128 3 N CA 0.556 53.649 53.050 0.072 0.000 0.697 3 N CB -0.683 37.841 38.487 0.062 0.000 1.057 3 N HN 0.457 nan 8.380 nan 0.000 0.557 4 R N -0.652 119.876 120.500 0.047 0.000 3.179 4 R HA 0.236 4.576 4.340 0.000 0.000 0.317 4 R C 1.316 177.647 176.300 0.052 0.000 1.331 4 R CA -0.063 56.059 56.100 0.037 0.000 1.184 4 R CB 0.450 30.763 30.300 0.022 0.000 1.408 4 R HN 0.177 nan 8.270 nan 0.000 0.598 5 V N 0.728 120.676 119.914 0.056 0.000 2.343 5 V HA -0.216 3.904 4.120 0.000 0.000 0.247 5 V C 2.261 178.393 176.094 0.064 0.000 1.051 5 V CA 2.275 64.613 62.300 0.063 0.000 1.036 5 V CB -0.248 31.606 31.823 0.052 0.000 0.654 5 V HN 0.581 nan 8.190 nan 0.000 0.451 6 A N -0.298 122.550 122.820 0.048 0.000 1.917 6 A HA -0.298 4.022 4.320 0.000 0.000 0.219 6 A C 2.031 179.641 177.584 0.042 0.000 1.182 6 A CA 2.271 54.332 52.037 0.041 0.000 0.633 6 A CB -0.702 18.315 19.000 0.029 0.000 0.819 6 A HN 0.750 nan 8.150 nan 0.000 0.448 7 E N -0.304 119.919 120.200 0.038 0.000 2.051 7 E HA -0.189 4.161 4.350 0.000 0.000 0.192 7 E C 1.986 178.612 176.600 0.044 0.000 0.991 7 E CA 1.231 57.648 56.400 0.027 0.000 0.799 7 E CB -0.132 29.579 29.700 0.019 0.000 0.748 7 E HN 0.401 nan 8.360 nan 0.000 0.449 8 K N 1.102 121.556 120.400 0.091 0.000 2.097 8 K HA -0.161 4.159 4.320 0.000 0.000 0.206 8 K C 2.086 178.841 176.600 0.258 0.000 1.049 8 K CA 1.170 57.570 56.287 0.188 0.000 0.933 8 K CB -0.396 32.246 32.500 0.237 0.000 0.717 8 K HN 0.273 nan 8.250 nan 0.000 0.442 9 Q N 0.874 120.775 119.800 0.169 0.000 1.975 9 Q HA -0.127 4.213 4.340 0.000 0.000 0.205 9 Q C 2.213 178.280 176.000 0.112 0.000 0.990 9 Q CA 1.224 57.118 55.803 0.152 0.000 0.845 9 Q CB -0.140 28.650 28.738 0.086 0.000 0.913 9 Q HN 0.111 nan 8.270 nan 0.000 0.420 10 K N 0.950 121.382 120.400 0.054 0.000 2.077 10 K HA -0.215 4.105 4.320 0.000 0.000 0.213 10 K C 2.075 178.662 176.600 -0.022 0.000 1.051 10 K CA 1.195 57.492 56.287 0.015 0.000 0.929 10 K CB -0.642 31.859 32.500 0.001 0.000 0.715 10 K HN 0.260 nan 8.250 nan 0.000 0.451 11 L N -0.267 120.916 121.223 -0.068 0.000 1.989 11 L HA -0.198 4.142 4.340 0.000 0.000 0.211 11 L C 2.186 178.871 176.870 -0.309 0.000 1.071 11 L CA 1.618 56.321 54.840 -0.228 0.000 0.749 11 L CB -0.268 41.572 42.059 -0.365 0.000 0.890 11 L HN 0.063 nan 8.230 nan 0.000 0.431 12 F N -0.343 119.605 119.950 -0.004 0.000 2.604 12 F HA -0.092 4.435 4.527 0.000 0.000 0.298 12 F C 2.457 178.253 