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 1rm1_1_C DATA FIRST_RESID 2 DATA SEQUENCE SNAEASRVYE IIVESVVNEV REDFENAGID EQTLQDLKNI WQKKLTETKV DATA SEQUENCE TTFSWDNQFN XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX XXXXXXXXXX DATA SEQUENCE XXXXXXXXXX XXXXXXXXXX XXXXXXDYLI SXXXEDGPDE NLMLCLYDKV DATA SEQUENCE TRTKARWKCS LKDGVVTINR NDYTFQKAQV EAEWV 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 S HA 0.000 nan 4.470 nan 0.000 0.327 2 S C 0.000 174.477 174.600 -0.205 0.000 1.055 2 S CA 0.000 58.075 58.200 -0.208 0.000 1.107 2 S CB 0.000 63.069 63.200 -0.218 0.000 0.593 3 N N 1.405 119.932 118.700 -0.289 0.000 2.424 3 N HA 0.708 5.448 4.740 0.000 0.000 0.271 3 N C 0.499 175.871 175.510 -0.229 0.000 0.985 3 N CA 0.456 53.366 53.050 -0.233 0.000 0.921 3 N CB 1.503 39.806 38.487 -0.306 0.000 1.149 3 N HN 0.305 nan 8.380 nan 0.000 0.492 4 A N 3.148 125.877 122.820 -0.152 0.000 1.858 4 A HA -0.161 4.159 4.320 0.000 0.000 0.216 4 A C 1.861 179.367 177.584 -0.129 0.000 1.190 4 A CA 1.607 53.560 52.037 -0.140 0.000 0.617 4 A CB -0.793 18.153 19.000 -0.090 0.000 0.827 4 A HN 0.865 nan 8.150 nan 0.000 0.443 5 E N -0.076 120.071 120.200 -0.088 0.000 2.049 5 E HA -0.197 4.153 4.350 0.000 0.000 0.198 5 E C 2.138 178.675 176.600 -0.106 0.000 1.007 5 E CA 1.474 57.837 56.400 -0.062 0.000 0.809 5 E CB -0.338 29.353 29.700 -0.014 0.000 0.749 5 E HN 0.509 nan 8.360 nan 0.000 0.450 6 A N 0.451 123.161 122.820 -0.184 0.000 1.883 6 A HA -0.222 4.098 4.320 0.000 0.000 0.217 6 A C 2.416 179.748 177.584 -0.420 0.000 1.186 6 A CA 2.059 53.885 52.037 -0.351 0.000 0.624 6 A CB -0.807 17.904 19.000 -0.482 0.000 0.822 6 A HN 0.331 nan 8.150 nan 0.000 0.444 7 S N -0.949 114.538 115.700 -0.356 0.000 2.353 7 S HA -0.221 4.249 4.470 0.000 0.000 0.222 7 S C 2.108 176.669 174.600 -0.064 0.000 1.035 7 S CA 1.668 59.694 58.200 -0.289 0.000 1.025 7 S CB -0.364 62.625 63.200 -0.351 0.000 0.902 7 S HN 0.664 nan 8.310 nan 0.000 0.440 8 R N 0.678 121.136 120.500 -0.069 0.000 2.083 8 R HA -0.099 4.241 4.340 0.000 0.000 0.237 8 R C 2.126 178.463 176.300 0.062 0.000 1.137 8 R CA 1.553 57.651 56.100 -0.002 0.000 0.951 8 R CB -0.529 29.760 30.300 -0.018 0.000 0.851 8 R HN 0.255 nan 8.270 nan 0.000 0.434 9 V N 0.189 120.142 119.914 0.066 0.000 2.343 9 V HA -0.263 3.857 4.120 0.000 0.000 0.247 9 V C 2.024 178.291 176.094 0.288 0.000 1.051 9 V CA 1.635 64.021 62.300 0.144 0.000 1.036 9 V CB -0.669 31.238 31.823 0.139 0.000 0.654 9 V HN 0.347 nan 8.190 nan 0.000 0.451 10 Y N 0.932 121.280 120.300 0.080 0.000 2.200 10 Y HA -0.134 4.416 4.550 0.000 0.000 0.290 10 Y C 2.634 178.564 175.900 0.050 0.000 