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 3e7k_1_B DATA FIRST_RESID 1 DATA SEQUENCE GAGSRVTFER VEQMSIQIKE VGDRVNYIKR SLQSLDSQIG HLQDLSALTV DATA SEQUENCE DTLKT 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 G HA2 0.000 nan 3.960 nan 0.000 0.244 1 G HA3 0.000 3.959 3.960 -0.001 0.000 0.244 1 G C 0.000 174.904 174.900 0.006 0.000 0.946 1 G CA 0.000 45.102 45.100 0.004 0.000 0.502 2 A N 1.026 123.848 122.820 0.005 0.000 1.903 2 A HA 0.137 4.456 4.320 -0.001 0.000 0.219 2 A C 2.718 180.311 177.584 0.016 0.000 1.191 2 A CA 3.076 55.117 52.037 0.007 0.000 0.638 2 A CB -1.373 17.630 19.000 0.005 0.000 0.823 2 A HN 1.441 nan 8.150 nan 0.000 0.451 3 G N -0.646 108.165 108.800 0.017 0.000 2.476 3 G HA2 -0.222 3.737 3.960 -0.001 0.000 0.218 3 G HA3 -0.222 3.737 3.960 -0.001 0.000 0.218 3 G C 1.819 176.741 174.900 0.036 0.000 1.164 3 G CA 1.538 46.652 45.100 0.023 0.000 0.768 3 G HN 0.567 nan 8.290 nan 0.000 0.560 4 S N 0.537 116.260 115.700 0.039 0.000 2.382 4 S HA -0.099 4.370 4.470 -0.001 0.000 0.228 4 S C 2.249 176.902 174.600 0.088 0.000 1.027 4 S CA 1.306 59.543 58.200 0.063 0.000 0.991 4 S CB -0.207 63.027 63.200 0.057 0.000 0.823 4 S HN 0.356 nan 8.310 nan 0.000 0.469 5 R N 1.957 122.488 120.500 0.052 0.000 2.080 5 R HA -0.043 4.297 4.340 -0.001 0.000 0.236 5 R C 1.984 178.341 176.300 0.095 0.000 1.137 5 R CA 1.722 57.849 56.100 0.046 0.000 0.943 5 R CB -1.266 29.035 30.300 0.003 0.000 0.846 5 R HN 0.318 nan 8.270 nan 0.000 0.431 6 V N -0.090 119.865 119.914 0.069 0.000 2.515 6 V HA -0.191 3.928 4.120 -0.001 0.000 0.250 6 V C 2.099 178.245 176.094 0.086 0.000 1.058 6 V CA 2.257 64.597 62.300 0.067 0.000 1.064 6 V CB -0.755 31.093 31.823 0.041 0.000 0.675 6 V HN 0.417 nan 8.190 nan 0.000 0.461 7 T N -0.142 114.466 114.554 0.091 0.000 2.821 7 T HA -0.131 4.218 4.350 -0.001 0.000 0.267 7 T C 1.635 176.394 174.700 0.097 0.000 1.046 7 T CA 1.644 63.787 62.100 0.073 0.000 1.139 7 T CB -0.341 68.562 68.868 0.058 0.000 0.871 7 T HN 0.498 nan 8.240 nan 0.000 0.454 8 F N 1.915 121.865 119.950 0.000 0.000 2.102 8 F HA -0.115 4.412 4.527 -0.001 0.000 0.298 8 F C 2.449 178.249 175.800 0.000 0.000 1.105 8 F CA 1.592 59.592 58.000 0.000 0.000 1.239 8 F CB -0.044 38.956 39.000 -0.000 0.000 0.991 8 F HN 0.043 nan 8.300 nan 0.000 0.474 9 E N 0.620 121.008 120.200 0.313 0.000 2.085 9 E HA -0.223 4.126 4.350 -0.001 0.000 0.194 9 E C 2.274 178.914 176.600 0.067 0.000 0.994 9 E CA 1.659 58.174 56.400 0.191 0.000 0.801 9 E CB -0.213 29.566 29.700 0.131 0.000 0.743 9 E HN 0.344 nan 8.360 