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 3hlu_1_A DATA FIRST_RESID 3 DATA SEQUENCE DQQTXVYIVS AKRKIIADRX LQELDLGVTX LQAVGAYKNN ETEVIXCVXR DATA SEQUENCE KATLVKVRNL LKEVDPDAFX IVS 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 3 D HA 0.000 nan 4.640 nan 0.000 0.000 3 D C 0.000 176.297 176.300 -0.005 0.000 0.000 3 D CA 0.000 53.998 54.000 -0.004 0.000 0.000 3 D CB 0.000 40.797 40.800 -0.004 0.000 0.000 4 Q N 0.600 120.397 119.800 -0.004 0.000 2.304 4 Q HA 0.306 4.646 4.340 -0.000 0.000 0.260 4 Q C 0.188 176.182 176.000 -0.009 0.000 0.965 4 Q CA 0.048 55.848 55.803 -0.006 0.000 0.898 4 Q CB 1.144 29.880 28.738 -0.003 0.000 1.196 4 Q HN 0.186 nan 8.270 nan 0.000 0.402 5 Q N 1.541 121.334 119.800 -0.012 0.000 2.247 5 Q HA -0.003 4.337 4.340 -0.000 0.000 0.288 5 Q C -0.188 175.799 176.000 -0.021 0.000 1.079 5 Q CA 0.633 56.425 55.803 -0.018 0.000 0.932 5 Q CB 0.597 29.323 28.738 -0.019 0.000 1.133 5 Q HN 0.571 nan 8.270 nan 0.000 0.377 9 Y N 4.127 124.410 120.300 -0.027 0.000 2.352 9 Y HA 0.771 5.321 4.550 -0.000 0.000 0.339 9 Y C 0.179 176.019 175.900 -0.101 0.000 0.992 9 Y CA -0.819 57.248 58.100 -0.055 0.000 1.100 9 Y CB 1.756 40.188 38.460 -0.046 0.000 1.192 9 Y HN 0.442 nan 8.280 nan 0.000 0.458 10 I N 3.920 124.490 120.570 0.000 0.000 2.389 10 I HA 0.345 4.515 4.170 -0.000 0.000 0.288 10 I C -0.993 175.002 176.117 -0.202 0.000 0.999 10 I CA -0.963 60.268 61.300 -0.115 0.000 1.129 10 I CB 1.442 39.393 38.000 -0.081 0.000 1.288 10 I HN 0.289 nan 8.210 nan 0.000 0.444 11 V N 5.309 124.941 119.914 -0.470 0.000 2.364 11 V HA 0.504 4.624 4.120 -0.000 0.000 0.272 11 V C 0.073 175.941 176.094 -0.376 0.000 1.036 11 V CA -0.117 61.867 62.300 -0.527 0.000 0.880 11 V CB 1.088 32.280 31.823 -1.052 0.000 0.991 11 V HN 0.800 nan 8.190 nan 0.000 0.460 12 S N 3.470 119.068 115.700 -0.169 0.000 2.535 12 S HA 0.634 5.104 4.470 -0.000 0.000 0.272 12 S C 0.717 175.297 174.600 -0.033 0.000 1.149 12 S CA 0.183 58.337 58.200 -0.077 0.000 0.888 12 S CB 1.974 65.138 63.200 -0.060 0.000 1.110 12 S HN 0.948 nan 8.310 nan 0.000 0.463 13 A N 3.824 126.642 122.820 -0.003 0.000 1.933 13 A HA 0.053 4.373 4.320 -0.000 0.000 0.218 13 A C 1.487 179.071 177.584 -0.000 0.000 1.175 13 A CA 1.115 53.155 52.037 0.005 0.000 0.628 13 A CB -0.317 18.694 19.000 0.017 0.000 0.814 13 A HN 0.697 nan 8.150 nan 0.000 0.444 14 K N 0.328 120.727 120.400 -0.001 0.000 2.627 14 K HA 0.022 4.342 4.320 -0.000 0.000 0.212 14 K C 1.462 178.056 176.600 -0.009 0.000 1.041 14 K CA 0.012 56.297 56.287 -0.002 0.000 1.205 