1.137 10 Y CA 1.017 59.176 58.100 0.098 0.000 1.163 10 Y CB -0.720 37.903 38.460 0.271 0.000 0.988 10 Y HN 0.409 nan 8.280 nan 0.000 0.518 11 E N -0.266 120.107 120.200 0.289 0.000 2.106 11 E HA -0.165 4.185 4.350 0.000 0.000 0.192 11 E C 2.245 178.906 176.600 0.103 0.000 0.984 11 E CA 1.291 57.840 56.400 0.248 0.000 0.806 11 E CB -0.316 29.510 29.700 0.211 0.000 0.750 11 E HN 0.444 nan 8.360 nan 0.000 0.458 12 I N 1.075 121.696 120.570 0.084 0.000 2.315 12 I HA -0.245 3.925 4.170 0.000 0.000 0.248 12 I C 2.403 178.524 176.117 0.007 0.000 1.117 12 I CA 0.913 62.239 61.300 0.043 0.000 1.404 12 I CB -0.180 37.850 38.000 0.050 0.000 1.071 12 I HN 0.076 nan 8.210 nan 0.000 0.419 13 I N 0.430 121.001 120.570 0.002 0.000 2.179 13 I HA -0.257 3.913 4.170 0.000 0.000 0.242 13 I C 2.702 178.730 176.117 -0.148 0.000 1.088 13 I CA 1.630 62.913 61.300 -0.028 0.000 1.357 13 I CB -0.394 37.602 38.000 -0.006 0.000 1.051 13 I HN 0.193 nan 8.210 nan 0.000 0.409 14 V N -0.575 119.077 119.914 -0.436 0.000 2.358 14 V HA -0.190 3.930 4.120 0.000 0.000 0.246 14 V C 2.274 178.184 176.094 -0.307 0.000 1.047 14 V CA 1.682 63.484 62.300 -0.830 0.000 1.035 14 V CB -0.581 30.474 31.823 -1.279 0.000 0.658 14 V HN 0.336 nan 8.190 nan 0.000 0.452 15 E N 0.948 121.045 120.200 -0.171 0.000 2.106 15 E HA -0.088 4.262 4.350 0.000 0.000 0.192 15 E C 2.481 179.062 176.600 -0.032 0.000 0.984 15 E CA 1.639 57.993 56.400 -0.076 0.000 0.806 15 E CB -0.433 29.249 29.700 -0.029 0.000 0.750 15 E HN 0.704 nan 8.360 nan 0.000 0.458 16 S N 0.460 116.151 115.700 -0.016 0.000 2.387 16 S HA -0.068 4.402 4.470 0.000 0.000 0.226 16 S C 2.229 176.853 174.600 0.040 0.000 1.026 16 S CA 0.677 58.885 58.200 0.014 0.000 0.972 16 S CB -0.041 63.172 63.200 0.022 0.000 0.814 16 S HN 0.037 nan 8.310 nan 0.000 0.477 17 V N 1.488 121.454 119.914 0.086 0.000 2.358 17 V HA -0.118 4.002 4.120 0.000 0.000 0.246 17 V C 2.281 178.437 176.094 0.104 0.000 1.047 17 V CA 1.300 63.691 62.300 0.153 0.000 1.035 17 V CB -0.651 31.391 31.823 0.365 0.000 0.658 17 V HN 0.323 nan 8.190 nan 0.000 0.452 18 V N 0.724 120.686 119.914 0.081 0.000 2.392 18 V HA -0.245 3.875 4.120 0.000 0.000 0.249 18 V C 2.290 178.347 176.094 -0.063 0.000 1.059 18 V CA 2.071 64.358 62.300 -0.021 0.000 1.051 18 V CB -0.783 31.011 31.823 -0.047 0.000 0.658 18 V HN 0.585 nan 8.190 nan 0.000 0.455 19 N N -0.142 118.543 118.700 -0.026 0.000 2.216 19 N HA -0.100 4.640 4.740 0.000 0.000 0.183 19 N C 1.803 177.309 175.510 -0.008 0.000 1.017 19 N CA 0.975 54.011 53.050 -0.024 0.000 0.861 19 N CB -0.163 38.318 38.487 -0.011 0.000 0.986 19 N HN 0.519 nan 8.380 nan 0.000 0.428 20 E N 