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 3hls_1_H DATA FIRST_RESID 345 DATA SEQUENCE SHXATRDLVL LGEQFREEYK LTQELEXLTD RLQLTLRALE DEKKKTDTLL DATA SEQUENCE YSVLPPSVAN ELR 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 345 S HA 0.000 nan 4.470 nan 0.000 0.327 345 S C 0.000 174.595 174.600 -0.008 0.000 1.055 345 S CA 0.000 58.222 58.200 0.036 0.000 1.107 345 S CB 0.000 63.216 63.200 0.027 0.000 0.593 349 T N 1.812 116.364 114.554 -0.002 0.000 2.665 349 T HA -0.209 4.142 4.350 0.000 0.000 0.268 349 T C 2.164 176.856 174.700 -0.014 0.000 1.035 349 T CA 2.046 64.143 62.100 -0.006 0.000 1.151 349 T CB -0.362 68.504 68.868 -0.003 0.000 0.862 349 T HN 0.783 nan 8.240 nan 0.000 0.438 350 R N 1.930 122.422 120.500 -0.014 0.000 2.133 350 R HA -0.154 4.186 4.340 0.000 0.000 0.247 350 R C 1.470 177.752 176.300 -0.029 0.000 1.151 350 R CA 1.829 57.918 56.100 -0.019 0.000 0.971 350 R CB -0.965 29.326 30.300 -0.015 0.000 0.866 350 R HN 0.414 nan 8.270 nan 0.000 0.447 351 D N 1.201 121.584 120.400 -0.027 0.000 2.162 351 D HA 0.026 4.667 4.640 0.000 0.000 0.203 351 D C 2.280 178.543 176.300 -0.062 0.000 0.967 351 D CA 0.615 54.592 54.000 -0.038 0.000 0.840 351 D CB -0.109 40.678 40.800 -0.023 0.000 0.972 351 D HN 0.184 nan 8.370 nan 0.000 0.482 352 L N 0.738 121.931 121.223 -0.050 0.000 2.079 352 L HA -0.142 4.198 4.340 0.000 0.000 0.210 352 L C 2.478 179.287 176.870 -0.101 0.000 1.081 352 L CA 0.813 55.612 54.840 -0.068 0.000 0.752 352 L CB -0.389 41.653 42.059 -0.030 0.000 0.896 352 L HN -0.040 nan 8.230 nan 0.000 0.433 353 V N -0.170 119.701 119.914 -0.073 0.000 2.488 353 V HA -0.212 3.908 4.120 0.000 0.000 0.246 353 V C 2.396 178.432 176.094 -0.096 0.000 1.046 353 V CA 1.086 63.344 62.300 -0.070 0.000 1.053 353 V CB -0.129 31.670 31.823 -0.039 0.000 0.679 353 V HN 0.323 nan 8.190 nan 0.000 0.458 354 L N -0.879 120.288 121.223 -0.093 0.000 2.083 354 L HA -0.197 4.143 4.340 0.000 0.000 0.209 354 L C 2.427 179.193 176.870 -0.174 0.000 1.083 354 L CA 1.145 55.925 54.840 -0.100 0.000 0.752 354 L CB -0.471 41.544 42.059 -0.073 0.000 0.899 354 L HN 0.313 nan 8.230 nan 0.000 0.433 355 L N 0.030 121.101 121.223 -0.254 0.000 2.056 355 L HA -0.076 4.264 4.340 0.000 0.000 0.207 355 L C 2.496 178.857 176.870 -0.849 0.000 1.078 355 L CA 2.019 56.554 54.840 -0.509 0.000 0.749 355 L CB -1.380 40.407 42.059 -0.453 0.000 0.901 355 L HN 0.175 nan 8.230 nan 0.000 0.433 356 G N -1.523 106.971 108.800 -0.510 0.000 2.450 356 G HA2 -0.254 3.706 3.960 0.000 0.000 0.220 356 G HA3 -0.254 3.706 3.960 0.000 0.000 0.220 356 G C 1.461 176.289 174.900 -0.120 0.000 1.130 356 G CA 0.581 45.514 45.100 -0.279 0.000 0.760 