nan 0.000 0.453 10 R N -0.693 119.832 120.500 0.041 0.000 2.081 10 R HA -0.073 4.266 4.340 -0.001 0.000 0.235 10 R C 2.413 178.695 176.300 -0.030 0.000 1.131 10 R CA 1.366 57.470 56.100 0.007 0.000 0.960 10 R CB -0.345 29.960 30.300 0.010 0.000 0.856 10 R HN 0.107 nan 8.270 nan 0.000 0.436 11 V N 0.694 120.565 119.914 -0.072 0.000 2.358 11 V HA -0.212 3.907 4.120 -0.001 0.000 0.246 11 V C 2.102 178.111 176.094 -0.142 0.000 1.047 11 V CA 1.828 64.056 62.300 -0.120 0.000 1.035 11 V CB -0.343 31.373 31.823 -0.178 0.000 0.658 11 V HN 0.305 nan 8.190 nan 0.000 0.452 12 E N -0.247 119.846 120.200 -0.178 0.000 2.070 12 E HA -0.262 4.087 4.350 -0.001 0.000 0.197 12 E C 2.325 178.895 176.600 -0.049 0.000 1.004 12 E CA 1.451 57.779 56.400 -0.121 0.000 0.805 12 E CB -0.084 29.585 29.700 -0.051 0.000 0.744 12 E HN 0.472 nan 8.360 nan 0.000 0.451 13 Q N -0.435 119.350 119.800 -0.025 0.000 2.119 13 Q HA -0.101 4.238 4.340 -0.001 0.000 0.201 13 Q C 2.227 178.214 176.000 -0.021 0.000 0.972 13 Q CA 1.348 57.144 55.803 -0.013 0.000 0.847 13 Q CB -0.289 28.449 28.738 -0.001 0.000 0.903 13 Q HN 0.457 nan 8.270 nan 0.000 0.433 14 M N 0.324 119.905 119.600 -0.031 0.000 2.149 14 M HA -0.170 4.309 4.480 -0.001 0.000 0.261 14 M C 2.265 178.547 176.300 -0.031 0.000 1.064 14 M CA 1.882 57.165 55.300 -0.029 0.000 1.102 14 M CB -0.335 32.244 32.600 -0.035 0.000 1.369 14 M HN 0.225 nan 8.290 nan 0.000 0.408 15 S N 0.426 116.101 115.700 -0.042 0.000 2.395 15 S HA -0.034 4.435 4.470 -0.001 0.000 0.225 15 S C 1.746 176.331 174.600 -0.026 0.000 1.027 15 S CA 0.602 58.779 58.200 -0.039 0.000 0.965 15 S CB -0.780 62.388 63.200 -0.054 0.000 0.812 15 S HN 0.442 nan 8.310 nan 0.000 0.482 16 I N 1.920 122.477 120.570 -0.022 0.000 2.151 16 I HA -0.264 3.905 4.170 -0.001 0.000 0.243 16 I C 2.994 179.105 176.117 -0.010 0.000 1.080 16 I CA 1.817 63.110 61.300 -0.013 0.000 1.339 16 I CB -0.455 37.540 38.000 -0.008 0.000 1.039 16 I HN 0.398 nan 8.210 nan 0.000 0.409 17 Q N 0.193 119.986 119.800 -0.011 0.000 2.230 17 Q HA -0.098 4.241 4.340 -0.001 0.000 0.202 17 Q C 2.323 178.319 176.000 -0.007 0.000 0.963 17 Q CA 1.157 56.956 55.803 -0.007 0.000 0.866 17 Q CB 0.058 28.792 28.738 -0.007 0.000 0.931 17 Q HN 0.573 nan 8.270 nan 0.000 0.452 18 I N 0.107 120.671 120.570 -0.010 0.000 2.353 18 I HA -0.261 3.908 4.170 -0.001 0.000 0.248 18 I C 2.539 178.653 176.117 -0.006 0.000 1.119 18 I CA 0.827 62.121 61.300 -0.009 0.000 1.417 18 I CB -0.165 37.827 38.000 -0.013 0.000 1.078 18 I HN 0.010 nan 8.210 nan 0.000 0.421 19 K N 1.281 121.676 