0.554 120.761 120.200 0.012 0.000 2.208 20 E HA -0.067 4.283 4.350 0.000 0.000 0.193 20 E C 1.866 178.488 176.600 0.037 0.000 0.988 20 E CA 0.693 57.109 56.400 0.026 0.000 0.828 20 E CB -0.021 29.701 29.700 0.037 0.000 0.763 20 E HN 0.369 nan 8.360 nan 0.000 0.478 21 V N -1.274 118.661 119.914 0.036 0.000 3.650 21 V HA 0.185 4.305 4.120 0.000 0.000 0.271 21 V C 2.233 178.377 176.094 0.083 0.000 1.281 21 V CA 0.473 62.830 62.300 0.095 0.000 1.120 21 V CB -0.197 31.722 31.823 0.161 0.000 0.856 21 V HN -0.011 nan 8.190 nan 0.000 0.443 22 R N 1.217 121.693 120.500 -0.040 0.000 2.117 22 R HA -0.246 4.094 4.340 0.000 0.000 0.243 22 R C 2.268 178.604 176.300 0.060 0.000 1.143 22 R CA 2.280 58.340 56.100 -0.066 0.000 0.968 22 R CB -0.315 29.940 30.300 -0.075 0.000 0.863 22 R HN 0.758 nan 8.270 nan 0.000 0.444 23 E N -0.207 120.030 120.200 0.062 0.000 2.150 23 E HA -0.180 4.170 4.350 0.000 0.000 0.193 23 E C 0.929 177.587 176.600 0.098 0.000 0.985 23 E CA 1.391 57.832 56.400 0.067 0.000 0.814 23 E CB 0.107 29.833 29.700 0.044 0.000 0.752 23 E HN 0.429 nan 8.360 nan 0.000 0.466 24 D N -0.526 119.960 120.400 0.144 0.000 2.213 24 D HA -0.083 4.557 4.640 0.000 0.000 0.205 24 D C 1.546 177.939 176.300 0.155 0.000 0.961 24 D CA 0.475 54.553 54.000 0.130 0.000 0.853 24 D CB -0.076 40.797 40.800 0.122 0.000 0.967 24 D HN 0.198 nan 8.370 nan 0.000 0.496 25 F N 2.058 122.002 119.950 -0.010 0.000 2.113 25 F HA -0.073 4.454 4.527 0.000 0.000 0.297 25 F C 2.428 178.223 175.800 -0.009 0.000 1.103 25 F CA 0.972 58.965 58.000 -0.011 0.000 1.248 25 F CB -0.429 38.565 39.000 -0.009 0.000 0.999 25 F HN -0.087 nan 8.300 nan 0.000 0.475 26 E N -0.368 119.952 120.200 0.199 0.000 2.118 26 E HA -0.255 4.095 4.350 0.000 0.000 0.195 26 E C 1.976 178.610 176.600 0.057 0.000 0.992 26 E CA 1.156 57.617 56.400 0.102 0.000 0.804 26 E CB -0.420 29.324 29.700 0.074 0.000 0.741 26 E HN 0.332 nan 8.360 nan 0.000 0.458 27 N N 0.293 119.024 118.700 0.051 0.000 2.459 27 N HA -0.077 4.663 4.740 0.000 0.000 0.181 27 N C 1.169 176.676 175.510 -0.004 0.000 1.046 27 N CA 0.894 53.957 53.050 0.021 0.000 0.904 27 N CB 0.218 38.718 38.487 0.021 0.000 0.964 27 N HN 0.093 nan 8.380 nan 0.000 0.444 28 A N -0.662 122.146 122.820 -0.020 0.000 2.348 28 A HA 0.418 4.738 4.320 0.000 0.000 0.224 28 A C 1.363 178.914 177.584 -0.054 0.000 1.227 28 A CA 0.712 52.711 52.037 -0.063 0.000 0.885 28 A CB 0.020 18.936 19.000 -0.140 0.000 0.933 28 A HN 0.324 nan 8.150 nan 0.000 0.506 29 G N -0.626 108.162 108.800 -0.019 0.000 2.175 29 G HA2 -0.178 3.782 3.960 0.000 0.000 0.244 29 G HA3 -0.178 3.782 3.960 0.000 0.000 0.244 29 G C -0.004 174.896 