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 2wuk_1_A DATA FIRST_RESID 2 DATA SEQUENCE PLTPNDIHNK TFTKSARGYD EDEVNEFLAQ VRKDYEIVLR KKTELEAKVN DATA SEQUENCE ELDER 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 P HA 0.000 nan 4.420 nan 0.000 0.216 2 P C 0.000 177.357 177.300 0.096 0.000 1.155 2 P CA 0.000 63.151 63.100 0.085 0.000 0.800 2 P CB 0.000 31.778 31.700 0.129 0.000 0.726 3 L N 0.775 122.052 121.223 0.089 0.000 2.483 3 L HA 0.411 4.737 4.340 -0.024 0.000 0.276 3 L C 1.043 178.023 176.870 0.184 0.000 1.213 3 L CA 0.273 55.148 54.840 0.057 0.000 0.843 3 L CB 0.256 42.264 42.059 -0.085 0.000 1.107 3 L HN 0.629 nan 8.230 nan 0.000 0.487 4 T N -0.951 113.684 114.554 0.136 0.000 2.927 4 T HA 0.349 4.684 4.350 -0.024 0.000 0.281 4 T C -1.990 172.825 174.700 0.192 0.000 0.998 4 T CA -1.958 60.255 62.100 0.188 0.000 1.019 4 T CB 1.646 70.573 68.868 0.099 0.000 1.061 4 T HN 0.297 nan 8.240 nan 0.000 0.518 5 P HA -0.075 nan 4.420 nan 0.000 0.216 5 P C 1.433 178.796 177.300 0.104 0.000 1.150 5 P CA 1.002 64.209 63.100 0.178 0.000 0.837 5 P CB -0.027 31.756 31.700 0.138 0.000 0.786 6 N N -0.873 117.877 118.700 0.083 0.000 2.188 6 N HA -0.149 4.576 4.740 -0.024 0.000 0.184 6 N C 1.104 176.666 175.510 0.086 0.000 1.018 6 N CA 0.874 53.976 53.050 0.086 0.000 0.858 6 N CB -0.152 38.369 38.487 0.056 0.000 0.989 6 N HN 0.011 nan 8.380 nan 0.000 0.426 7 D N 1.105 121.536 120.400 0.051 0.000 2.104 7 D HA -0.146 4.480 4.640 -0.024 0.000 0.194 7 D C 1.990 178.287 176.300 -0.006 0.000 0.994 7 D CA 0.835 54.843 54.000 0.013 0.000 0.830 7 D CB -0.304 40.497 40.800 0.002 0.000 0.959 7 D HN 0.393 nan 8.370 nan 0.000 0.452 8 I N 0.430 121.000 120.570 -0.000 0.000 2.179 8 I HA -0.266 3.889 4.170 -0.024 0.000 0.242 8 I C 2.530 178.663 176.117 0.028 0.000 1.088 8 I CA 1.109 62.402 61.300 -0.012 0.000 1.357 8 I CB -0.375 37.600 38.000 -0.041 0.000 1.051 8 I HN 0.173 nan 8.210 nan 0.000 0.409 9 H N 1.479 120.537 119.070 -0.020 0.000 2.387 9 H HA -0.135 4.408 4.556 -0.023 0.000 0.299 9 H C 1.579 176.891 175.328 -0.026 0.000 1.090 9 H CA 1.912 57.953 56.048 -0.012 0.000 1.332 9 H CB 0.032 29.791 29.762 -0.004 0.000 1.386 9 H HN 0.435 nan 8.280 nan 0.000 0.516 10 N N 0.290 118.950 118.700 -0.066 0.000 2.463 10 N HA -0.055 4.670 4.740 -0.024 0.000 0.181 10 N C 0.285 175.687 175.510 -0.179 0.000 1.078 10 N CA -0.222 52.752 53.050 -0.127 0.000 0.902 10 N CB 0.366 38.836 38.487 -0.028 0.000 0.970 10 N HN 0.050 nan 8.380 nan 0.000 0.451 11 K N 1.960 122.241 120.400 -0.198 0.000 2.451 11 K HA 