356 G HN 0.327 nan 8.290 nan 0.000 0.557 357 E N 0.100 120.228 120.200 -0.120 0.000 2.158 357 E HA 0.009 4.359 4.350 0.000 0.000 0.191 357 E C 2.725 179.316 176.600 -0.016 0.000 0.982 357 E CA 0.370 56.747 56.400 -0.038 0.000 0.823 357 E CB -0.214 29.465 29.700 -0.035 0.000 0.766 357 E HN 0.272 nan 8.360 nan 0.000 0.468 358 Q N -0.518 119.234 119.800 -0.080 0.000 2.079 358 Q HA -0.074 4.266 4.340 0.000 0.000 0.200 358 Q C 1.952 178.048 176.000 0.160 0.000 0.974 358 Q CA 0.829 56.631 55.803 -0.001 0.000 0.840 358 Q CB -0.308 28.404 28.738 -0.043 0.000 0.898 358 Q HN 0.300 nan 8.270 nan 0.000 0.430 359 F N 0.634 120.591 119.950 0.012 0.000 2.171 359 F HA -0.139 4.388 4.527 0.000 0.000 0.300 359 F C 2.501 178.334 175.800 0.056 0.000 1.090 359 F CA 1.006 59.001 58.000 -0.009 0.000 1.293 359 F CB -0.896 38.108 39.000 0.008 0.000 1.013 359 F HN 0.087 nan 8.300 nan 0.000 0.486 360 R N 0.930 121.617 120.500 0.312 0.000 2.073 360 R HA -0.136 4.204 4.340 0.000 0.000 0.234 360 R C 2.060 178.477 176.300 0.195 0.000 1.134 360 R CA 1.463 57.730 56.100 0.278 0.000 0.952 360 R CB -0.573 29.827 30.300 0.167 0.000 0.850 360 R HN 0.022 nan 8.270 nan 0.000 0.433 361 E N 0.860 121.138 120.200 0.130 0.000 2.114 361 E HA -0.238 4.112 4.350 0.000 0.000 0.199 361 E C 1.856 178.509 176.600 0.089 0.000 1.008 361 E CA 1.794 58.249 56.400 0.091 0.000 0.810 361 E CB -0.155 29.583 29.700 0.064 0.000 0.739 361 E HN 0.584 nan 8.360 nan 0.000 0.456 362 E N -0.575 119.678 120.200 0.088 0.000 2.047 362 E HA -0.158 4.192 4.350 0.000 0.000 0.191 362 E C 2.119 178.733 176.600 0.022 0.000 0.987 362 E CA 0.660 57.075 56.400 0.024 0.000 0.799 362 E CB -0.272 29.407 29.700 -0.034 0.000 0.752 362 E HN 0.266 nan 8.360 nan 0.000 0.449 363 Y N 1.711 122.036 120.300 0.042 0.000 2.151 363 Y HA -0.247 4.304 4.550 0.001 0.000 0.284 363 Y C 2.197 178.109 175.900 0.020 0.000 1.166 363 Y CA 1.465 59.580 58.100 0.025 0.000 1.163 363 Y CB -0.184 38.296 38.460 0.033 0.000 0.974 363 Y HN -0.063 nan 8.280 nan 0.000 0.511 364 K N -0.282 120.238 120.400 0.200 0.000 2.103 364 K HA -0.188 4.133 4.320 0.000 0.000 0.207 364 K C 2.023 178.672 176.600 0.081 0.000 1.048 364 K CA 1.591 57.946 56.287 0.113 0.000 0.930 364 K CB -0.448 32.102 32.500 0.083 0.000 0.716 364 K HN 0.300 nan 8.250 nan 0.000 0.444 365 L N 0.709 121.973 121.223 0.069 0.000 2.056 365 L HA -0.157 4.183 4.340 0.000 0.000 0.207 365 L C 2.741 179.634 176.870 0.038 0.000 1.078 365 L CA 1.568 56.433 54.840 0.042 0.000 0.749 365 L CB -0.899 41.176 42.059 0.027 0.000 0.901 365 L HN 0.380 nan 8.230 nan 0.000 0.433 366 T N -3.926 110.655 114.554 0.045 0.000 2.867 366 T HA -0.166 4.184 4.350 0.000 