174.900 -0.001 0.000 0.982 29 G CA 0.150 45.244 45.100 -0.009 0.000 0.641 29 G HN 0.336 nan 8.290 nan 0.000 0.527 30 I N 2.640 123.207 120.570 -0.005 0.000 2.395 30 I HA 0.335 4.505 4.170 0.000 0.000 0.289 30 I C 0.609 176.814 176.117 0.147 0.000 1.023 30 I CA -1.000 60.319 61.300 0.032 0.000 1.350 30 I CB 0.413 38.355 38.000 -0.097 0.000 1.409 30 I HN 0.402 nan 8.210 nan 0.000 0.507 31 D N 3.683 124.155 120.400 0.121 0.000 2.354 31 D HA 0.079 4.719 4.640 0.000 0.000 0.247 31 D C 0.895 177.268 176.300 0.122 0.000 1.138 31 D CA -0.477 53.586 54.000 0.105 0.000 0.958 31 D CB 1.041 41.876 40.800 0.059 0.000 1.144 31 D HN 0.502 nan 8.370 nan 0.000 0.458 32 E N -0.238 119.998 120.200 0.059 0.000 2.147 32 E HA -0.340 4.010 4.350 0.000 0.000 0.199 32 E C 1.747 178.345 176.600 -0.003 0.000 1.005 32 E CA 1.637 58.040 56.400 0.006 0.000 0.810 32 E CB -0.164 29.531 29.700 -0.009 0.000 0.736 32 E HN 0.549 nan 8.360 nan 0.000 0.460 33 Q N -0.344 119.469 119.800 0.022 0.000 2.124 33 Q HA -0.102 4.238 4.340 0.000 0.000 0.202 33 Q C 2.009 178.031 176.000 0.037 0.000 0.977 33 Q CA 2.394 58.208 55.803 0.018 0.000 0.850 33 Q CB -0.732 28.019 28.738 0.021 0.000 0.901 33 Q HN 0.360 nan 8.270 nan 0.000 0.429 34 T N 0.925 115.531 114.554 0.087 0.000 2.821 34 T HA -0.119 4.231 4.350 0.000 0.000 0.267 34 T C 1.556 176.354 174.700 0.163 0.000 1.046 34 T CA 1.087 63.275 62.100 0.146 0.000 1.139 34 T CB -0.327 68.669 68.868 0.214 0.000 0.871 34 T HN 0.236 nan 8.240 nan 0.000 0.454 35 L N 1.322 122.561 121.223 0.027 0.000 2.017 35 L HA -0.071 4.269 4.340 0.000 0.000 0.208 35 L C 2.390 179.157 176.870 -0.173 0.000 1.073 35 L CA 1.753 56.367 54.840 -0.376 0.000 0.745 35 L CB -0.816 40.826 42.059 -0.695 0.000 0.894 35 L HN 0.068 nan 8.230 nan 0.000 0.432 36 Q N -0.238 119.505 119.800 -0.096 0.000 2.084 36 Q HA -0.203 4.137 4.340 0.000 0.000 0.202 36 Q C 2.022 178.008 176.000 -0.024 0.000 0.978 36 Q CA 1.746 57.514 55.803 -0.059 0.000 0.844 36 Q CB -0.625 28.089 28.738 -0.040 0.000 0.898 36 Q HN 0.564 nan 8.270 nan 0.000 0.426 37 D N 0.498 120.902 120.400 0.005 0.000 2.123 37 D HA -0.153 4.487 4.640 0.000 0.000 0.196 37 D C 1.994 178.311 176.300 0.028 0.000 0.992 37 D CA 0.631 54.646 54.000 0.024 0.000 0.833 37 D CB -0.248 40.576 40.800 0.040 0.000 0.954 37 D HN 0.134 nan 8.370 nan 0.000 0.455 38 L N 1.388 122.636 121.223 0.041 0.000 2.012 38 L HA -0.160 4.180 4.340 0.000 0.000 0.210 38 L C 2.006 178.924 176.870 0.081 0.000 1.073 38 L CA 1.891 56.762 54.840 0.052 0.000 0.748 38 L CB -0.597 41.509 42.059 0.078 0.000 0.891 38 L HN -0.115 nan 8.230 nan 0.000 0.431 39 K N -0.378 120.052 120.400 0.050 0.000 