14 K CB 0.061 32.562 32.500 0.002 0.000 0.936 14 K HN 0.642 nan 8.250 nan 0.000 0.489 15 R N 1.271 121.762 120.500 -0.015 0.000 2.096 15 R HA -0.144 4.196 4.340 -0.000 0.000 0.235 15 R C 1.666 177.957 176.300 -0.014 0.000 1.127 15 R CA 1.393 57.481 56.100 -0.021 0.000 0.968 15 R CB -0.376 29.907 30.300 -0.027 0.000 0.861 15 R HN 0.150 nan 8.270 nan 0.000 0.440 16 K N 0.880 121.275 120.400 -0.009 0.000 2.032 16 K HA -0.103 4.217 4.320 -0.000 0.000 0.209 16 K C 2.335 178.931 176.600 -0.007 0.000 1.048 16 K CA 1.804 58.087 56.287 -0.007 0.000 0.927 16 K CB -0.174 32.323 32.500 -0.004 0.000 0.712 16 K HN 0.262 nan 8.250 nan 0.000 0.441 17 I N 1.147 121.714 120.570 -0.005 0.000 2.163 17 I HA -0.321 3.849 4.170 -0.000 0.000 0.243 17 I C 2.374 178.487 176.117 -0.007 0.000 1.085 17 I CA 1.352 62.649 61.300 -0.005 0.000 1.347 17 I CB -0.304 37.695 38.000 -0.003 0.000 1.044 17 I HN 0.210 nan 8.210 nan 0.000 0.408 18 I N 0.826 121.391 120.570 -0.009 0.000 2.179 18 I HA -0.303 3.867 4.170 -0.000 0.000 0.242 18 I C 2.835 178.944 176.117 -0.013 0.000 1.088 18 I CA 1.419 62.712 61.300 -0.012 0.000 1.357 18 I CB -0.522 37.468 38.000 -0.017 0.000 1.051 18 I HN 0.209 nan 8.210 nan 0.000 0.409 19 A N 0.474 123.286 122.820 -0.014 0.000 1.902 19 A HA -0.241 4.079 4.320 -0.000 0.000 0.217 19 A C 1.937 179.514 177.584 -0.012 0.000 1.181 19 A CA 2.105 54.133 52.037 -0.015 0.000 0.623 19 A CB -0.556 18.436 19.000 -0.014 0.000 0.818 19 A HN 0.349 nan 8.150 nan 0.000 0.443 20 D N -0.372 120.023 120.400 -0.009 0.000 2.097 20 D HA -0.041 4.599 4.640 -0.000 0.000 0.197 20 D C 1.342 177.637 176.300 -0.007 0.000 0.984 20 D CA 0.664 54.659 54.000 -0.007 0.000 0.826 20 D CB -0.232 40.564 40.800 -0.006 0.000 0.973 20 D HN 0.422 nan 8.370 nan 0.000 0.460 24 Q N 0.301 120.097 119.800 -0.007 0.000 2.062 24 Q HA -0.004 4.336 4.340 -0.000 0.000 0.196 24 Q C 1.139 177.135 176.000 -0.006 0.000 0.967 24 Q CA 2.289 58.088 55.803 -0.006 0.000 0.832 24 Q CB 0.118 28.854 28.738 -0.005 0.000 0.899 24 Q HN 0.608 nan 8.270 nan 0.000 0.442 25 E N -0.595 119.601 120.200 -0.006 0.000 2.415 25 E HA 0.082 4.432 4.350 -0.000 0.000 0.197 25 E C 0.856 177.452 176.600 -0.006 0.000 1.007 25 E CA 0.258 56.655 56.400 -0.005 0.000 0.890 25 E CB 0.635 30.333 29.700 -0.004 0.000 0.891 25 E HN 0.214 nan 8.360 nan 0.000 0.496 26 L N 0.094 121.312 121.223 -0.008 0.000 3.086 26 L HA 0.195 4.535 4.340 -0.000 0.000 0.274 26 L C -0.292 176.572 176.870 -0.010 0.000 1.184 26 L CA -0.179 54.655 54.840 -0.009 0.000 1.002 26 L CB 0.408 42.461 42.059 -0.010 0.000 1.383 26 L HN -0.049 nan 8.230 nan 0.000 0.582 27 D N 1.172 121.567 120.400 -0.010 0.000 2.882 27 D HA -0.189 4.451 4.640 -0.000 0.000 0.229 27 D C 0.169 176.461 176.300 -0.013 0.000 1.167 27 D CA 0.769 54.763 54.000 -0.010 0.000 0.759 27 D CB -1.044 39.751 40.800 -0.009 0.000 1.088 27 D HN 0.316 nan 8.370 nan 0.000 0.425 28 L N 0.693 121.907 121.223 -0.015 0.000 2.349 28 L HA 0.387 4.727 4.340 -0.000 0.000 0.275 28 L C 1.479 178.337 176.870 -0.020 0.000 1.115 28 L CA -0.098 54.731 54.840 -0.019 0.000 0.820 28 L CB 1.213 43.258 42.059 -0.022 0.000 1.135 28 L HN -0.028 nan 8.230 nan 0.000 0.445 29 G N 2.745 111.532 108.800 -0.022 0.000 2.320 29 G HA2 0.502 4.462 3.960 -0.000 0.000 0.300 29 G HA3 0.502 4.462 3.960 -0.000 0.000 0.300 29 G C -0.600 174.283 174.900 -0.028 0.000 1.126 29 G CA -0.271 44.816 45.100 -0.021 0.000 0.896 29 G HN 0.495 nan 8.290 nan 0.000 0.436 30 V N 0.667 120.565 119.914 -0.025 0.000 2.914 30 V HA 0.918 5.038 4.120 -0.000 0.000 0.314 30 V C 0.021 176.102 176.094 -0.022 0.000 1.084 30 V CA -0.729 61.553 62.300 -0.030 0.000 0.963 30 V CB 1.750 33.554 31.823 -0.030 0.000 1.025 30 V HN 0.685 nan 8.190 nan 0.000 0.432 34 Q N 2.170 121.984 119.800 0.023 0.000 2.322 34 Q HA 0.876 5.216 4.340 -0.000 0.000 0.265 34 Q C -0.736 175.266 176.000 0.003 0.000 0.985 34 Q CA -0.235 55.575 55.803 0.012 0.000 0.849 34 Q CB 1.917 30.662 28.738 0.012 0.000 1.274 34 Q HN 0.985 nan 8.270 nan 0.000 0.449 35 A N 2.834 125.651 122.820 -0.005 0.000 2.304 35 A HA 0.461 4.781 4.320 -0.000 0.000 0.271 35 A C -0.582 176.994 177.584 -0.013 0.000 1.091 35 A CA -0.532 51.493 52.037 -0.019 0.000 0.812 35 A CB 0.860 19.844 19.000 -0.026 0.000 1.056 35 A HN 0.590 nan 8.150 nan 0.000 0.489 36 V N 2.470 122.370 119.914 -0.023 0.000 2.339 36 V HA 0.425 4.545 4.120 -0.000 0.000 0.261 36 V C 1.177 177.258 176.094 -0.021 0.000 1.058 36 V CA 0.252 62.541 62.300 -0.019 0.000 0.897 36 V CB 0.174 31.981 31.823 -0.026 0.000 1.052 36 V HN 1.081 nan 8.190 nan 0.000 0.480 37 G N 3.255 112.051 108.800 -0.007 0.000 2.580 37 G HA2 0.448 4.408 3.960 -0.000 0.000 0.278 37 G HA3 0.448 4.408 3.960 -0.000 0.000 0.278 37 G C 1.132 176.002 174.900 -0.049 0.000 1.212 37 G CA 0.084 45.179 45.100 -0.008 0.000 0.939 37 G HN 0.837 nan 8.290 nan 0.000 0.513 38 A N -0.643 122.120 122.820 -0.095 0.000 1.948 38 A HA 0.067 4.387 4.320 -0.000 0.000 0.220 38 A C 0.560 177.901 177.584 -0.405 0.000 1.177 38 A CA 1.130 53.006 52.037 -0.269 0.000 0.636 38 A CB -0.482 18.307 19.000 -0.353 0.000 0.815 38 A HN 0.555 