0.000 0.268 366 T C 1.849 176.584 174.700 0.059 0.000 1.057 366 T CA 0.626 62.750 62.100 0.040 0.000 1.136 366 T CB -0.155 68.729 68.868 0.026 0.000 0.874 366 T HN 0.208 nan 8.240 nan 0.000 0.466 367 Q N 1.077 120.925 119.800 0.081 0.000 2.084 367 Q HA -0.065 4.275 4.340 0.000 0.000 0.202 367 Q C 2.286 178.309 176.000 0.039 0.000 0.978 367 Q CA 1.601 57.442 55.803 0.062 0.000 0.844 367 Q CB -0.370 28.405 28.738 0.063 0.000 0.898 367 Q HN 0.771 nan 8.270 nan 0.000 0.426 368 E N 0.491 120.712 120.200 0.036 0.000 2.077 368 E HA -0.145 4.205 4.350 0.000 0.000 0.193 368 E C 2.181 178.793 176.600 0.020 0.000 0.989 368 E CA 0.518 56.933 56.400 0.025 0.000 0.800 368 E CB 0.010 29.724 29.700 0.024 0.000 0.746 368 E HN 0.259 nan 8.360 nan 0.000 0.452 369 L N 0.908 122.143 121.223 0.020 0.000 2.012 369 L HA -0.167 4.173 4.340 0.000 0.000 0.210 369 L C 1.490 178.369 176.870 0.014 0.000 1.073 369 L CA 1.049 55.898 54.840 0.014 0.000 0.748 369 L CB -0.479 41.587 42.059 0.011 0.000 0.891 369 L HN 0.152 nan 8.230 nan 0.000 0.431 373 T N -0.132 114.426 114.554 0.007 0.000 2.867 373 T HA -0.119 4.231 4.350 0.000 0.000 0.268 373 T C 1.146 175.850 174.700 0.006 0.000 1.057 373 T CA 1.729 63.832 62.100 0.006 0.000 1.136 373 T CB -0.123 68.748 68.868 0.006 0.000 0.874 373 T HN 0.205 nan 8.240 nan 0.000 0.466 374 D N 1.022 121.426 120.400 0.006 0.000 2.117 374 D HA -0.010 4.630 4.640 0.000 0.000 0.198 374 D C 2.371 178.674 176.300 0.005 0.000 0.982 374 D CA 0.889 54.893 54.000 0.006 0.000 0.828 374 D CB -0.190 40.613 40.800 0.006 0.000 0.967 374 D HN 0.271 nan 8.370 nan 0.000 0.464 375 R N -0.007 120.496 120.500 0.005 0.000 2.096 375 R HA -0.007 4.333 4.340 0.000 0.000 0.235 375 R C 2.483 178.785 176.300 0.004 0.000 1.127 375 R CA 0.448 56.551 56.100 0.005 0.000 0.968 375 R CB -0.201 30.102 30.300 0.005 0.000 0.861 375 R HN 0.203 nan 8.270 nan 0.000 0.440 376 L N 0.377 121.603 121.223 0.004 0.000 2.017 376 L HA -0.245 4.095 4.340 0.000 0.000 0.208 376 L C 2.497 179.369 176.870 0.004 0.000 1.073 376 L CA 1.558 56.401 54.840 0.004 0.000 0.745 376 L CB -0.330 41.731 42.059 0.004 0.000 0.894 376 L HN 0.286 nan 8.230 nan 0.000 0.432 377 Q N -0.452 119.350 119.800 0.004 0.000 2.079 377 Q HA -0.238 4.102 4.340 0.000 0.000 0.200 377 Q C 2.307 178.309 176.000 0.004 0.000 0.974 377 Q CA 1.377 57.183 55.803 0.004 0.000 0.840 377 Q CB -0.141 28.599 28.738 0.003 0.000 0.898 377 Q HN 0.455 nan 8.270 nan 0.000 0.430 378 L N 0.257 121.482 121.223 0.004 0.000 2.012 378 L HA -0.215 4.125 4.340 0.000 0.000 0.210 378 L C 2.113 178.985 176.870 0.003 0.000 1.073 378 L CA 1.532 56.374 54.840 0.004 0.000 0.748 378 L CB -0.334 41.727 42.059 