2.063 39 K HA -0.214 4.106 4.320 0.000 0.000 0.208 39 K C 1.873 178.422 176.600 -0.084 0.000 1.048 39 K CA 2.070 58.368 56.287 0.018 0.000 0.928 39 K CB -0.243 32.212 32.500 -0.076 0.000 0.713 39 K HN 0.619 nan 8.250 nan 0.000 0.442 40 N N 0.422 119.093 118.700 -0.049 0.000 2.084 40 N HA -0.147 4.593 4.740 0.000 0.000 0.190 40 N C 1.988 177.469 175.510 -0.047 0.000 1.030 40 N CA 1.500 54.540 53.050 -0.017 0.000 0.849 40 N CB -0.165 38.355 38.487 0.055 0.000 1.012 40 N HN 0.156 nan 8.380 nan 0.000 0.423 41 I N -0.161 120.401 120.570 -0.014 0.000 2.286 41 I HA -0.231 3.939 4.170 0.000 0.000 0.248 41 I C 2.233 178.323 176.117 -0.044 0.000 1.115 41 I CA 0.761 62.041 61.300 -0.033 0.000 1.392 41 I CB -0.272 37.722 38.000 -0.010 0.000 1.065 41 I HN 0.367 nan 8.210 nan 0.000 0.418 42 W N 2.197 123.348 121.300 -0.248 0.000 2.355 42 W HA -0.204 4.456 4.660 0.000 0.000 0.309 42 W C 2.526 178.784 176.519 -0.434 0.000 1.206 42 W CA 1.488 58.661 57.345 -0.287 0.000 1.284 42 W CB -0.716 28.584 29.460 -0.266 0.000 1.145 42 W HN 0.195 nan 8.180 nan 0.000 0.502 43 Q N -0.079 119.423 119.800 -0.496 0.000 2.050 43 Q HA -0.241 4.099 4.340 0.000 0.000 0.202 43 Q C 2.323 177.821 176.000 -0.837 0.000 0.980 43 Q CA 2.084 57.243 55.803 -1.074 0.000 0.840 43 Q CB -0.502 27.326 28.738 -1.517 0.000 0.898 43 Q HN 0.244 nan 8.270 nan 0.000 0.424 44 K N 0.726 120.570 120.400 -0.926 0.000 2.009 44 K HA -0.193 4.127 4.320 0.000 0.000 0.210 44 K C 1.930 178.295 176.600 -0.392 0.000 1.049 44 K CA 1.159 56.838 56.287 -1.013 0.000 0.929 44 K CB 0.140 32.260 32.500 -0.634 0.000 0.714 44 K HN -0.049 nan 8.250 nan 0.000 0.440 45 K N 0.988 121.262 120.400 -0.211 0.000 2.044 45 K HA -0.168 4.152 4.320 0.000 0.000 0.210 45 K C 2.258 178.853 176.600 -0.009 0.000 1.049 45 K CA 1.293 57.541 56.287 -0.065 0.000 0.927 45 K CB -0.601 31.895 32.500 -0.007 0.000 0.713 45 K HN 0.271 nan 8.250 nan 0.000 0.443 46 L N 0.899 122.104 121.223 -0.029 0.000 2.042 46 L HA -0.204 4.136 4.340 0.000 0.000 0.210 46 L C 2.449 179.449 176.870 0.217 0.000 1.076 46 L CA 1.553 56.414 54.840 0.036 0.000 0.749 46 L CB -0.780 41.133 42.059 -0.244 0.000 0.893 46 L HN 0.223 nan 8.230 nan 0.000 0.432 47 T N -0.950 113.714 114.554 0.184 0.000 2.788 47 T HA -0.192 4.158 4.350 0.000 0.000 0.268 47 T C 1.671 176.485 174.700 0.190 0.000 1.044 47 T CA 1.255 63.543 62.100 0.314 0.000 1.139 47 T CB -0.174 68.841 68.868 0.244 0.000 0.867 47 T HN 0.404 nan 8.240 nan 0.000 0.454 48 E N 0.734 120.991 120.200 0.094 0.000 2.204 48 E HA -0.127 4.223 4.350 0.000 0.000 0.195 48 E C 2.548 179.205 176.600 0.095 0.000 0.990 48 E CA 1.540 57.986 56.400 0.076 