nan 8.150 nan 0.000 0.449 39 Y N -1.673 118.626 120.300 -0.001 0.000 2.524 39 Y HA 0.402 4.952 4.550 -0.000 0.000 0.344 39 Y C 1.180 177.079 175.900 -0.001 0.000 1.012 39 Y CA -0.691 57.409 58.100 -0.001 0.000 1.068 39 Y CB 1.619 40.079 38.460 -0.000 0.000 1.249 39 Y HN 0.173 nan 8.280 nan 0.000 0.468 40 K N -0.617 119.880 120.400 0.163 0.000 2.305 40 K HA -0.041 4.279 4.320 -0.000 0.000 0.199 40 K C 0.128 176.773 176.600 0.075 0.000 1.047 40 K CA 1.381 57.722 56.287 0.089 0.000 0.976 40 K CB -0.097 32.437 32.500 0.057 0.000 0.765 40 K HN 0.570 nan 8.250 nan 0.000 0.474 41 N N 1.562 120.309 118.700 0.079 0.000 2.453 41 N HA -0.145 4.594 4.740 -0.000 0.000 0.183 41 N C 0.006 175.542 175.510 0.042 0.000 1.041 41 N CA 0.809 53.882 53.050 0.037 0.000 0.900 41 N CB -0.403 38.083 38.487 -0.003 0.000 0.961 41 N HN 0.327 nan 8.380 nan 0.000 0.443 42 N N 1.522 120.271 118.700 0.081 0.000 3.188 42 N HA 0.013 4.753 4.740 -0.000 0.000 0.279 42 N C -0.940 174.604 175.510 0.057 0.000 1.213 42 N CA -0.312 52.784 53.050 0.077 0.000 1.138 42 N CB 0.235 38.802 38.487 0.134 0.000 1.417 42 N HN 0.297 nan 8.380 nan 0.000 0.526 43 E N 0.399 120.622 120.200 0.037 0.000 2.392 43 E HA 0.063 4.413 4.350 -0.000 0.000 0.264 43 E C -0.241 176.372 176.600 0.022 0.000 1.024 43 E CA -0.046 56.370 56.400 0.027 0.000 0.903 43 E CB 1.270 30.982 29.700 0.019 0.000 0.963 43 E HN 0.064 nan 8.360 nan 0.000 0.432 44 T N 1.613 116.177 114.554 0.017 0.000 2.952 44 T HA 0.190 4.540 4.350 -0.000 0.000 0.305 44 T C -1.332 173.371 174.700 0.004 0.000 1.064 44 T CA -0.710 61.397 62.100 0.011 0.000 1.008 44 T CB 1.370 70.246 68.868 0.013 0.000 1.078 44 T HN 0.485 nan 8.240 nan 0.000 0.459 45 E N 2.268 122.468 120.200 -0.000 0.000 2.195 45 E HA 0.668 5.018 4.350 -0.000 0.000 0.271 45 E C -1.050 175.545 176.600 -0.007 0.000 0.923 45 E CA -0.941 55.459 56.400 0.000 0.000 0.790 45 E CB 2.435 32.136 29.700 0.001 0.000 1.155 45 E HN 0.347 nan 8.360 nan 0.000 0.402 46 V N 3.861 123.779 119.914 0.005 0.000 2.680 46 V HA 0.403 4.523 4.120 -0.000 0.000 0.309 46 V C 0.101 176.214 176.094 0.030 0.000 1.052 46 V CA -0.572 61.735 62.300 0.012 0.000 0.908 46 V CB 1.759 33.603 31.823 0.035 0.000 1.001 46 V HN 0.572 nan 8.190 nan 0.000 0.431 53 K N 0.601 120.996 120.400 -0.009 0.000 2.147 53 K HA -0.124 4.196 4.320 -0.000 0.000 0.205 53 K C 1.879 178.477 176.600 -0.004 0.000 1.049 53 K CA 1.836 58.120 56.287 -0.005 0.000 0.936 53 K CB -0.106 32.394 32.500 -0.001 0.000 0.722 53 K HN 0.590 nan 8.250 nan 0.000 0.446 54 A N 1.468 124.285 