0.013 4.318 4.320 -0.024 0.000 0.280 11 K C -0.192 176.099 176.600 -0.514 0.000 1.020 11 K CA 0.262 56.349 56.287 -0.334 0.000 1.008 11 K CB 0.328 32.636 32.500 -0.320 0.000 0.917 11 K HN 0.042 nan 8.250 nan 0.000 0.478 12 T N 0.543 114.741 114.554 -0.594 0.000 2.930 12 T HA 0.729 5.064 4.350 -0.024 0.000 0.290 12 T C -0.608 173.613 174.700 -0.799 0.000 1.052 12 T CA -0.854 60.914 62.100 -0.555 0.000 1.017 12 T CB 0.647 69.373 68.868 -0.237 0.000 1.137 12 T HN 0.281 nan 8.240 nan 0.000 0.511 13 F N -0.363 119.587 119.950 -0.000 0.000 2.576 13 F HA 0.518 5.030 4.527 -0.025 0.000 0.313 13 F C 0.723 176.523 175.800 0.001 0.000 1.078 13 F CA -1.138 56.866 58.000 0.007 0.000 0.921 13 F CB 1.942 40.956 39.000 0.024 0.000 1.232 13 F HN 0.566 nan 8.300 nan 0.000 0.459 14 T N 1.810 116.474 114.554 0.182 0.000 2.937 14 T HA 0.120 4.455 4.350 -0.024 0.000 0.316 14 T C -0.206 174.551 174.700 0.095 0.000 1.079 14 T CA -0.252 61.908 62.100 0.100 0.000 1.131 14 T CB 0.174 69.082 68.868 0.066 0.000 1.000 14 T HN 0.372 nan 8.240 nan 0.000 0.549 15 K N 2.161 122.595 120.400 0.056 0.000 2.185 15 K HA 0.510 4.815 4.320 -0.024 0.000 0.269 15 K C -0.305 176.301 176.600 0.009 0.000 0.987 15 K CA -0.511 55.797 56.287 0.035 0.000 0.865 15 K CB 1.327 33.847 32.500 0.034 0.000 1.090 15 K HN 0.424 nan 8.250 nan 0.000 0.450 16 S N 1.049 116.742 115.700 -0.012 0.000 2.621 16 S HA 0.314 4.769 4.470 -0.024 0.000 0.302 16 S C 1.183 175.766 174.600 -0.028 0.000 1.093 16 S CA -0.636 57.548 58.200 -0.027 0.000 1.017 16 S CB 1.759 64.928 63.200 -0.052 0.000 1.077 16 S HN 0.744 nan 8.310 nan 0.000 0.517 17 A N 1.543 124.347 122.820 -0.026 0.000 1.915 17 A HA -0.153 4.153 4.320 -0.024 0.000 0.220 17 A C 1.160 178.726 177.584 -0.030 0.000 1.198 17 A CA 1.671 53.694 52.037 -0.023 0.000 0.647 17 A CB -0.225 18.762 19.000 -0.022 0.000 0.825 17 A HN 0.673 nan 8.150 nan 0.000 0.456 18 R N -1.839 118.634 120.500 -0.046 0.000 2.575 18 R HA 0.520 4.846 4.340 -0.024 0.000 0.293 18 R C -0.246 175.994 176.300 -0.100 0.000 0.983 18 R CA 0.305 56.370 56.100 -0.058 0.000 0.887 18 R CB 1.646 31.913 30.300 -0.055 0.000 1.184 18 R HN 0.463 nan 8.270 nan 0.000 0.445 19 G N 1.650 110.384 108.800 -0.109 0.000 2.634 19 G HA2 0.239 4.184 3.960 -0.024 0.000 0.309 19 G HA3 0.239 4.184 3.960 -0.024 0.000 0.309 19 G C -1.878 172.941 174.900 -0.135 0.000 1.299 19 G CA -0.535 44.445 45.100 -0.201 0.000 0.798 19 G HN 0.315 nan 8.290 nan 0.000 0.490 20 Y N 1.472 121.723 120.300 -0.081 0.000 2.359 20 Y HA 0.268 4.804 4.550 -0.024 0.000 0.330 