120.400 -0.007 0.000 2.057 19 K HA -0.191 4.128 4.320 -0.001 0.000 0.206 19 K C 2.324 178.923 176.600 -0.002 0.000 1.050 19 K CA 1.823 58.108 56.287 -0.005 0.000 0.935 19 K CB -0.810 31.686 32.500 -0.007 0.000 0.715 19 K HN 0.562 nan 8.250 nan 0.000 0.439 20 E N 0.168 120.366 120.200 -0.003 0.000 2.085 20 E HA -0.119 4.230 4.350 -0.001 0.000 0.194 20 E C 2.184 178.788 176.600 0.006 0.000 0.994 20 E CA 1.853 58.252 56.400 -0.002 0.000 0.801 20 E CB -1.152 28.546 29.700 -0.004 0.000 0.743 20 E HN 0.378 nan 8.360 nan 0.000 0.453 21 V N 1.046 120.964 119.914 0.006 0.000 2.295 21 V HA -0.125 3.994 4.120 -0.001 0.000 0.246 21 V C 2.828 178.932 176.094 0.017 0.000 1.049 21 V CA 1.956 64.263 62.300 0.012 0.000 1.024 21 V CB -1.043 30.785 31.823 0.007 0.000 0.648 21 V HN 0.661 nan 8.190 nan 0.000 0.447 22 G N 0.149 108.956 108.800 0.012 0.000 2.586 22 G HA2 -0.345 3.614 3.960 -0.001 0.000 0.218 22 G HA3 -0.345 3.614 3.960 -0.001 0.000 0.218 22 G C 1.207 176.122 174.900 0.025 0.000 1.216 22 G CA 1.340 46.449 45.100 0.015 0.000 0.786 22 G HN 0.518 nan 8.290 nan 0.000 0.583 23 D N 0.425 120.837 120.400 0.021 0.000 2.133 23 D HA -0.117 4.522 4.640 -0.001 0.000 0.192 23 D C 2.608 178.942 176.300 0.056 0.000 1.001 23 D CA 0.984 55.000 54.000 0.027 0.000 0.844 23 D CB -0.344 40.458 40.800 0.004 0.000 0.944 23 D HN 0.306 nan 8.370 nan 0.000 0.447 24 R N 0.163 120.696 120.500 0.054 0.000 2.081 24 R HA -0.073 4.266 4.340 -0.001 0.000 0.235 24 R C 2.445 178.817 176.300 0.120 0.000 1.131 24 R CA 0.717 56.877 56.100 0.099 0.000 0.960 24 R CB -0.350 29.992 30.300 0.069 0.000 0.856 24 R HN 0.087 nan 8.270 nan 0.000 0.436 25 V N 1.295 121.251 119.914 0.071 0.000 2.427 25 V HA -0.225 3.894 4.120 -0.001 0.000 0.248 25 V C 1.522 177.650 176.094 0.057 0.000 1.051 25 V CA 1.826 64.157 62.300 0.051 0.000 1.048 25 V CB -0.588 31.252 31.823 0.029 0.000 0.666 25 V HN 0.419 nan 8.190 nan 0.000 0.456 26 N N -0.798 117.942 118.700 0.067 0.000 2.104 26 N HA -0.255 4.484 4.740 -0.001 0.000 0.190 26 N C 1.925 177.505 175.510 0.117 0.000 1.024 26 N CA 1.639 54.732 53.050 0.071 0.000 0.853 26 N CB -0.281 38.243 38.487 0.061 0.000 1.008 26 N HN 0.563 nan 8.380 nan 0.000 0.424 27 Y N 1.825 122.125 120.300 0.000 0.000 2.145 27 Y HA -0.116 4.434 4.550 -0.001 0.000 0.286 27 Y C 1.919 177.819 175.900 0.001 0.000 1.145 27 Y CA 1.177 59.278 58.100 0.001 0.000 1.148 27 Y CB -0.422 38.039 38.460 0.001 0.000 0.981 27 Y HN 0.027 nan 8.280 nan 0.000 0.507 28 I N -0.135 120.401 120.570 -0.056 0.000 2.163 28 I HA -0.379 3.791 4.170 -0.001 0.000 0.243 28 I C 2.680 178.726 176.117 -0.118 0.000 1.085 28 I CA 1.932 63.142 61.300 -0.149 0.000 1.347 28 I CB -0.708 37.266 38.000 -0.043 0.000 1.044 28 I HN 0.074 nan 8.210 nan 0.000 0.408 29 K N 1.234 121.603 120.400 -0.051 0.000 2.044 29 K HA -0.213 4.106 4.320 -0.001 0.000 0.210 29 K C 2.147 178.716 176.600 -0.052 0.000 1.049 29 K CA 1.792 58.056 56.287 -0.038 0.000 0.927 29 K CB -0.563 31.931 32.500 -0.009 0.000 0.713 29 K HN 0.397 nan 8.250 nan 0.000 0.443 30 R N 0.002 120.471 120.500 -0.052 0.000 2.075 30 R HA 0.017 4.356 4.340 -0.001 0.000 0.232 30 R C 2.892 179.129 176.300 -0.104 0.000 1.126 30 R CA 1.741 57.812 56.100 -0.047 0.000 0.963 30 R CB -0.472 29.831 30.300 0.006 0.000 0.858 30 R HN 0.374 nan 8.270 nan 0.000 0.435 31 S N 1.303 116.872 115.700 -0.218 0.000 2.382 31 S HA -0.069 4.401 4.470 -0.001 0.000 0.228 31 S C 1.970 176.492 174.600 -0.130 0.000 1.027 31 S CA 0.966 59.026 58.200 -0.233 0.000 0.991 31 S CB -0.131 62.836 63.200 -0.389 0.000 0.823 31 S HN 0.211 nan 8.310 nan 0.000 0.469 32 L N 1.263 122.421 121.223 -0.109 0.000 2.141 32 L HA -0.154 4.185 4.340 -0.001 0.000 0.209 32 L C 2.668 179.509 176.870 -0.049 0.000 1.094 32 L CA 1.086 55.885 54.840 -0.068 0.000 0.763 32 L CB -0.500 41.525 42.059 -0.056 0.000 0.908 32 L HN 0.371 nan 8.230 nan 0.000 0.437 33 Q N -0.856 118.917 119.800 -0.045 0.000 2.079 33 Q HA -0.164 4.176 4.340 -0.001 0.000 0.200 33 Q C 2.421 178.407 176.000 -0.024 0.000 0.974 33 Q CA 1.642 57.427 55.803 -0.030 0.000 0.840 33 Q CB -0.159 28.567 28.738 -0.021 0.000 0.898 33 Q HN 0.378 nan 8.270 nan 0.000 0.430 34 S N 1.200 116.883 115.700 -0.027 0.000 2.370 34 S HA -0.159 4.311 4.470 -0.001 0.000 0.226 34 S C 1.854 176.449 174.600 -0.008 0.000 1.033 34 S CA 1.195 59.389 58.200 -0.012 0.000 1.011 34 S CB -0.276 62.913 63.200 -0.019 0.000 0.852 34 S HN 0.283 nan 8.310 nan 0.000 0.457 35 L N 2.283 123.492 121.223 -0.024 0.000 2.056 35 L HA -0.073 4.266 4.340 -0.001 0.000 0.207 35 L C 2.015 178.877 176.870 -0.014 0.000 1.078 35 L CA 2.003 56.832 54.840 -0.018 0.000 0.749 35 L CB -0.779 41.262 42.059 -0.030 0.000 0.901 35 L HN 0.282 nan 8.230 nan 0.000 0.433 36 D N -1.178 119.209 120.400 -0.023 0.000 2.144 36 D HA -0.190 4.449 4.640 -0.001 0.000 0.199 36 D C 1.791 178.069 176.300 -0.037 0.000 0.984 36 D CA 1.447 55.430 54.000 -0.029 0.000 0.834 36 D CB 0.308 41.089 40.800 -0.032 0.000 0.955 36 D HN 0.486 nan 8.370 nan 0.000 0.465 37 S N 0.367 116.051 115.700 -0.027 0.000 2.370 37 S HA -0.177 4.292 4.470 -0.001 0.000 0.226 37 S C 2.040 