122.820 -0.004 0.000 1.902 54 A HA -0.166 4.153 4.320 -0.000 0.000 0.217 54 A C 2.248 179.829 177.584 -0.005 0.000 1.181 54 A CA 2.101 54.136 52.037 -0.004 0.000 0.623 54 A CB -1.098 17.900 19.000 -0.004 0.000 0.818 54 A HN 0.293 nan 8.150 nan 0.000 0.443 55 T N 0.189 114.738 114.554 -0.008 0.000 2.759 55 T HA -0.164 4.186 4.350 -0.000 0.000 0.269 55 T C 1.770 176.465 174.700 -0.009 0.000 1.042 55 T CA 1.458 63.553 62.100 -0.010 0.000 1.140 55 T CB -0.399 68.460 68.868 -0.015 0.000 0.864 55 T HN 0.308 nan 8.240 nan 0.000 0.455 56 L N 1.347 122.565 121.223 -0.008 0.000 2.127 56 L HA -0.045 4.295 4.340 -0.000 0.000 0.211 56 L C 2.343 179.213 176.870 0.001 0.000 1.089 56 L CA 1.331 56.168 54.840 -0.005 0.000 0.757 56 L CB -0.529 41.529 42.059 -0.002 0.000 0.899 56 L HN 0.087 nan 8.230 nan 0.000 0.434 57 V N -0.521 119.394 119.914 0.002 0.000 2.379 57 V HA -0.247 3.873 4.120 -0.000 0.000 0.245 57 V C 2.511 178.606 176.094 0.003 0.000 1.044 57 V CA 1.831 64.134 62.300 0.004 0.000 1.036 57 V CB -0.655 31.171 31.823 0.004 0.000 0.664 57 V HN 0.449 nan 8.190 nan 0.000 0.453 58 K N -0.152 120.248 120.400 -0.000 0.000 2.057 58 K HA -0.122 4.198 4.320 -0.000 0.000 0.207 58 K C 2.118 178.717 176.600 -0.001 0.000 1.049 58 K CA 1.332 57.618 56.287 -0.001 0.000 0.931 58 K CB -0.438 32.060 32.500 -0.003 0.000 0.714 58 K HN 0.328 nan 8.250 nan 0.000 0.440 59 V N 1.506 121.418 119.914 -0.003 0.000 2.307 59 V HA -0.228 3.892 4.120 -0.000 0.000 0.245 59 V C 2.458 178.553 176.094 0.002 0.000 1.045 59 V CA 1.541 63.839 62.300 -0.004 0.000 1.024 59 V CB -0.481 31.336 31.823 -0.010 0.000 0.651 59 V HN 0.319 nan 8.190 nan 0.000 0.449 60 R N 0.251 120.755 120.500 0.007 0.000 2.103 60 R HA -0.218 4.122 4.340 -0.000 0.000 0.242 60 R C 2.094 178.402 176.300 0.014 0.000 1.142 60 R CA 2.048 58.157 56.100 0.015 0.000 0.960 60 R CB -0.268 30.043 30.300 0.019 0.000 0.858 60 R HN 0.518 nan 8.270 nan 0.000 0.439 61 N N 0.616 119.322 118.700 0.010 0.000 2.331 61 N HA -0.143 4.597 4.740 -0.000 0.000 0.180 61 N C 1.496 177.010 175.510 0.007 0.000 1.019 61 N CA 0.627 53.683 53.050 0.009 0.000 0.881 61 N CB -0.177 38.313 38.487 0.006 0.000 0.972 61 N HN 0.211 nan 8.380 nan 0.000 0.435 62 L N 0.416 121.643 121.223 0.005 0.000 2.156 62 L HA 0.097 4.437 4.340 -0.000 0.000 0.208 62 L C 1.697 178.571 176.870 0.005 0.000 1.095 62 L CA 1.135 55.977 54.840 0.003 0.000 0.770 62 L CB -0.364 41.694 42.059 -0.001 0.000 0.914 62 L HN 0.055 nan 8.230 nan 0.000 0.439 63 L N -0.493 120.736 121.223 0.009 0.000 2.027 63 L HA -0.203 4.137 