0.000 0.821 48 E CB -0.199 29.523 29.700 0.036 0.000 0.750 48 E HN 0.662 nan 8.360 nan 0.000 0.477 49 T N -1.328 113.302 114.554 0.127 0.000 2.942 49 T HA -0.072 4.278 4.350 0.000 0.000 0.265 49 T C 0.889 175.661 174.700 0.121 0.000 1.062 49 T CA 0.540 62.716 62.100 0.126 0.000 1.139 49 T CB -0.149 68.814 68.868 0.160 0.000 0.883 49 T HN 0.032 nan 8.240 nan 0.000 0.468 50 K N 0.411 120.900 120.400 0.148 0.000 3.096 50 K HA -0.136 4.184 4.320 0.000 0.000 0.266 50 K C 0.965 177.577 176.600 0.021 0.000 1.043 50 K CA 0.427 56.761 56.287 0.079 0.000 0.758 50 K CB -2.035 30.493 32.500 0.047 0.000 1.260 50 K HN 0.582 nan 8.250 nan 0.000 0.481 51 V N -3.902 116.043 119.914 0.051 0.000 3.406 51 V HA 0.122 4.243 4.120 0.000 0.000 0.263 51 V C 0.767 176.741 176.094 -0.199 0.000 1.172 51 V CA 1.451 63.736 62.300 -0.026 0.000 1.140 51 V CB 0.842 32.712 31.823 0.077 0.000 0.784 51 V HN 0.393 nan 8.190 nan 0.000 0.467 52 T N -0.006 114.367 114.554 -0.302 0.000 2.722 52 T HA 0.433 4.783 4.350 0.000 0.000 0.314 52 T C -0.613 173.592 174.700 -0.826 0.000 1.675 52 T CA 0.266 62.042 62.100 -0.540 0.000 1.003 52 T CB 1.400 69.880 68.868 -0.645 0.000 1.602 52 T HN 0.662 nan 8.240 nan 0.000 0.496 53 T N 1.358 115.451 114.554 -0.768 0.000 2.882 53 T HA 0.768 5.118 4.350 0.000 0.000 0.287 53 T C -0.646 173.425 174.700 -1.050 0.000 0.992 53 T CA -0.494 61.166 62.100 -0.733 0.000 1.076 53 T CB 0.384 69.026 68.868 -0.377 0.000 0.961 53 T HN 0.382 nan 8.240 nan 0.000 0.490 54 F N 0.499 120.173 119.950 -0.461 0.000 2.538 54 F HA 0.443 4.970 4.527 0.000 0.000 0.325 54 F C 1.739 177.141 175.800 -0.662 0.000 1.066 54 F CA -1.264 56.233 58.000 -0.839 0.000 0.946 54 F CB 1.909 39.815 39.000 -1.824 0.000 1.199 54 F HN 0.710 nan 8.300 nan 0.000 0.473 55 S N -0.081 115.395 115.700 -0.373 0.000 2.547 55 S HA -0.162 4.308 4.470 0.000 0.000 0.235 55 S C 0.910 175.527 174.600 0.027 0.000 0.980 55 S CA 0.633 58.755 58.200 -0.129 0.000 0.941 55 S CB -0.781 62.395 63.200 -0.040 0.000 0.763 55 S HN 0.832 nan 8.310 nan 0.000 0.532 56 W N 0.528 121.942 121.300 0.190 0.000 3.127 56 W HA 0.560 5.220 4.660 0.000 0.000 0.344 56 W C 0.517 177.209 176.519 0.288 0.000 1.151 56 W CA -0.567 56.894 57.345 0.194 0.000 1.765 56 W CB -0.252 29.345 29.460 0.229 0.000 1.085 56 W HN -0.049 nan 8.180 nan 0.000 0.596 57 D N 1.796 122.348 120.400 0.253 0.000 2.158 57 D HA -0.239 4.401 4.640 0.000 0.000 0.197 57 D C 1.619 178.085 176.300 0.277 0.000 0.995 57 D CA 1.695 55.901 54.000 0.344 0.000 0.846 57 D CB -0.465 40.407 40.800 0.120 0.000 0.941 57 D HN 0.265 nan 8.370 nan 0.000 0.456 58 N N 0.789 119.577 118.700 0.148 0.000 2.348 58 N