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 2wrr_1_5 DATA FIRST_RESID 2 DATA SEQUENCE AKHPVPKKKT SKARRDARRS HHALTPPTLV PCPECKAMKP PHTVCPECGY DATA SEQUENCE YAGRKVLEV 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 2 A HA 0.000 nan 4.320 nan 0.000 0.244 2 A C 0.000 177.574 177.584 -0.017 0.000 1.274 2 A CA 0.000 52.031 52.037 -0.009 0.000 0.836 2 A CB 0.000 18.991 19.000 -0.014 0.000 0.831 3 K N 0.428 120.808 120.400 -0.033 0.000 2.343 3 K HA 0.343 4.663 4.320 0.000 0.000 0.250 3 K C 1.104 177.699 176.600 -0.009 0.000 1.087 3 K CA 0.707 56.949 56.287 -0.076 0.000 0.853 3 K CB -0.322 32.125 32.500 -0.089 0.000 1.133 3 K HN 0.520 nan 8.250 nan 0.000 0.509 4 H N -0.030 119.041 119.070 0.001 0.000 2.355 4 H HA -0.089 4.467 4.556 0.000 0.000 0.293 4 H C -1.219 174.110 175.328 0.002 0.000 1.060 4 H CA 0.809 56.857 56.048 0.001 0.000 1.167 4 H CB -1.103 28.660 29.762 0.001 0.000 1.376 4 H HN 0.391 nan 8.280 nan 0.000 0.549 5 P HA 0.035 nan 4.420 nan 0.000 0.260 5 P C -1.397 175.930 177.300 0.046 0.000 1.207 5 P CA 0.641 63.785 63.100 0.074 0.000 0.780 5 P CB 0.676 32.413 31.700 0.061 0.000 0.789 6 V N 5.914 125.850 119.914 0.037 0.000 2.737 6 V HA 0.360 4.480 4.120 0.000 0.000 0.298 6 V C -2.255 173.850 176.094 0.019 0.000 1.163 6 V CA -1.716 60.599 62.300 0.024 0.000 0.925 6 V CB 1.794 33.631 31.823 0.023 0.000 1.037 6 V HN 0.489 nan 8.190 nan 0.000 0.433 7 P HA 0.124 nan 4.420 nan 0.000 0.269 7 P C -0.247 177.058 177.300 0.008 0.000 1.211 7 P CA -0.072 63.035 63.100 0.010 0.000 0.781 7 P CB 0.854 32.558 31.700 0.008 0.000 0.877 8 K N -0.066 120.338 120.400 0.006 0.000 2.373 8 K HA 0.110 4.430 4.320 0.000 0.000 0.200 8 K C 0.018 176.619 176.600 0.003 0.000 1.054 8 K CA 0.063 56.353 56.287 0.005 0.000 1.065 8 K CB 0.356 32.859 32.500 0.004 0.000 0.886 8 K HN 0.203 nan 8.250 nan 0.000 0.546 9 K N 0.842 121.243 120.400 0.002 0.000 2.546 9 K HA 0.131 4.451 4.320 0.000 0.000 0.264 9 K C -1.586 175.013 176.600 -0.001 0.000 0.937 9 K CA -0.681 55.606 56.287 -0.000 0.000 0.833 9 K CB 1.790 34.290 32.500 -0.001 0.000 1.378 9 K HN -0.071 nan 8.250 nan 0.000 0.432 10 K N 2.306 122.705 120.400 -0.003 0.000 2.237 10 K HA 0.047 4.367 4.320 0.000 0.000 0.283 10 K C -0.291 176.305 176.600 -0.007 0.000 1.080 10 K CA 0.088 56.372 56.287 -0.004 0.000 0.965 10 K CB -0.131 32.366 32.500 -0.005 0.000 1.098 10 K HN 0.608 nan 8.250 nan 0.000 0.434 11 T N 1.859 116.409 114.554 -0.007 0.000 2.642 11 T HA -0.070 4.280 4.350 0.000 0.000 0.258 11 T C 0.387 175.078 174.700 -0.014 0.000 1.022 11 T CA -0.133 61.961 62.100 -0.010 0.000 1.266 