175.800 -0.006 0.000 1.131 12 F CA 0.744 58.740 58.000 -0.006 0.000 1.457 12 F CB -0.199 38.800 39.000 -0.002 0.000 1.095 12 F HN 0.203 nan 8.300 nan 0.000 0.574 13 Q N -0.032 119.834 119.800 0.110 0.000 2.408 13 Q HA -0.042 4.298 4.340 0.000 0.000 0.205 13 Q C 0.638 176.652 176.000 0.024 0.000 0.919 13 Q CA -0.075 55.770 55.803 0.069 0.000 0.932 13 Q CB 0.100 28.873 28.738 0.058 0.000 1.058 13 Q HN 0.336 nan 8.270 nan 0.000 0.517 14 E N 2.014 122.208 120.200 -0.009 0.000 2.498 14 E HA -0.133 4.217 4.350 0.000 0.000 0.252 14 E C -0.810 175.779 176.600 -0.018 0.000 1.025 14 E CA -0.086 56.297 56.400 -0.028 0.000 0.938 14 E CB 0.377 30.038 29.700 -0.065 0.000 0.947 14 E HN 0.027 nan 8.360 nan 0.000 0.478 15 D N 3.869 124.262 120.400 -0.011 0.000 2.745 15 D HA -0.047 4.593 4.640 0.000 0.000 0.229 15 D C 0.384 176.675 176.300 -0.015 0.000 1.088 15 D CA -0.028 53.968 54.000 -0.007 0.000 1.054 15 D CB -0.326 40.472 40.800 -0.003 0.000 1.132 15 D HN 0.445 nan 8.370 nan 0.000 0.464 16 N N 0.924 119.611 118.700 -0.022 0.000 2.314 16 N HA 0.089 4.829 4.740 0.000 0.000 0.200 16 N C 1.525 177.020 175.510 -0.024 0.000 1.135 16 N CA 0.275 53.308 53.050 -0.029 0.000 0.835 16 N CB 0.294 38.755 38.487 -0.044 0.000 0.989 16 N HN 0.239 nan 8.380 nan 0.000 0.478 17 G N -0.328 108.463 108.800 -0.016 0.000 2.196 17 G HA2 -0.308 3.652 3.960 0.000 0.000 0.268 17 G HA3 -0.308 3.652 3.960 0.000 0.000 0.268 17 G C -0.121 174.767 174.900 -0.021 0.000 0.975 17 G CA 0.544 45.636 45.100 -0.013 0.000 0.648 17 G HN 0.385 nan 8.290 nan 0.000 0.538 18 L N 1.910 123.114 121.223 -0.032 0.000 2.453 18 L HA 0.411 4.751 4.340 0.000 0.000 0.261 18 L C -1.193 175.650 176.870 -0.045 0.000 1.179 18 L CA -1.708 53.098 54.840 -0.057 0.000 0.813 18 L CB 0.784 42.797 42.059 -0.075 0.000 1.110 18 L HN 0.041 nan 8.230 nan 0.000 0.466 19 P HA 0.037 nan 4.420 nan 0.000 0.286 19 P C 0.691 177.975 177.300 -0.027 0.000 1.261 19 P CA -0.385 62.700 63.100 -0.024 0.000 0.821 19 P CB 1.915 33.623 31.700 0.013 0.000 1.013 20 V N 2.871 122.829 119.914 0.073 0.000 2.363 20 V HA -0.278 3.842 4.120 0.000 0.000 0.254 20 V C 2.251 178.405 176.094 0.101 0.000 1.074 20 V CA 2.593 64.952 62.300 0.099 0.000 1.069 20 V CB -1.514 30.350 31.823 0.069 0.000 0.659 20 V HN 0.750 nan 8.190 nan 0.000 0.455 21 H N -1.365 117.700 119.070 -0.008 0.000 2.563 21 H HA 0.070 4.626 4.556 0.000 0.000 0.272 21 H C 1.429 176.745 175.328 -0.020 