20 Y C 1.094 176.954 175.900 -0.067 0.000 1.143 20 Y CA -1.140 56.906 58.100 -0.091 0.000 1.318 20 Y CB 0.731 39.107 38.460 -0.140 0.000 1.234 20 Y HN 0.416 nan 8.280 nan 0.000 0.522 21 D N 3.198 123.675 120.400 0.127 0.000 2.520 21 D HA -0.091 4.534 4.640 -0.024 0.000 0.243 21 D C 0.461 176.793 176.300 0.052 0.000 1.160 21 D CA 0.383 54.419 54.000 0.060 0.000 0.877 21 D CB 0.738 41.557 40.800 0.032 0.000 1.150 21 D HN 0.770 nan 8.370 nan 0.000 0.494 22 E N 2.676 122.907 120.200 0.051 0.000 2.077 22 E HA -0.175 4.160 4.350 -0.024 0.000 0.193 22 E C 1.191 177.825 176.600 0.056 0.000 0.989 22 E CA 0.916 57.352 56.400 0.060 0.000 0.800 22 E CB 0.201 29.939 29.700 0.062 0.000 0.746 22 E HN 0.533 nan 8.360 nan 0.000 0.452 23 D N 0.850 121.276 120.400 0.043 0.000 2.144 23 D HA -0.145 4.480 4.640 -0.024 0.000 0.199 23 D C 1.732 178.057 176.300 0.043 0.000 0.984 23 D CA 0.983 55.008 54.000 0.042 0.000 0.834 23 D CB -0.138 40.682 40.800 0.033 0.000 0.955 23 D HN 0.272 nan 8.370 nan 0.000 0.465 24 E N 0.265 120.481 120.200 0.027 0.000 2.047 24 E HA -0.097 4.238 4.350 -0.024 0.000 0.191 24 E C 2.334 178.953 176.600 0.033 0.000 0.987 24 E CA 0.531 56.939 56.400 0.014 0.000 0.799 24 E CB 0.119 29.798 29.700 -0.035 0.000 0.752 24 E HN 0.059 nan 8.360 nan 0.000 0.449 25 V N 1.922 121.844 119.914 0.013 0.000 2.295 25 V HA -0.308 3.798 4.120 -0.024 0.000 0.246 25 V C 1.748 177.917 176.094 0.126 0.000 1.049 25 V CA 2.184 64.503 62.300 0.031 0.000 1.024 25 V CB -0.696 31.110 31.823 -0.027 0.000 0.648 25 V HN 0.287 nan 8.190 nan 0.000 0.447 26 N N -0.292 118.475 118.700 0.112 0.000 2.120 26 N HA -0.197 4.528 4.740 -0.024 0.000 0.188 26 N C 1.831 177.402 175.510 0.102 0.000 1.024 26 N CA 1.416 54.534 53.050 0.113 0.000 0.852 26 N CB -0.149 38.390 38.487 0.087 0.000 1.003 26 N HN 0.594 nan 8.380 nan 0.000 0.424 27 E N 0.190 120.450 120.200 0.099 0.000 2.077 27 E HA -0.182 4.153 4.350 -0.024 0.000 0.193 27 E C 1.550 178.219 176.600 0.116 0.000 0.989 27 E CA 0.760 57.215 56.400 0.092 0.000 0.800 27 E CB -0.117 29.632 29.700 0.082 0.000 0.746 27 E HN 0.341 nan 8.360 nan 0.000 0.452 28 F N 1.325 121.272 119.950 -0.005 0.000 2.146 28 F HA -0.113 4.402 4.527 -0.020 0.000 0.298 28 F C 1.896 177.699 175.800 0.005 0.000 1.096 28 F CA 1.128 59.119 58.000 -0.014 0.000 1.275 28 F CB -0.076 38.894 39.000 -0.050 0.000 1.008 28 F HN -0.093 nan 8.300 nan 0.000 0.480 29 L N -0.283 120.961 121.223 0.035 0.000 2.191 29 L HA -0.173 4.153 4.340 -0.024 0.000 0.212 29 L C 2.697 179.533 176.870 -0.056 0.000 1.103 29 