11 T CB -0.501 68.360 68.868 -0.011 0.000 0.987 11 T HN 0.575 nan 8.240 nan 0.000 0.518 12 S N 3.066 118.757 115.700 -0.014 0.000 2.599 12 S HA -0.023 4.447 4.470 0.000 0.000 0.303 12 S C 1.307 175.894 174.600 -0.021 0.000 1.267 12 S CA -0.469 57.721 58.200 -0.016 0.000 1.055 12 S CB 0.414 63.606 63.200 -0.014 0.000 0.790 12 S HN 0.784 nan 8.310 nan 0.000 0.500 13 K N 2.412 122.799 120.400 -0.021 0.000 2.242 13 K HA -0.258 4.062 4.320 0.000 0.000 0.206 13 K C 2.237 178.818 176.600 -0.031 0.000 1.045 13 K CA 1.560 57.831 56.287 -0.027 0.000 0.930 13 K CB -0.711 31.775 32.500 -0.023 0.000 0.726 13 K HN 0.756 nan 8.250 nan 0.000 0.462 14 A N 1.570 124.374 122.820 -0.026 0.000 1.823 14 A HA -0.174 4.146 4.320 0.000 0.000 0.214 14 A C 2.022 179.586 177.584 -0.034 0.000 1.227 14 A CA 1.437 53.458 52.037 -0.028 0.000 0.616 14 A CB -0.655 18.333 19.000 -0.021 0.000 0.874 14 A HN 0.238 nan 8.150 nan 0.000 0.455 15 R N -0.277 120.206 120.500 -0.029 0.000 2.303 15 R HA -0.122 4.218 4.340 0.000 0.000 0.225 15 R C 2.255 178.530 176.300 -0.042 0.000 1.114 15 R CA 1.226 57.307 56.100 -0.031 0.000 1.007 15 R CB -0.240 30.047 30.300 -0.021 0.000 0.861 15 R HN 0.617 nan 8.270 nan 0.000 0.471 16 R N 0.319 120.793 120.500 -0.045 0.000 2.062 16 R HA -0.119 4.221 4.340 0.000 0.000 0.231 16 R C 1.119 177.367 176.300 -0.087 0.000 1.136 16 R CA 1.963 58.029 56.100 -0.057 0.000 0.948 16 R CB -0.096 30.175 30.300 -0.049 0.000 0.845 16 R HN 0.199 nan 8.270 nan 0.000 0.430 17 D N 0.643 120.992 120.400 -0.084 0.000 2.178 17 D HA -0.119 4.521 4.640 0.000 0.000 0.201 17 D C 1.778 178.003 176.300 -0.124 0.000 0.980 17 D CA 1.288 55.223 54.000 -0.108 0.000 0.842 17 D CB -0.291 40.461 40.800 -0.079 0.000 0.948 17 D HN 0.410 nan 8.370 nan 0.000 0.472 18 A N 1.398 124.161 122.820 -0.095 0.000 1.903 18 A HA -0.283 4.037 4.320 0.000 0.000 0.219 18 A C 2.211 179.712 177.584 -0.139 0.000 1.191 18 A CA 2.034 54.011 52.037 -0.100 0.000 0.638 18 A CB -0.644 18.318 19.000 -0.063 0.000 0.823 18 A HN 0.178 nan 8.150 nan 0.000 0.451 19 R N -0.165 120.265 120.500 -0.116 0.000 2.070 19 R HA -0.062 4.278 4.340 0.000 0.000 0.233 19 R C 0.631 176.822 176.300 -0.181 0.000 1.137 19 R CA 1.082 57.124 56.100 -0.097 0.000 0.945 19 R CB -0.203 30.067 30.300 -0.050 0.000 0.845 19 R HN 0.449 nan 8.270 nan 0.000 0.430 20 R N 1.066 121.371 120.500 -0.325 0.000 3.641 20 R HA -0.005 4.335 4.340 0.000 0.000 0.189 20 R C 0.698 176.815 176.300 -0.305 0.000 1.706 20 R CA 0.234 55.952 56.100 -0.637 0.000 1.311 20 R CB 0.221 30.219 30.300 -0.504 0.000 1.330 20 R HN 0.400 nan 8.270 nan 