0.004 0.000 0.891 378 L HN 0.194 nan 8.230 nan 0.000 0.431 379 T N 0.037 114.593 114.554 0.003 0.000 2.821 379 T HA -0.182 4.168 4.350 0.000 0.000 0.267 379 T C 1.889 176.591 174.700 0.004 0.000 1.046 379 T CA 1.438 63.540 62.100 0.003 0.000 1.139 379 T CB -0.240 68.630 68.868 0.003 0.000 0.871 379 T HN 0.287 nan 8.240 nan 0.000 0.454 380 L N 0.642 121.867 121.223 0.004 0.000 2.056 380 L HA -0.087 4.253 4.340 0.000 0.000 0.207 380 L C 2.888 179.761 176.870 0.004 0.000 1.078 380 L CA 1.179 56.021 54.840 0.004 0.000 0.749 380 L CB -0.196 41.865 42.059 0.004 0.000 0.901 380 L HN 0.131 nan 8.230 nan 0.000 0.433 381 R N -0.071 120.431 120.500 0.004 0.000 2.091 381 R HA -0.145 4.195 4.340 0.000 0.000 0.238 381 R C 2.160 178.463 176.300 0.005 0.000 1.136 381 R CA 1.463 57.565 56.100 0.004 0.000 0.959 381 R CB -1.026 29.276 30.300 0.004 0.000 0.856 381 R HN 0.371 nan 8.270 nan 0.000 0.437 382 A N 1.209 124.032 122.820 0.004 0.000 1.972 382 A HA -0.127 4.194 4.320 0.000 0.000 0.219 382 A C 2.208 179.794 177.584 0.005 0.000 1.169 382 A CA 1.043 53.083 52.037 0.004 0.000 0.635 382 A CB -0.408 18.594 19.000 0.004 0.000 0.810 382 A HN 0.216 nan 8.150 nan 0.000 0.446 383 L N 0.041 121.267 121.223 0.005 0.000 2.109 383 L HA -0.074 4.266 4.340 0.000 0.000 0.207 383 L C 2.102 178.976 176.870 0.007 0.000 1.086 383 L CA 2.247 57.090 54.840 0.005 0.000 0.760 383 L CB -0.589 41.472 42.059 0.005 0.000 0.910 383 L HN 0.504 nan 8.230 nan 0.000 0.437 384 E N -0.472 119.732 120.200 0.007 0.000 2.077 384 E HA -0.216 4.135 4.350 0.000 0.000 0.193 384 E C 1.723 178.329 176.600 0.009 0.000 0.989 384 E CA 1.375 57.780 56.400 0.008 0.000 0.800 384 E CB -0.170 29.535 29.700 0.007 0.000 0.746 384 E HN 0.541 nan 8.360 nan 0.000 0.452 385 D N 0.719 121.124 120.400 0.008 0.000 2.097 385 D HA -0.140 4.501 4.640 0.000 0.000 0.197 385 D C 1.884 178.190 176.300 0.010 0.000 0.984 385 D CA 0.808 54.814 54.000 0.009 0.000 0.826 385 D CB -0.139 40.666 40.800 0.007 0.000 0.973 385 D HN 0.118 nan 8.370 nan 0.000 0.460 386 E N 1.135 121.340 120.200 0.008 0.000 2.058 386 E HA -0.160 4.190 4.350 0.000 0.000 0.194 386 E C 2.027 178.633 176.600 0.009 0.000 0.997 386 E CA 0.795 57.200 56.400 0.007 0.000 0.801 386 E CB -0.153 29.550 29.700 0.005 0.000 0.746 386 E HN 0.383 nan 8.360 nan 0.000 0.450 387 K N 0.742 121.149 120.400 0.011 0.000 2.097 387 K HA -0.149 4.171 4.320 0.000 0.000 0.206 387 K C 2.253 178.867 176.600 0.024 0.000 1.049 387 K CA 1.032 57.329 56.287 0.015 0.000 0.933 387 K CB -0.120 32.390 32.500 0.015 0.000 0.717 387 K HN -0.018 nan 8.250 nan 0.000 0.442 388 K N 1.677 122.091 120.400 0.023 0.000 2.057 388 K HA -0.174 4.146 