0.000 1.005 21 H CA 1.195 57.230 56.048 -0.022 0.000 1.171 21 H CB -0.158 29.562 29.762 -0.071 0.000 1.351 21 H HN 0.527 nan 8.280 nan 0.000 0.602 22 L N -0.651 120.378 121.223 -0.323 0.000 3.017 22 L HA 0.125 4.465 4.340 0.000 0.000 0.265 22 L C 2.114 178.932 176.870 -0.086 0.000 1.128 22 L CA -0.190 54.493 54.840 -0.262 0.000 0.984 22 L CB 0.200 41.995 42.059 -0.440 0.000 1.464 22 L HN -0.113 nan 8.230 nan 0.000 0.556 23 K N 1.227 121.619 120.400 -0.013 0.000 2.228 23 K HA -0.137 4.183 4.320 0.000 0.000 0.205 23 K C 1.817 178.396 176.600 -0.036 0.000 1.045 23 K CA 1.521 57.826 56.287 0.030 0.000 0.931 23 K CB -0.246 32.380 32.500 0.210 0.000 0.727 23 K HN 0.414 nan 8.250 nan 0.000 0.458 24 G N -0.058 108.834 108.800 0.154 0.000 2.572 24 G HA2 0.125 4.085 3.960 0.000 0.000 0.216 24 G HA3 0.125 4.085 3.960 0.000 0.000 0.216 24 G C 0.638 175.524 174.900 -0.023 0.000 1.133 24 G CA 0.802 45.961 45.100 0.099 0.000 0.791 24 G HN 0.558 nan 8.290 nan 0.000 0.538 25 G N -1.753 107.033 108.800 -0.022 0.000 2.302 25 G HA2 0.431 4.391 3.960 0.000 0.000 0.264 25 G HA3 0.431 4.391 3.960 0.000 0.000 0.264 25 G C 0.687 175.584 174.900 -0.005 0.000 1.335 25 G CA 0.256 45.340 45.100 -0.026 0.000 0.982 25 G HN 0.798 nan 8.290 nan 0.000 0.473 26 A N -1.048 121.773 122.820 0.002 0.000 1.930 26 A HA 0.241 4.561 4.320 0.000 0.000 0.215 26 A C 2.537 180.141 177.584 0.033 0.000 1.176 26 A CA 3.035 55.080 52.037 0.013 0.000 0.632 26 A CB -1.153 17.852 19.000 0.008 0.000 0.819 26 A HN 1.734 nan 8.150 nan 0.000 0.445 27 T N -0.773 113.803 114.554 0.036 0.000 2.833 27 T HA -0.149 4.201 4.350 0.000 0.000 0.269 27 T C 1.293 176.036 174.700 0.071 0.000 1.054 27 T CA 1.464 63.594 62.100 0.049 0.000 1.135 27 T CB -0.496 68.400 68.868 0.047 0.000 0.869 27 T HN 0.348 nan 8.240 nan 0.000 0.466 28 D N 1.357 121.800 120.400 0.073 0.000 2.149 28 D HA -0.083 4.557 4.640 0.000 0.000 0.198 28 D C 2.119 178.496 176.300 0.128 0.000 0.990 28 D CA 1.007 55.062 54.000 0.093 0.000 0.839 28 D CB -0.517 40.322 40.800 0.064 0.000 0.948 28 D HN 0.414 nan 8.370 nan 0.000 0.460 29 N N -0.268 118.495 118.700 0.105 0.000 2.171 29 N HA -0.074 4.666 4.740 0.000 0.000 0.184 29 N C 1.835 177.445 175.510 0.166 0.000 1.021 29 N CA 0.932 54.077 53.050 0.158 0.000 0.854 29 N CB -0.017 38.528 38.487 0.096 0.000 0.994 29 N HN 0.284 nan 8.380 nan 0.000 0.426 30 I N -1.137 119.493 120.570 0.100 0.000 2.179 30 I HA -0.166 