0.000 0.727 21 S N -0.872 114.714 115.700 -0.190 0.000 3.186 21 S HA -0.002 4.468 4.470 0.000 0.000 0.253 21 S C 1.213 175.775 174.600 -0.064 0.000 1.071 21 S CA -0.489 57.597 58.200 -0.190 0.000 0.796 21 S CB 0.062 63.035 63.200 -0.379 0.000 0.818 21 S HN 0.490 nan 8.310 nan 0.000 0.498 22 H N 1.098 120.267 119.070 0.166 0.000 2.553 22 H HA 0.243 4.799 4.556 0.000 0.000 0.269 22 H C 0.268 175.667 175.328 0.117 0.000 1.011 22 H CA 0.623 56.737 56.048 0.111 0.000 1.150 22 H CB -0.572 29.230 29.762 0.066 0.000 1.339 22 H HN 0.538 nan 8.280 nan 0.000 0.604 23 H N 0.477 119.578 119.070 0.051 0.000 2.612 23 H HA 0.224 4.780 4.556 0.000 0.000 0.285 23 H C 1.523 176.867 175.328 0.026 0.000 1.066 23 H CA 0.311 56.378 56.048 0.032 0.000 1.180 23 H CB -0.117 29.649 29.762 0.006 0.000 1.312 23 H HN 0.413 nan 8.280 nan 0.000 0.606 24 A N 0.281 123.177 122.820 0.125 0.000 2.918 24 A HA 0.288 4.608 4.320 0.000 0.000 0.167 24 A C 0.131 177.745 177.584 0.050 0.000 1.069 24 A CA 0.595 52.678 52.037 0.077 0.000 0.981 24 A CB 0.041 19.081 19.000 0.067 0.000 0.875 24 A HN 0.384 nan 8.150 nan 0.000 0.559 25 L N -2.873 118.369 121.223 0.033 0.000 3.976 25 L HA 0.129 4.469 4.340 0.000 0.000 0.253 25 L C -0.663 176.214 176.870 0.011 0.000 1.011 25 L CA -0.263 54.587 54.840 0.017 0.000 1.069 25 L CB 1.542 43.611 42.059 0.017 0.000 1.791 25 L HN 0.614 nan 8.230 nan 0.000 0.481 26 T N 3.706 118.261 114.554 0.003 0.000 2.738 26 T HA 0.429 4.779 4.350 0.000 0.000 0.294 26 T C -2.236 172.463 174.700 -0.001 0.000 0.914 26 T CA -0.897 61.203 62.100 -0.000 0.000 1.052 26 T CB 0.247 69.110 68.868 -0.008 0.000 0.897 26 T HN 0.193 nan 8.240 nan 0.000 0.522 27 P HA 0.156 nan 4.420 nan 0.000 0.261 27 P C -2.295 175.004 177.300 -0.002 0.000 1.183 27 P CA -0.918 62.183 63.100 0.002 0.000 0.761 27 P CB 0.006 31.709 31.700 0.004 0.000 0.785 28 P HA -0.061 nan 4.420 nan 0.000 0.256 28 P C -0.222 177.075 177.300 -0.005 0.000 1.173 28 P CA 0.273 63.369 63.100 -0.006 0.000 0.768 28 P CB -0.006 31.691 31.700 -0.004 0.000 0.758 29 T N 2.814 117.362 114.554 -0.010 0.000 3.185 29 T HA 0.418 4.768 4.350 0.000 0.000 0.287 29 T C 0.364 175.060 174.700 -0.007 0.000 1.051 29 T CA -0.588 61.507 62.100 -0.009 0.000 1.051 29 T CB -0.662 68.196 68.868 -0.016 0.000 1.034 29 T HN 0.214 nan 8.240 nan 0.000 0.685 30 L N 3.372 124.596 121.223 0.003 0.000 2.325 30 L HA 0.824 5.164 4.340 0.000 0.000 0.278 30 L C 0.110 176.992 176.870 0.020 0.000 1.023 30 L CA -1.493 53.354 54.840 0.011 0.000 0.811 30 L CB 1.748 43.814 42.059 0.012 0.000 1.249 30 L HN 0.500 nan 8.230 nan 0.000 