L CA 0.967 55.785 54.840 -0.036 0.000 0.769 29 L CB -1.025 41.094 42.059 0.101 0.000 0.908 29 L HN 0.247 nan 8.230 nan 0.000 0.438 30 A N -0.490 122.324 122.820 -0.010 0.000 1.930 30 A HA -0.263 4.042 4.320 -0.024 0.000 0.217 30 A C 2.268 179.822 177.584 -0.050 0.000 1.175 30 A CA 1.706 53.748 52.037 0.009 0.000 0.627 30 A CB -0.447 18.577 19.000 0.040 0.000 0.815 30 A HN 0.488 nan 8.150 nan 0.000 0.443 31 Q N -0.175 119.554 119.800 -0.117 0.000 2.046 31 Q HA -0.112 4.214 4.340 -0.024 0.000 0.200 31 Q C 1.927 177.805 176.000 -0.204 0.000 0.975 31 Q CA 1.902 57.614 55.803 -0.152 0.000 0.836 31 Q CB -0.208 28.425 28.738 -0.175 0.000 0.896 31 Q HN 0.371 nan 8.270 nan 0.000 0.428 32 V N 1.792 121.490 119.914 -0.360 0.000 2.332 32 V HA -0.286 3.819 4.120 -0.024 0.000 0.248 32 V C 2.661 178.698 176.094 -0.096 0.000 1.055 32 V CA 2.126 64.253 62.300 -0.288 0.000 1.038 32 V CB -0.908 30.680 31.823 -0.393 0.000 0.651 32 V HN 0.425 nan 8.190 nan 0.000 0.450 33 R N 0.870 121.328 120.500 -0.069 0.000 2.091 33 R HA -0.219 4.107 4.340 -0.024 0.000 0.238 33 R C 2.357 178.691 176.300 0.058 0.000 1.136 33 R CA 2.349 58.464 56.100 0.024 0.000 0.959 33 R CB -0.444 29.878 30.300 0.036 0.000 0.856 33 R HN 0.594 nan 8.270 nan 0.000 0.437 34 K N 0.212 120.619 120.400 0.011 0.000 1.991 34 K HA -0.171 4.135 4.320 -0.024 0.000 0.212 34 K C 1.578 178.190 176.600 0.019 0.000 1.049 34 K CA 2.140 58.432 56.287 0.008 0.000 0.932 34 K CB -0.201 32.292 32.500 -0.011 0.000 0.717 34 K HN 0.112 nan 8.250 nan 0.000 0.441 35 D N -0.281 120.127 120.400 0.012 0.000 2.117 35 D HA -0.190 4.436 4.640 -0.024 0.000 0.197 35 D C 1.795 178.131 176.300 0.061 0.000 0.987 35 D CA 1.134 55.146 54.000 0.020 0.000 0.829 35 D CB -0.504 40.298 40.800 0.003 0.000 0.961 35 D HN 0.340 nan 8.370 nan 0.000 0.460 36 Y N 1.510 121.783 120.300 -0.045 0.000 2.128 36 Y HA -0.263 4.284 4.550 -0.006 0.000 0.284 36 Y C 2.481 178.367 175.900 -0.024 0.000 1.154 36 Y CA 2.144 60.226 58.100 -0.031 0.000 1.149 36 Y CB 0.087 38.529 38.460 -0.030 0.000 0.976 36 Y HN -0.037 nan 8.280 nan 0.000 0.505 37 E N 0.158 120.393 120.200 0.060 0.000 2.110 37 E HA -0.222 4.113 4.350 -0.024 0.000 0.193 37 E C 2.079 178.634 176.600 -0.075 0.000 0.988 37 E CA 1.646 58.027 56.400 -0.031 0.000 0.804 37 E CB -0.311 29.403 29.700 0.023 0.000 0.745 37 E HN 0.628 nan 8.360 nan 0.000 0.458 38 I N 0.278 120.820 120.570 -0.046 0.000 2.179 38 I HA -0.263 3.893 4.170 -0.024 0.000 0.242 38 I C 2.318 178.391 176.117 -0.072 0.000 1.088 38 I CA 0.825 62.096 61.300 -0.047 0.000 