4.004 4.170 0.000 0.000 0.242 30 I C 1.949 178.111 176.117 0.074 0.000 1.088 30 I CA 1.334 62.676 61.300 0.069 0.000 1.357 30 I CB -0.589 37.438 38.000 0.045 0.000 1.051 30 I HN 0.089 nan 8.210 nan 0.000 0.409 31 L N -0.516 120.766 121.223 0.097 0.000 2.012 31 L HA -0.247 4.093 4.340 0.000 0.000 0.210 31 L C 2.823 179.772 176.870 0.131 0.000 1.073 31 L CA 2.122 57.022 54.840 0.099 0.000 0.748 31 L CB -0.778 41.347 42.059 0.110 0.000 0.891 31 L HN 0.432 nan 8.230 nan 0.000 0.431 32 Y N 1.203 121.540 120.300 0.062 0.000 2.070 32 Y HA -0.283 4.267 4.550 0.000 0.000 0.280 32 Y C 2.762 178.695 175.900 0.055 0.000 1.148 32 Y CA 1.614 59.761 58.100 0.078 0.000 1.125 32 Y CB -0.427 38.104 38.460 0.118 0.000 0.975 32 Y HN 0.035 nan 8.280 nan 0.000 0.492 33 R N -0.529 119.870 120.500 -0.168 0.000 2.120 33 R HA -0.124 4.216 4.340 0.000 0.000 0.234 33 R C 2.189 178.387 176.300 -0.170 0.000 1.123 33 R CA 1.532 57.474 56.100 -0.264 0.000 0.975 33 R CB -0.798 29.453 30.300 -0.082 0.000 0.866 33 R HN 0.324 nan 8.270 nan 0.000 0.446 34 V N 0.592 120.459 119.914 -0.078 0.000 2.270 34 V HA -0.216 3.904 4.120 0.000 0.000 0.245 34 V C 2.262 178.322 176.094 -0.057 0.000 1.043 34 V CA 2.179 64.450 62.300 -0.048 0.000 1.014 34 V CB -0.656 31.161 31.823 -0.010 0.000 0.645 34 V HN 0.333 nan 8.190 nan 0.000 0.447 35 T N -0.062 114.465 114.554 -0.045 0.000 2.635 35 T HA -0.243 4.107 4.350 0.000 0.000 0.267 35 T C 1.982 176.640 174.700 -0.069 0.000 1.040 35 T CA 1.748 63.830 62.100 -0.030 0.000 1.156 35 T CB -0.329 68.550 68.868 0.018 0.000 0.863 35 T HN 0.141 nan 8.240 nan 0.000 0.430 36 M N 0.988 120.490 119.600 -0.164 0.000 2.202 36 M HA -0.081 4.399 4.480 0.000 0.000 0.262 36 M C 2.424 178.654 176.300 -0.117 0.000 1.063 36 M CA 1.473 56.663 55.300 -0.183 0.000 1.097 36 M CB -1.512 30.850 32.600 -0.398 0.000 1.382 36 M HN 0.270 nan 8.290 nan 0.000 0.413 37 T N 1.122 115.610 114.554 -0.111 0.000 2.698 37 T HA -0.051 4.299 4.350 0.000 0.000 0.260 37 T C 1.964 176.641 174.700 -0.038 0.000 1.044 37 T CA 1.045 63.103 62.100 -0.068 0.000 1.149 37 T CB -0.290 68.539 68.868 -0.065 0.000 0.864 37 T HN 0.286 nan 8.240 nan 0.000 0.419 38 L N 0.661 121.866 121.223 -0.030 0.000 2.042 38 L HA -0.159 4.181 4.340 0.000 0.000 0.210 38 L C 2.941 179.814 176.870 0.005 0.000 1.076 38 L CA 1.047 55.881 54.840 -0.009 0.000 0.749 38 L CB -0.881 41.176 42.059 -0.004 0.000 0.893 38 L HN 0.389 nan 8.230 nan 