0.431 31 V N -0.060 119.873 119.914 0.032 0.000 2.876 31 V HA 0.589 4.709 4.120 0.000 0.000 0.312 31 V C -2.678 173.444 176.094 0.047 0.000 1.085 31 V CA -2.773 59.551 62.300 0.040 0.000 0.945 31 V CB 1.601 33.456 31.823 0.053 0.000 1.017 31 V HN 0.507 nan 8.190 nan 0.000 0.428 32 P HA 0.069 nan 4.420 nan 0.000 0.257 32 P C -0.126 177.204 177.300 0.050 0.000 1.189 32 P CA 0.266 63.390 63.100 0.039 0.000 0.780 32 P CB -0.138 31.580 31.700 0.030 0.000 0.772 33 C N 8.000 127.333 119.300 0.055 0.000 2.482 33 C HA 0.327 4.787 4.460 0.000 0.000 0.378 33 C C -1.889 173.132 174.990 0.051 0.000 1.284 33 C CA -2.093 56.965 59.018 0.067 0.000 1.826 33 C CB -0.358 27.429 27.740 0.078 0.000 2.473 33 C HN 0.472 nan 8.230 nan 0.000 0.562 34 P HA 0.307 nan 4.420 nan 0.000 0.256 34 P C -0.006 177.314 177.300 0.034 0.000 1.689 34 P CA 0.804 63.922 63.100 0.031 0.000 1.124 34 P CB 0.563 32.273 31.700 0.017 0.000 1.766 35 E N -0.206 120.014 120.200 0.034 0.000 1.119 35 E HA 0.001 4.351 4.350 0.000 0.000 0.202 35 E C -0.051 176.569 176.600 0.034 0.000 0.912 35 E CA 0.323 56.744 56.400 0.036 0.000 0.851 35 E CB -0.616 29.115 29.700 0.052 0.000 4.846 35 E HN 0.629 nan 8.360 nan 0.000 0.582 36 C N 0.778 120.099 119.300 0.035 0.000 2.898 36 C HA 0.710 5.170 4.460 0.000 0.000 0.304 36 C C 0.774 175.780 174.990 0.027 0.000 1.237 36 C CA -0.733 58.303 59.018 0.031 0.000 1.529 36 C CB 1.570 29.331 27.740 0.035 0.000 2.021 36 C HN 0.255 nan 8.230 nan 0.000 0.474 37 K N 1.075 121.488 120.400 0.022 0.000 2.790 37 K HA 0.546 4.866 4.320 0.000 0.000 0.229 37 K C 0.282 176.894 176.600 0.020 0.000 1.040 37 K CA 0.349 56.647 56.287 0.019 0.000 1.211 37 K CB -0.226 32.283 32.500 0.015 0.000 1.002 37 K HN 0.884 nan 8.250 nan 0.000 0.479 38 A N 1.087 123.922 122.820 0.025 0.000 2.299 38 A HA 0.712 5.032 4.320 0.000 0.000 0.332 38 A C -0.621 176.980 177.584 0.029 0.000 1.131 38 A CA -0.979 51.073 52.037 0.025 0.000 0.844 38 A CB 0.738 19.754 19.000 0.027 0.000 1.251 38 A HN 0.291 nan 8.150 nan 0.000 0.486 39 M N 1.779 121.394 119.600 0.026 0.000 2.125 39 M HA 0.361 4.841 4.480 0.000 0.000 0.321 39 M C -0.320 175.997 176.300 0.027 0.000 0.983 39 M CA -0.262 55.054 55.300 0.027 0.000 0.934 39 M CB 0.840 33.452 32.600 0.020 0.000 1.542 39 M HN 0.867 nan 8.290 nan 0.000 0.424 40 K N 3.707 124.129 120.400 0.036 0.000 2.433 40 K HA 0.888 5.208 4.320 0.000 0.000 0.252 40 K C -3.072 173.550 176.600 0.037 0.000 1.015 40 K CA -1.646 54.662 56.287 0.035 0.000 0.860 40 K CB 2.371 34.898 32.500 0.046 0.000 1.359 40 K HN 0.203 nan 8.250 nan 0.000 0.452 41 P HA 0.240 nan 