176.643 174.600 0.004 0.000 1.033 37 S CA 0.925 59.103 58.200 -0.036 0.000 1.011 37 S CB -0.199 63.014 63.200 0.023 0.000 0.852 37 S HN 0.404 nan 8.310 nan 0.000 0.457 38 Q N 0.310 120.151 119.800 0.069 0.000 2.096 38 Q HA -0.078 4.261 4.340 -0.001 0.000 0.204 38 Q C 2.180 178.217 176.000 0.063 0.000 0.982 38 Q CA 1.279 57.149 55.803 0.113 0.000 0.850 38 Q CB -0.406 28.370 28.738 0.064 0.000 0.901 38 Q HN 0.553 nan 8.270 nan 0.000 0.422 39 I N 0.181 120.758 120.570 0.012 0.000 2.361 39 I HA -0.180 3.989 4.170 -0.001 0.000 0.251 39 I C 2.297 178.397 176.117 -0.029 0.000 1.133 39 I CA 1.004 62.301 61.300 -0.004 0.000 1.413 39 I CB -0.551 37.441 38.000 -0.013 0.000 1.073 39 I HN 0.247 nan 8.210 nan 0.000 0.424 40 G N 0.129 108.878 108.800 -0.085 0.000 2.422 40 G HA2 -0.216 3.743 3.960 -0.001 0.000 0.218 40 G HA3 -0.216 3.743 3.960 -0.001 0.000 0.218 40 G C 1.513 176.319 174.900 -0.157 0.000 1.146 40 G CA 0.536 45.547 45.100 -0.148 0.000 0.769 40 G HN 0.370 nan 8.290 nan 0.000 0.547 41 H N -0.354 118.712 119.070 -0.005 0.000 2.389 41 H HA -0.014 4.542 4.556 -0.001 0.000 0.299 41 H C 2.489 177.814 175.328 -0.004 0.000 1.081 41 H CA 1.298 57.343 56.048 -0.004 0.000 1.345 41 H CB -0.276 29.483 29.762 -0.004 0.000 1.393 41 H HN 0.343 nan 8.280 nan 0.000 0.520 42 L N 1.293 122.574 121.223 0.097 0.000 2.072 42 L HA -0.124 4.216 4.340 -0.001 0.000 0.205 42 L C 2.267 179.153 176.870 0.027 0.000 1.079 42 L CA 1.385 56.257 54.840 0.053 0.000 0.752 42 L CB -0.475 41.607 42.059 0.037 0.000 0.906 42 L HN 0.066 nan 8.230 nan 0.000 0.436 43 Q N -0.408 119.398 119.800 0.009 0.000 2.096 43 Q HA -0.233 4.107 4.340 -0.001 0.000 0.204 43 Q C 1.827 177.830 176.000 0.004 0.000 0.982 43 Q CA 1.912 57.714 55.803 -0.002 0.000 0.850 43 Q CB -0.230 28.498 28.738 -0.017 0.000 0.901 43 Q HN 0.554 nan 8.270 nan 0.000 0.422 44 D N 0.299 120.704 120.400 0.009 0.000 2.117 44 D HA -0.140 4.500 4.640 -0.001 0.000 0.197 44 D C 1.774 178.090 176.300 0.027 0.000 0.987 44 D CA 0.726 54.737 54.000 0.019 0.000 0.829 44 D CB -0.129 40.692 40.800 0.035 0.000 0.961 44 D HN 0.105 nan 8.370 nan 0.000 0.460 45 L N 0.477 121.722 121.223 0.036 0.000 2.044 45 L HA -0.068 4.271 4.340 -0.001 0.000 0.205 45 L C 2.283 179.164 176.870 0.018 0.000 1.075 45 L CA 1.545 56.402 54.840 0.028 0.000 0.747 45 L CB -1.022 41.056 42.059 0.031 0.000 0.903 45 L HN -0.090 nan 8.230 nan 0.000 0.435 46 S N -0.642 115.067 115.700 0.015 0.000 2.359 46 S HA -0.214 4.255 4.470 -0.001 0.000 0.224 46 S C 2.167 176.771 174.600 0.007 0.000 1.035 46 S CA 1.452 