0.000 0.432 39 C N -0.268 119.030 119.300 -0.003 0.000 2.413 39 C HA -0.169 4.291 4.460 0.000 0.000 0.277 39 C C 2.754 177.753 174.990 0.016 0.000 1.228 39 C CA 0.683 59.706 59.018 0.008 0.000 1.731 39 C CB -0.877 26.863 27.740 0.001 0.000 2.042 39 C HN 0.434 nan 8.230 nan 0.000 0.468 40 L N 0.786 122.012 121.223 0.004 0.000 1.994 40 L HA -0.062 4.278 4.340 0.000 0.000 0.208 40 L C 2.870 179.758 176.870 0.029 0.000 1.071 40 L CA 1.964 56.812 54.840 0.013 0.000 0.745 40 L CB -1.548 40.510 42.059 -0.002 0.000 0.892 40 L HN 0.519 nan 8.230 nan 0.000 0.431 41 G N -0.015 108.798 108.800 0.021 0.000 2.459 41 G HA2 -0.226 3.734 3.960 0.000 0.000 0.217 41 G HA3 -0.226 3.734 3.960 0.000 0.000 0.217 41 G C 1.599 176.548 174.900 0.082 0.000 1.183 41 G CA 0.851 45.970 45.100 0.032 0.000 0.776 41 G HN 0.488 nan 8.290 nan 0.000 0.552 42 G N 0.222 109.071 108.800 0.081 0.000 2.505 42 G HA2 -0.234 3.726 3.960 0.000 0.000 0.220 42 G HA3 -0.234 3.726 3.960 0.000 0.000 0.220 42 G C 1.869 176.843 174.900 0.124 0.000 1.145 42 G CA 1.921 47.096 45.100 0.125 0.000 0.761 42 G HN 0.412 nan 8.290 nan 0.000 0.571 43 T N 1.353 115.956 114.554 0.082 0.000 2.746 43 T HA -0.053 4.297 4.350 0.000 0.000 0.267 43 T C 2.432 177.189 174.700 0.096 0.000 1.039 43 T CA 1.098 63.239 62.100 0.069 0.000 1.142 43 T CB -0.222 68.675 68.868 0.049 0.000 0.866 43 T HN 0.184 nan 8.240 nan 0.000 0.444 44 L N -0.347 120.944 121.223 0.112 0.000 2.017 44 L HA -0.111 4.229 4.340 0.000 0.000 0.208 44 L C 2.466 179.478 176.870 0.237 0.000 1.073 44 L CA 1.463 56.387 54.840 0.141 0.000 0.745 44 L CB -0.665 41.458 42.059 0.108 0.000 0.894 44 L HN 0.225 nan 8.230 nan 0.000 0.432 45 Y N 1.392 121.736 120.300 0.074 0.000 2.128 45 Y HA -0.315 4.235 4.550 0.000 0.000 0.284 45 Y C 3.016 179.010 175.900 0.158 0.000 1.154 45 Y CA 1.322 59.484 58.100 0.102 0.000 1.149 45 Y CB -0.759 37.729 38.460 0.047 0.000 0.976 45 Y HN 0.316 nan 8.280 nan 0.000 0.505 46 S N -0.471 115.237 115.700 0.013 0.000 2.382 46 S HA -0.170 4.300 4.470 0.000 0.000 0.228 46 S C 2.029 176.634 174.600 0.007 0.000 1.027 46 S CA 1.320 59.467 58.200 -0.088 0.000 0.991 46 S CB -0.919 62.257 63.200 -0.039 0.000 0.823 46 S HN 0.289 nan 8.310 nan 0.000 0.469 47 L N 0.706 121.978 121.223 0.082 0.000 2.046 47 L HA 0.048 4.388 4.340 0.000 0.000 0.208 47 L C 2.410 179.353 176.870 0.121 0.000 1.077 47 L CA 1.656 56.551 54.840 0.092 0.000 0.747 47 L CB -1.610 40.511 