4.420 nan 0.000 0.276 41 P C -2.610 174.714 177.300 0.040 0.000 1.244 41 P CA -1.881 61.228 63.100 0.015 0.000 0.801 41 P CB -0.081 31.613 31.700 -0.009 0.000 1.006 42 P HA -0.053 nan 4.420 nan 0.000 0.260 42 P C -0.006 177.363 177.300 0.116 0.000 1.185 42 P CA 0.986 64.129 63.100 0.072 0.000 0.763 42 P CB -0.801 30.846 31.700 -0.088 0.000 0.776 43 H N -1.505 117.618 119.070 0.088 0.000 3.636 43 H HA -0.153 4.403 4.556 0.000 0.000 0.179 43 H C 0.445 175.780 175.328 0.013 0.000 0.968 43 H CA 0.280 56.389 56.048 0.100 0.000 1.220 43 H CB -1.929 27.866 29.762 0.055 0.000 1.023 43 H HN 0.407 nan 8.280 nan 0.000 0.366 44 T N 0.649 115.275 114.554 0.119 0.000 2.681 44 T HA 0.354 4.704 4.350 0.000 0.000 0.333 44 T C 1.105 175.726 174.700 -0.131 0.000 1.049 44 T CA 0.395 62.486 62.100 -0.016 0.000 1.002 44 T CB 1.508 70.380 68.868 0.007 0.000 1.161 44 T HN 0.138 nan 8.240 nan 0.000 0.519 45 V N 0.539 120.362 119.914 -0.151 0.000 3.829 45 V HA 0.193 4.313 4.120 0.000 0.000 0.409 45 V C 0.285 176.334 176.094 -0.074 0.000 1.319 45 V CA -1.200 60.990 62.300 -0.185 0.000 1.906 45 V CB -0.353 31.222 31.823 -0.414 0.000 0.812 45 V HN 1.218 nan 8.190 nan 0.000 0.520 46 C N 0.794 120.084 119.300 -0.017 0.000 2.520 46 C HA 0.624 5.084 4.460 0.000 0.000 0.376 46 C C -0.873 174.120 174.990 0.005 0.000 1.268 46 C CA -1.792 57.221 59.018 -0.008 0.000 2.414 46 C CB 1.349 29.090 27.740 0.001 0.000 2.521 46 C HN 0.554 nan 8.230 nan 0.000 0.618 47 P HA 0.086 nan 4.420 nan 0.000 0.271 47 P C -0.112 177.195 177.300 0.012 0.000 1.601 47 P CA 1.085 64.188 63.100 0.005 0.000 0.856 47 P CB -0.364 31.335 31.700 -0.000 0.000 1.820 48 E N 0.074 120.286 120.200 0.020 0.000 4.044 48 E HA 0.188 4.538 4.350 0.000 0.000 0.216 48 E C 0.819 177.439 176.600 0.033 0.000 1.104 48 E CA -0.193 56.221 56.400 0.023 0.000 1.383 48 E CB -0.113 29.602 29.700 0.024 0.000 1.195 48 E HN 0.485 nan 8.360 nan 0.000 0.442 49 C N -2.674 116.645 119.300 0.032 0.000 5.885 49 C HA 0.009 4.469 4.460 0.000 0.000 0.328 49 C C 1.209 176.227 174.990 0.047 0.000 2.433 49 C CA 0.481 59.523 59.018 0.040 0.000 2.197 49 C CB -1.345 26.425 27.740 0.050 0.000 3.236 49 C HN 0.800 nan 8.230 nan 0.000 0.260 50 G N 0.363 109.204 108.800 0.068 0.000 2.249 50 G HA2 0.459 4.419 3.960 0.000 0.000 0.089 50 G HA3 0.459 4.419 3.960 0.000 0.000 0.089 50 G C -1.436 173.571 174.900 0.178 0.000 1.206 50 G CA 0.574 45.721 45.100 0.079 0.000 1.190 50 G HN 1.990 nan 8.290 nan 0.000 0.454 51 Y N 0.399 120.660 120.300 -0.065 0.000 2.581 51 Y HA 0.624 5.174 4.550 0.000 0.000 0.345 51 Y C -0.256 175.575 175.900 -0.115 0.000 1.036 51 Y CA -1.635 56.376 58.100 -0.148 0.000 1.042 51 Y CB 1.447 39.749 38.460 -0.263 0.000 1.289 51 Y HN 0.777 nan 8.280 nan 0.000 0.471 52 Y N 1.426 121.694 120.300 -0.053 0.000 2.677 52 Y HA 0.400 4.950 4.550 0.000 0.000 0.335 52 Y C 0.731 176.638 175.900 0.011 0.000 1.162 52 Y CA -0.702 57.367 58.100 -0.053 0.000 1.483 52 Y CB -0.448 37.932 38.460 -0.133 0.000 1.209 52 Y HN 0.811 nan 8.280 nan 0.000 0.528 53 A N 2.362 125.270 122.820 0.146 0.000 2.860 53 A HA -0.143 4.177 4.320 0.000 0.000 0.267 53 A C 0.723 178.340 177.584 0.054 0.000 1.421 53 A CA 0.884 52.984 52.037 0.105 0.000 0.831 53 A CB -1.990 17.103 19.000 0.155 0.000 1.041 53 A HN 1.786 nan 8.150 nan 0.000 0.623 54 G N -0.640 108.191 108.800 0.051 0.000 2.347 54 G HA2 0.554 4.514 3.960 0.000 0.000 0.314 54 G HA3 0.554 4.514 3.960 0.000 0.000 0.314 54 G C -0.034 174.882 174.900 0.025 0.000 1.126 54 G CA -0.180 44.952 45.100 0.052 0.000 0.929 54 G HN 0.932 nan 8.290 nan 0.000 0.441 55 R N 2.037 122.537 120.500 0.001 0.000 2.474 55 R HA -0.049 4.291 4.340 0.000 0.000 0.290 55 R C 0.105 176.401 176.300 -0.008 0.000 0.918 55 R CA 0.713 56.810 56.100 -0.005 0.000 1.130 55 R CB -0.186 30.104 30.300 -0.017 0.000 0.881 55 R HN 0.600 nan 8.270 nan 0.000 0.416 56 K N 3.553 123.954 120.400 0.002 0.000 2.464 56 K HA 0.250 4.570 4.320 0.000 0.000 0.253 56 K C 0.989 177.590 176.600 0.001 0.000 0.933 56 K CA -0.650 55.639 56.287 0.003 0.000 0.801 56 K CB 1.681 34.190 32.500 0.015 0.000 1.271 56 K HN 0.188 nan 8.250 nan 0.000 0.430 57 V N 0.548 120.461 119.914 -0.002 0.000 2.230 57 V HA -0.310 3.810 4.120 0.000 0.000 0.256 57 V C 0.791 176.886 176.094 0.002 0.000 1.064 57 V CA 1.637 63.937 62.300 -0.001 0.000 1.050 57 V CB -1.263 30.560 31.823 -0.001 0.000 0.666 57 V HN 0.680 nan 8.190 nan 0.000 0.457 58 L N -0.745 120.481 121.223 0.005 0.000 2.654 58 L HA 0.667 5.007 4.340 0.000 0.000 0.257 58 L C -1.086 175.790 176.870 0.010 0.000 1.093 58 L CA -0.262 54.582 54.840 0.007 0.000 0.903 58 L CB 1.946 44.009 42.059 0.006 0.000 1.520 58 L HN 0.656 nan 8.230 nan 0.000 0.402 59 E N -0.782 119.425 120.200 0.011 0.000 3.311 59 E HA 0.563 4.913 4.350 0.000 0.000 0.384 59 E C -2.009 174.598 176.600 0.012 0.000 0.981 59 E CA -0.548 55.860 56.400 0.013 0.000 0.754 59 E CB 0.547 30.258 29.700 0.018 0.000 1.369 59 E HN 0.207 nan 8.360 nan 0.000 0.448 60 V N 0.000 119.921 119.914 0.011 0.000 0.000 60 V HA 0.000 4.120 4.120 0.000 0.000 0.000 60 V CA 0.000 62.306 62.300 0.010 0.000 0.000 60 V CB 0.000 31.828 31.823 0.008 0.000 0.000 60 V HN 0.000 nan 8.190 nan 0.000 0.000