4.320 0.000 0.000 0.207 388 K C 2.160 178.779 176.600 0.032 0.000 1.049 388 K CA 1.368 57.673 56.287 0.030 0.000 0.931 388 K CB 0.053 32.567 32.500 0.022 0.000 0.714 388 K HN -0.044 nan 8.250 nan 0.000 0.440 389 K N -0.068 120.345 120.400 0.022 0.000 2.032 389 K HA -0.140 4.181 4.320 0.000 0.000 0.209 389 K C 1.835 178.445 176.600 0.017 0.000 1.048 389 K CA 2.049 58.347 56.287 0.019 0.000 0.927 389 K CB -0.129 32.378 32.500 0.011 0.000 0.712 389 K HN 0.173 nan 8.250 nan 0.000 0.441 390 T N 1.366 115.928 114.554 0.012 0.000 2.684 390 T HA -0.187 4.164 4.350 0.000 0.000 0.267 390 T C 1.530 176.231 174.700 0.003 0.000 1.036 390 T CA 1.621 63.721 62.100 0.000 0.000 1.148 390 T CB -0.423 68.443 68.868 -0.003 0.000 0.863 390 T HN 0.393 nan 8.240 nan 0.000 0.436 391 D N 0.500 120.923 120.400 0.039 0.000 2.117 391 D HA -0.120 4.520 4.640 0.000 0.000 0.197 391 D C 2.005 178.396 176.300 0.153 0.000 0.987 391 D CA 1.284 55.344 54.000 0.101 0.000 0.829 391 D CB -0.001 40.885 40.800 0.144 0.000 0.961 391 D HN 0.296 nan 8.370 nan 0.000 0.460 392 T N 1.441 116.060 114.554 0.108 0.000 2.746 392 T HA -0.106 4.244 4.350 0.000 0.000 0.267 392 T C 1.990 176.730 174.700 0.066 0.000 1.039 392 T CA 0.241 62.406 62.100 0.107 0.000 1.142 392 T CB -0.239 68.668 68.868 0.064 0.000 0.866 392 T HN 0.176 nan 8.240 nan 0.000 0.444 393 L N 0.709 121.943 121.223 0.019 0.000 1.990 393 L HA -0.129 4.211 4.340 0.000 0.000 0.213 393 L C 2.459 179.296 176.870 -0.054 0.000 1.072 393 L CA 1.620 56.453 54.840 -0.012 0.000 0.755 393 L CB -0.469 41.577 42.059 -0.021 0.000 0.889 393 L HN 0.277 nan 8.230 nan 0.000 0.432 394 L N -0.752 120.393 121.223 -0.130 0.000 2.012 394 L HA -0.281 4.059 4.340 0.000 0.000 0.210 394 L C 2.278 178.941 176.870 -0.346 0.000 1.073 394 L CA 1.982 56.647 54.840 -0.292 0.000 0.748 394 L CB -0.861 40.912 42.059 -0.476 0.000 0.891 394 L HN 0.198 nan 8.230 nan 0.000 0.431 395 Y N -0.283 120.017 120.300 0.000 0.000 2.314 395 Y HA -0.107 4.443 4.550 0.000 0.000 0.293 395 Y C 2.907 178.807 175.900 -0.000 0.000 1.129 395 Y CA 1.166 59.266 58.100 -0.000 0.000 1.201 395 Y CB -0.974 37.486 38.460 -0.000 0.000 0.999 395 Y HN 0.465 nan 8.280 nan 0.000 0.541 396 S N -1.384 114.372 115.700 0.095 0.000 2.481 396 S HA -0.061 4.410 4.470 0.000 0.000 0.231 396 S C 1.643 176.259 174.600 0.027 0.000 0.996 396 S CA 0.913 59.148 58.200 0.058 0.000 0.942 396 S CB -0.662 62.563 63.200 0.042 0.000 0.768 396 S HN 0.183 nan 8.310 nan 0.000 0.520 397 V N 1.030 120.946 119.914 0.002 0.000 3.647 397 V HA 0.401 4.521 4.120 0.000 0.000 0.279 397 V C 0.422 176.511 176.094 -0.008 0.000 1.314 397 V CA 0.261 62.554 62.300 -0.012 0.000 1.125 397 