1.357 38 I CB -0.123 37.861 38.000 -0.027 0.000 1.051 38 I HN 0.082 nan 8.210 nan 0.000 0.409 39 V N 0.494 120.353 119.914 -0.091 0.000 2.427 39 V HA -0.245 3.861 4.120 -0.024 0.000 0.248 39 V C 2.326 178.330 176.094 -0.151 0.000 1.051 39 V CA 1.332 63.570 62.300 -0.104 0.000 1.048 39 V CB -0.501 31.265 31.823 -0.096 0.000 0.666 39 V HN 0.344 nan 8.190 nan 0.000 0.456 40 L N 0.495 121.572 121.223 -0.244 0.000 2.017 40 L HA -0.147 4.178 4.340 -0.024 0.000 0.208 40 L C 2.554 179.336 176.870 -0.146 0.000 1.073 40 L CA 2.125 56.809 54.840 -0.260 0.000 0.745 40 L CB -0.794 41.027 42.059 -0.396 0.000 0.894 40 L HN 0.216 nan 8.230 nan 0.000 0.432 41 R N -0.513 119.918 120.500 -0.115 0.000 2.073 41 R HA -0.181 4.144 4.340 -0.024 0.000 0.234 41 R C 2.331 178.595 176.300 -0.060 0.000 1.134 41 R CA 1.743 57.799 56.100 -0.073 0.000 0.952 41 R CB -0.124 30.142 30.300 -0.057 0.000 0.850 41 R HN 0.344 nan 8.270 nan 0.000 0.433 42 K N 0.482 120.846 120.400 -0.060 0.000 2.032 42 K HA -0.228 4.078 4.320 -0.024 0.000 0.209 42 K C 2.154 178.726 176.600 -0.046 0.000 1.048 42 K CA 1.909 58.168 56.287 -0.047 0.000 0.927 42 K CB -0.184 32.291 32.500 -0.042 0.000 0.712 42 K HN 0.155 nan 8.250 nan 0.000 0.441 43 K N 0.904 121.268 120.400 -0.059 0.000 2.009 43 K HA -0.186 4.119 4.320 -0.024 0.000 0.210 43 K C 2.181 178.754 176.600 -0.045 0.000 1.049 43 K CA 2.251 58.506 56.287 -0.053 0.000 0.929 43 K CB -0.302 32.157 32.500 -0.068 0.000 0.714 43 K HN 0.281 nan 8.250 nan 0.000 0.440 44 T N -1.361 113.162 114.554 -0.052 0.000 2.788 44 T HA -0.103 4.233 4.350 -0.024 0.000 0.268 44 T C 1.647 176.328 174.700 -0.031 0.000 1.044 44 T CA 1.356 63.432 62.100 -0.040 0.000 1.139 44 T CB -0.256 68.586 68.868 -0.043 0.000 0.867 44 T HN 0.381 nan 8.240 nan 0.000 0.454 45 E N 0.602 120.783 120.200 -0.032 0.000 2.077 45 E HA -0.039 4.296 4.350 -0.024 0.000 0.193 45 E C 2.113 178.700 176.600 -0.021 0.000 0.989 45 E CA 0.943 57.328 56.400 -0.025 0.000 0.800 45 E CB -0.259 29.426 29.700 -0.025 0.000 0.746 45 E HN 0.291 nan 8.360 nan 0.000 0.452 46 L N 1.758 122.967 121.223 -0.023 0.000 2.027 46 L HA -0.167 4.159 4.340 -0.024 0.000 0.206 46 L C 1.929 178.789 176.870 -0.017 0.000 1.074 46 L CA 1.785 56.613 54.840 -0.019 0.000 0.745 46 L CB -0.381 41.666 42.059 -0.020 0.000 0.898 46 L HN 0.043 nan 8.230 nan 0.000 0.433 47 E N -0.705 119.484 120.200 -0.019 0.000 2.097 47 E HA -0.264 4.071 4.350 -0.024 0.000 0.196 47 E C 2.145 178.736 176.600 -0.014 0.000 1.000 47 E CA 1.267 57.657 56.400 -0.016 0.000 0.804 47 E CB -0.278 