4.340 -0.000 0.000 0.206 63 L C 2.576 179.456 176.870 0.018 0.000 1.074 63 L CA 1.531 56.380 54.840 0.013 0.000 0.745 63 L CB -0.670 41.402 42.059 0.021 0.000 0.898 63 L HN 0.232 nan 8.230 nan 0.000 0.433 64 K N 0.122 120.533 120.400 0.019 0.000 2.127 64 K HA -0.280 4.039 4.320 -0.000 0.000 0.208 64 K C 1.930 178.539 176.600 0.015 0.000 1.047 64 K CA 1.869 58.167 56.287 0.019 0.000 0.927 64 K CB -0.154 32.356 32.500 0.016 0.000 0.716 64 K HN 0.294 nan 8.250 nan 0.000 0.450 65 E N 0.001 120.208 120.200 0.011 0.000 2.435 65 E HA -0.072 4.277 4.350 -0.000 0.000 0.195 65 E C 1.051 177.656 176.600 0.008 0.000 1.029 65 E CA 0.421 56.826 56.400 0.009 0.000 0.865 65 E CB 0.511 30.215 29.700 0.006 0.000 0.833 65 E HN 0.052 nan 8.360 nan 0.000 0.510 66 V N -0.485 119.435 119.914 0.010 0.000 3.103 66 V HA 0.116 4.236 4.120 -0.000 0.000 0.229 66 V C -0.270 175.831 176.094 0.012 0.000 1.304 66 V CA 0.292 62.597 62.300 0.008 0.000 1.298 66 V CB 1.221 33.046 31.823 0.004 0.000 1.093 66 V HN 0.115 nan 8.190 nan 0.000 0.489 67 D N -0.276 120.134 120.400 0.016 0.000 2.375 67 D HA 0.320 4.960 4.640 -0.000 0.000 0.241 67 D C -2.364 173.957 176.300 0.035 0.000 1.361 67 D CA -1.547 52.467 54.000 0.023 0.000 0.995 67 D CB 2.272 43.084 40.800 0.020 0.000 1.312 67 D HN -0.000 nan 8.370 nan 0.000 0.576 68 P HA -0.022 nan 4.420 nan 0.000 0.221 68 P C 0.503 177.840 177.300 0.062 0.000 1.145 68 P CA 0.822 63.947 63.100 0.042 0.000 0.795 68 P CB 0.439 32.157 31.700 0.031 0.000 0.775 69 D N -1.160 119.283 120.400 0.073 0.000 2.354 69 D HA 0.101 4.741 4.640 -0.000 0.000 0.209 69 D C 0.977 177.393 176.300 0.194 0.000 1.015 69 D CA 0.141 54.207 54.000 0.109 0.000 0.867 69 D CB -0.079 40.776 40.800 0.091 0.000 0.933 69 D HN 0.067 nan 8.370 nan 0.000 0.520 70 A N 0.921 123.822 122.820 0.135 0.000 2.547 70 A HA 0.322 4.642 4.320 -0.000 0.000 0.233 70 A C 0.006 177.733 177.584 0.238 0.000 1.067 70 A CA 0.348 52.450 52.037 0.109 0.000 0.763 70 A CB -0.170 18.841 19.000 0.018 0.000 1.007 70 A HN 0.209 nan 8.150 nan 0.000 0.506 74 V N 4.821 124.819 119.914 0.140 0.000 2.320 74 V HA 0.280 4.400 4.120 -0.000 0.000 0.265 74 V C 0.828 176.980 176.094 0.097 0.000 1.048 74 V CA -0.063 62.289 62.300 0.087 0.000 0.865 74 V CB 1.132 32.988 31.823 0.054 0.000 1.043 74 V HN 0.842 nan 8.190 nan 0.000 0.474 75 S N 0.000 115.769 115.700 0.115 0.000 2.498 75 S HA 0.000 4.470 4.470 -0.000 0.000 0.327 75 S CA 0.000 58.277 58.200 0.128 0.000 1.107 75 S CB 0.000 63.283 63.200 0.138 0.000 0.593 75 S HN 0.000 nan 8.310 nan 0.000 0.517