V CB -0.357 31.445 31.823 -0.035 0.000 0.907 397 V HN 0.453 nan 8.190 nan 0.000 0.434 398 L N 0.575 121.803 121.223 0.009 0.000 2.334 398 L HA 0.500 4.840 4.340 0.000 0.000 0.270 398 L C -2.353 174.538 176.870 0.034 0.000 1.018 398 L CA -2.052 52.799 54.840 0.019 0.000 0.811 398 L CB 1.095 43.175 42.059 0.035 0.000 1.271 398 L HN -0.032 nan 8.230 nan 0.000 0.443 399 P HA 0.086 nan 4.420 nan 0.000 0.265 399 P C -2.150 175.172 177.300 0.037 0.000 1.193 399 P CA -0.956 62.160 63.100 0.027 0.000 0.765 399 P CB 0.125 31.837 31.700 0.020 0.000 0.823 400 P HA -0.233 nan 4.420 nan 0.000 0.216 400 P C 1.549 178.867 177.300 0.030 0.000 1.150 400 P CA 1.775 64.895 63.100 0.033 0.000 0.843 400 P CB -0.284 31.429 31.700 0.022 0.000 0.787 401 S N -1.384 114.330 115.700 0.024 0.000 2.400 401 S HA -0.134 4.336 4.470 0.000 0.000 0.232 401 S C 1.849 176.465 174.600 0.027 0.000 1.025 401 S CA 1.707 59.919 58.200 0.020 0.000 0.993 401 S CB -1.622 61.587 63.200 0.015 0.000 0.808 401 S HN 0.019 nan 8.310 nan 0.000 0.478 402 V N 1.677 121.614 119.914 0.038 0.000 2.685 402 V HA 0.213 4.333 4.120 0.000 0.000 0.244 402 V C 3.043 179.187 176.094 0.083 0.000 1.054 402 V CA 0.967 63.297 62.300 0.050 0.000 1.076 402 V CB -1.221 30.628 31.823 0.044 0.000 0.725 402 V HN 0.617 nan 8.190 nan 0.000 0.467 403 A N 1.110 123.995 122.820 0.107 0.000 1.898 403 A HA -0.228 4.092 4.320 0.000 0.000 0.216 403 A C 1.980 179.599 177.584 0.058 0.000 1.181 403 A CA 2.331 54.478 52.037 0.184 0.000 0.620 403 A CB -0.732 18.391 19.000 0.205 0.000 0.819 403 A HN 0.673 nan 8.150 nan 0.000 0.442 404 N N -0.776 117.935 118.700 0.018 0.000 2.354 404 N HA -0.060 4.680 4.740 0.000 0.000 0.179 404 N C 1.635 177.134 175.510 -0.017 0.000 1.021 404 N CA 0.790 53.826 53.050 -0.025 0.000 0.887 404 N CB -0.076 38.401 38.487 -0.017 0.000 0.974 404 N HN 0.626 nan 8.380 nan 0.000 0.437 405 E N 0.352 120.557 120.200 0.008 0.000 2.478 405 E HA -0.079 4.271 4.350 0.000 0.000 0.198 405 E C 1.157 177.768 176.600 0.018 0.000 1.046 405 E CA 0.445 56.852 56.400 0.011 0.000 0.870 405 E CB 0.210 29.922 29.700 0.019 0.000 0.818 405 E HN 0.302 nan 8.360 nan 0.000 0.527 406 L N -0.283 120.957 121.223 0.027 0.000 2.575 406 L HA 0.218 4.558 4.340 0.000 0.000 0.228 406 L C 0.889 177.748 176.870 -0.019 0.000 1.075 406 L CA 0.158 55.030 54.840 0.053 0.000 0.867 406 L CB 0.372 42.537 42.059 0.178 0.000 1.097 406 L HN -0.147 nan 8.230 nan 0.000 0.485 407 R N 0.000 120.435 120.500 -0.108 0.000 2.786 407 R HA 0.000 4.340 4.340 0.000 0.000 0.208 407 R CA 0.000 55.992 56.100 -0.180 0.000 0.921 407 R CB 0.000 30.101 30.300 -0.332 0.000 0.687 407 R HN 0.000 nan 8.270 nan 0.000 0.535