29.411 29.700 -0.018 0.000 0.740 47 E HN 0.636 nan 8.360 nan 0.000 0.454 48 A N 1.407 124.218 122.820 -0.015 0.000 1.902 48 A HA -0.219 4.087 4.320 -0.024 0.000 0.217 48 A C 1.921 179.499 177.584 -0.011 0.000 1.181 48 A CA 1.488 53.518 52.037 -0.013 0.000 0.623 48 A CB -0.245 18.747 19.000 -0.014 0.000 0.818 48 A HN 0.059 nan 8.150 nan 0.000 0.443 49 K N -0.447 119.946 120.400 -0.011 0.000 2.097 49 K HA -0.029 4.277 4.320 -0.024 0.000 0.205 49 K C 1.820 178.415 176.600 -0.009 0.000 1.050 49 K CA 1.279 57.560 56.287 -0.010 0.000 0.938 49 K CB -0.293 32.201 32.500 -0.010 0.000 0.718 49 K HN 0.304 nan 8.250 nan 0.000 0.442 50 V N 2.051 121.959 119.914 -0.009 0.000 2.358 50 V HA -0.260 3.846 4.120 -0.024 0.000 0.246 50 V C 1.678 177.768 176.094 -0.007 0.000 1.047 50 V CA 1.812 64.108 62.300 -0.008 0.000 1.035 50 V CB -0.695 31.123 31.823 -0.008 0.000 0.658 50 V HN 0.370 nan 8.190 nan 0.000 0.452 51 N N -0.028 118.668 118.700 -0.007 0.000 2.069 51 N HA -0.270 4.455 4.740 -0.024 0.000 0.191 51 N C 1.984 177.491 175.510 -0.006 0.000 1.031 51 N CA 1.591 54.638 53.050 -0.006 0.000 0.852 51 N CB -0.159 38.324 38.487 -0.007 0.000 1.018 51 N HN 0.608 nan 8.380 nan 0.000 0.423 52 E N 0.644 120.840 120.200 -0.006 0.000 2.110 52 E HA -0.178 4.158 4.350 -0.024 0.000 0.193 52 E C 1.977 178.574 176.600 -0.005 0.000 0.988 52 E CA 0.593 56.989 56.400 -0.006 0.000 0.804 52 E CB 0.064 29.760 29.700 -0.006 0.000 0.745 52 E HN 0.192 nan 8.360 nan 0.000 0.458 53 L N 1.304 122.524 121.223 -0.005 0.000 2.027 53 L HA -0.113 4.212 4.340 -0.024 0.000 0.206 53 L C 1.867 178.734 176.870 -0.004 0.000 1.074 53 L CA 2.355 57.193 54.840 -0.005 0.000 0.745 53 L CB -0.649 41.407 42.059 -0.005 0.000 0.898 53 L HN 0.125 nan 8.230 nan 0.000 0.433 54 D N -0.593 119.804 120.400 -0.004 0.000 2.123 54 D HA -0.237 4.388 4.640 -0.024 0.000 0.196 54 D C 1.942 178.240 176.300 -0.003 0.000 0.992 54 D CA 1.580 55.578 54.000 -0.004 0.000 0.833 54 D CB 0.007 40.805 40.800 -0.004 0.000 0.954 54 D HN 0.543 nan 8.370 nan 0.000 0.455 55 E N -0.544 119.654 120.200 -0.003 0.000 2.265 55 E HA -0.076 4.259 4.350 -0.024 0.000 0.196 55 E C 0.387 176.985 176.600 -0.003 0.000 0.996 55 E CA 0.246 56.644 56.400 -0.003 0.000 0.832 55 E CB 0.093 29.791 29.700 -0.003 0.000 0.756 55 E HN 0.053 nan 8.360 nan 0.000 0.491 56 R N 0.000 120.498 120.500 -0.003 0.000 2.786 56 R HA 0.000 4.325 4.340 -0.024 0.000 0.208 56 R CA 0.000 56.098 56.100 -0.003 0.000 0.921 56 R CB 0.000 30.298 30.300 -0.003 0.000 0.687 56 R HN 0.000 nan 8.270 nan 0.000 0.535