59.658 58.200 0.009 0.000 1.018 46 S CB -0.518 62.686 63.200 0.007 0.000 0.876 46 S HN 0.643 nan 8.310 nan 0.000 0.448 47 A N 1.199 124.023 122.820 0.006 0.000 1.902 47 A HA -0.005 4.314 4.320 -0.001 0.000 0.217 47 A C 2.184 179.772 177.584 0.005 0.000 1.181 47 A CA 1.686 53.725 52.037 0.004 0.000 0.623 47 A CB -0.884 18.117 19.000 0.002 0.000 0.818 47 A HN 0.607 nan 8.150 nan 0.000 0.443 48 L N -0.294 120.934 121.223 0.008 0.000 2.083 48 L HA -0.095 4.244 4.340 -0.001 0.000 0.209 48 L C 2.363 179.237 176.870 0.006 0.000 1.083 48 L CA 2.763 57.608 54.840 0.008 0.000 0.752 48 L CB -0.907 41.159 42.059 0.011 0.000 0.899 48 L HN 0.344 nan 8.230 nan 0.000 0.433 49 T N -1.195 113.363 114.554 0.007 0.000 2.777 49 T HA -0.141 4.208 4.350 -0.001 0.000 0.266 49 T C 1.976 176.678 174.700 0.004 0.000 1.040 49 T CA 1.525 63.628 62.100 0.005 0.000 1.141 49 T CB -0.383 68.488 68.868 0.005 0.000 0.868 49 T HN 0.191 nan 8.240 nan 0.000 0.444 50 V N 1.820 121.736 119.914 0.003 0.000 2.255 50 V HA -0.206 3.913 4.120 -0.001 0.000 0.247 50 V C 2.435 178.530 176.094 0.002 0.000 1.051 50 V CA 2.018 64.320 62.300 0.002 0.000 1.018 50 V CB -0.632 31.192 31.823 0.002 0.000 0.641 50 V HN 0.437 nan 8.190 nan 0.000 0.445 51 D N -0.792 119.610 120.400 0.002 0.000 2.190 51 D HA -0.183 4.456 4.640 -0.001 0.000 0.200 51 D C 2.153 178.454 176.300 0.002 0.000 0.992 51 D CA 1.766 55.767 54.000 0.002 0.000 0.854 51 D CB -0.055 40.746 40.800 0.003 0.000 0.936 51 D HN 0.362 nan 8.370 nan 0.000 0.462 52 T N -1.345 113.211 114.554 0.002 0.000 3.067 52 T HA 0.140 4.489 4.350 -0.001 0.000 0.257 52 T C 1.543 176.244 174.700 0.002 0.000 1.105 52 T CA 0.199 62.300 62.100 0.002 0.000 1.104 52 T CB 0.175 69.044 68.868 0.003 0.000 0.925 52 T HN 0.105 nan 8.240 nan 0.000 0.498 53 L N -0.293 120.931 121.223 0.002 0.000 2.609 53 L HA 0.156 4.495 4.340 -0.001 0.000 0.230 53 L C 2.619 179.489 176.870 0.001 0.000 1.087 53 L CA -0.015 54.826 54.840 0.001 0.000 0.874 53 L CB -0.133 41.927 42.059 0.001 0.000 1.114 53 L HN -0.024 nan 8.230 nan 0.000 0.488 54 K N 0.448 120.848 120.400 0.001 0.000 2.089 54 K HA -0.114 4.205 4.320 -0.001 0.000 0.210 54 K C 1.099 177.699 176.600 0.001 0.000 1.048 54 K CA 1.758 58.045 56.287 0.001 0.000 0.926 54 K CB -0.878 31.622 32.500 0.001 0.000 0.714 54 K HN 0.709 nan 8.250 nan 0.000 0.448 55 T N 0.000 114.554 114.554 0.001 0.000 3.816 55 T HA 0.000 4.349 4.350 -0.001 0.000 0.228 55 T CA 0.000 62.100 62.100 0.001 0.000 1.349 55 T CB 0.000 nan 68.868 nan 0.000 0.612 55 T HN 0.000 nan 8.240 nan 0.000 0.658