42.059 0.105 0.000 0.896 47 L HN 0.526 nan 8.230 nan 0.000 0.432 48 Y N -0.821 119.542 120.300 0.105 0.000 2.181 48 Y HA -0.296 4.254 4.550 0.000 0.000 0.288 48 Y C 2.615 178.620 175.900 0.175 0.000 1.146 48 Y CA 1.756 59.948 58.100 0.153 0.000 1.164 48 Y CB -0.555 38.030 38.460 0.208 0.000 0.982 48 Y HN 0.205 nan 8.280 nan 0.000 0.515 49 C N 0.572 119.866 119.300 -0.010 0.000 2.473 49 C HA -0.162 4.298 4.460 0.000 0.000 0.279 49 C C 2.689 177.729 174.990 0.083 0.000 1.250 49 C CA 1.185 60.193 59.018 -0.017 0.000 1.713 49 C CB -1.504 26.154 27.740 -0.137 0.000 2.066 49 C HN 0.600 nan 8.230 nan 0.000 0.474 50 L N 0.947 122.183 121.223 0.022 0.000 2.551 50 L HA -0.067 4.273 4.340 0.000 0.000 0.230 50 L C 2.391 179.257 176.870 -0.006 0.000 1.163 50 L CA 1.271 56.118 54.840 0.011 0.000 0.826 50 L CB -0.927 41.128 42.059 -0.007 0.000 0.943 50 L HN 0.627 nan 8.230 nan 0.000 0.452 51 G N -1.012 107.795 108.800 0.012 0.000 2.641 51 G HA2 -0.217 3.743 3.960 0.000 0.000 0.207 51 G HA3 -0.217 3.743 3.960 0.000 0.000 0.207 51 G C 1.186 176.161 174.900 0.126 0.000 1.137 51 G CA 0.092 45.230 45.100 0.064 0.000 0.824 51 G HN 0.498 nan 8.290 nan 0.000 0.547 52 W N 2.172 123.356 121.300 -0.194 0.000 2.374 52 W HA 0.165 4.825 4.660 0.000 0.000 0.288 52 W C 2.047 178.576 176.519 0.015 0.000 1.218 52 W CA 1.671 58.920 57.345 -0.160 0.000 1.245 52 W CB 0.165 29.362 29.460 -0.439 0.000 1.126 52 W HN 0.185 nan 8.180 nan 0.000 0.545 53 A N -0.316 122.296 122.820 -0.347 0.000 2.278 53 A HA 0.113 4.433 4.320 0.000 0.000 0.212 53 A C 1.793 179.164 177.584 -0.355 0.000 1.213 53 A CA 1.009 52.695 52.037 -0.585 0.000 0.840 53 A CB -0.785 18.101 19.000 -0.191 0.000 0.866 53 A HN 0.257 nan 8.150 nan 0.000 0.489 54 S N -1.056 114.479 115.700 -0.275 0.000 2.503 54 S HA 0.303 4.773 4.470 0.000 0.000 0.217 54 S C 0.025 174.195 174.600 -0.716 0.000 0.999 54 S CA 0.004 57.933 58.200 -0.452 0.000 0.914 54 S CB -0.235 62.659 63.200 -0.509 0.000 0.782 54 S HN 0.343 nan 8.310 nan 0.000 0.520 55 F N 1.797 121.586 119.950 -0.268 0.000 2.507 55 F HA 0.584 5.111 4.527 0.000 0.000 0.327 55 F C -1.518 174.127 175.800 -0.258 0.000 1.068 55 F CA -2.453 55.416 58.000 -0.219 0.000 0.965 55 F CB -0.458 38.429 39.000 -0.188 0.000 1.192 55 F HN -0.022 nan 8.300 nan 0.000 0.476 56 P HA 0.000 nan 4.420 nan 0.000 0.000 56 P CA 0.000 63.062 63.100 -0.064 0.000 0.000 56 P CB 0.000 31.686 31.700 -0.024 0.000 0.000