HA -0.150 4.590 4.740 0.000 0.000 0.185 58 N C 1.538 177.070 175.510 0.037 0.000 1.019 58 N CA 0.643 53.739 53.050 0.078 0.000 0.880 58 N CB -0.117 38.394 38.487 0.041 0.000 0.965 58 N HN 0.507 nan 8.380 nan 0.000 0.437 59 Q N -0.580 119.224 119.800 0.007 0.000 2.378 59 Q HA 0.049 4.389 4.340 0.000 0.000 0.205 59 Q C -0.089 175.623 176.000 -0.480 0.000 0.954 59 Q CA 0.627 56.267 55.803 -0.272 0.000 0.901 59 Q CB 0.128 28.606 28.738 -0.434 0.000 0.981 59 Q HN 0.318 nan 8.270 nan 0.000 0.483 60 F N 1.004 121.036 119.950 0.138 0.000 2.627 60 F HA 0.277 4.804 4.527 0.000 0.000 0.329 60 F C -0.027 175.832 175.800 0.098 0.000 1.378 60 F CA -1.087 56.985 58.000 0.120 0.000 1.134 60 F CB 0.042 39.142 39.000 0.166 0.000 1.229 60 F HN -0.145 nan 8.300 nan 0.000 0.537 229 Y N -0.326 119.992 120.300 0.029 0.000 2.457 229 Y HA 0.446 4.996 4.550 0.000 0.000 0.263 229 Y C 0.101 176.023 175.900 0.037 0.000 1.164 229 Y CA 0.076 58.201 58.100 0.042 0.000 1.274 229 Y CB 0.378 38.863 38.460 0.041 0.000 1.097 229 Y HN -0.015 nan 8.280 nan 0.000 0.523 230 L N 0.614 121.929 121.223 0.155 0.000 2.365 230 L HA 0.386 4.726 4.340 0.000 0.000 0.273 230 L C -0.183 176.721 176.870 0.057 0.000 1.000 230 L CA -1.204 53.695 54.840 0.098 0.000 0.819 230 L CB 1.652 43.764 42.059 0.087 0.000 1.284 230 L HN -0.142 nan 8.230 nan 0.000 0.418 231 I N 1.655 122.252 120.570 0.045 0.000 3.058 231 I HA -0.074 4.096 4.170 0.000 0.000 0.299 231 I C 0.982 177.112 176.117 0.022 0.000 1.238 231 I CA 0.848 62.165 61.300 0.028 0.000 1.423 231 I CB 0.737 38.752 38.000 0.024 0.000 1.330 231 I HN 0.835 nan 8.210 nan 0.000 0.589 237 D N 1.919 122.330 120.400 0.019 0.000 2.339 237 D HA 0.574 5.214 4.640 0.000 0.000 0.241 237 D C 0.341 176.655 176.300 0.025 0.000 1.183 237 D CA 0.344 54.358 54.000 0.024 0.000 0.859 237 D CB 1.408 42.222 40.800 0.022 0.000 1.067 237 D HN 0.528 nan 8.370 nan 0.000 0.484 238 G N 1.806 110.625 108.800 0.031 0.000 2.554 238 G HA2 0.396 4.356 3.960 0.000 0.000 0.306 238 G HA3 0.396 4.356 3.960 0.000 0.000 0.306 238 G C -2.335 172.591 174.900 0.043 0.000 1.320 238 G CA -0.978 44.141 45.100 0.033 0.000 0.800 238 G HN 0.211 nan 8.290 nan 0.000 0.481 239 P HA 0.028 nan 4.420 nan 0.000 0.225 239 P C 0.179 177.510 177.300 0.052 0.000 1.148 239 P CA 0.997 64.130 63.100 0.054 0.000 0.779 239 P CB 0.380 32.111 31.700 0.052 0.000 0.780 240 D N -0.424 120.001 120.400 0.043 0.000 2.349 240 D HA 0.018 4.658 4.640 0.000 0.000 0.214 240 D C 0.636 176.959 176.300 0.040 0.000 1.063 240 D CA 0.191 54.215 54.000 0.040 0.000 0.847 240 D CB 0.545 41.364 40.800 0.031 0.000 0.933 240 D HN 0.370 nan 8.370 nan 0.000 0.513 241 E N 1.566 121.792 120.200 0.043 0.000 2.259 241 E HA 0.071 4.421 4.350 0.000 0.000 0.281 241 E C -0.388 176.244 176.600 0.054 0.000 1.027 241 E CA -0.503 55.922 56.400 0.041 0.000 0.838 241 E CB 0.635 30.358 29.700 0.038 0.000 1.066 241 E HN -0.127 nan 8.360 nan 0.000 0.401 242 N N 4.652 123.382 118.700 0.051 0.000 2.406 242 N HA 0.209 4.949 4.740 0.000 0.000 0.251 242 N C -0.902 174.648 175.510 0.067 0.000 1.069 242 N CA -0.245 52.844 53.050 0.065 0.000 0.947 242 N CB 0.888 39.407 38.487 0.053 0.000 1.111 242 N HN 0.343 nan 8.380 nan 0.000 0.497 243 L N 2.521 123.797 121.223 0.088 0.000 2.408 243 L HA 0.567 4.907 4.340 0.000 0.000 0.268 243 L C -0.884 176.060 176.870 0.123 0.000 0.986 243 L CA -0.540 54.354 54.840 0.090 0.000 0.820 243 L CB 2.084 44.191 42.059 0.080 0.000 1.303 243 L HN 0.464 nan 8.230 nan 0.000 0.411 244 M N 5.995 125.671 119.600 0.126 0.000 2.181 244 M HA 0.585 5.065 4.480 0.000 0.000 0.323 244 M C -2.023 174.374 176.300 0.162 0.000 1.004 244 M CA -0.475 54.934 55.300 0.182 0.000 0.941 244 M CB 1.093 33.812 32.600 0.199 0.000 1.579 244 M HN 0.587 nan 8.290 nan 0.000 0.427 245 L N 6.334 127.649 121.223 0.154 0.000 2.333 245 L HA 0.823 5.163 4.340 0.000 0.000 0.280 245 L C -0.597 176.327 176.870 0.091 0.000 1.004 245 L CA -0.670 54.236 54.840 0.110 0.000 0.820 245 L CB 1.574 43.679 42.059 0.077 0.000 1.247 245 L HN 1.072 nan 8.230 nan 0.000 0.416 246 C N 0.761 120.125 119.300 0.106 0.000 3.279 246 C HA 0.647 5.107 4.460 0.000 0.000 0.362 246 C C -1.313 173.740 174.990 0.104 0.000 1.706 246 C CA -0.924 58.139 59.018 0.076 0.000 1.128 246 C CB 0.775 28.622 27.740 0.178 0.000 1.990 246 C HN 0.532 nan 8.230 nan 0.000 0.416 247 L N 1.151 122.434 121.223 0.099 0.000 2.332 247 L HA 0.794 5.134 4.340 0.000 0.000 0.269 247 L C -0.416 176.556 176.870 0.170 0.000 1.016 247 L CA -0.208 54.669 54.840 0.062 0.000 0.809 247 L CB 1.303 43.357 42.059 -0.008 0.000 1.280 247 L HN 0.931 nan 8.230 nan 0.000 0.447 248 Y N -1.988 118.360 120.300 0.081 0.000 2.391 248 Y HA 0.538 5.088 4.550 0.000 0.000 0.341 248 Y C 0.096 176.036 175.900 0.067 0.000 0.965 248 Y CA -0.972 57.178 58.100 0.083 0.000 1.067 248 Y CB 0.929 39.435 38.460 0.078 0.000 1.199 248 Y HN 0.542 nan 8.280 nan 0.000 0.450 249 D N 2.530 123.080 120.400 0.250 0.000 2.144 249 D HA 0.016 4.656 4.640 0.000 0.000 0.207 249 D C -0.258 176.184 176.300 0.238 0.000 0.970 249 D CA 1.486 55.584 54.000 0.163 0.000 0.853 249 D CB 0.332 41.202 40.800 0.116 0.000 1.007 249 D HN 0.750 nan 8.370 nan 0.000 0.469 250 K N -0.769 119.773 120.400 0.237 0.000 2.557 250 K HA 0.520 4.840 4.320 0.000 0.000 0.261 250 K C -1.651 175.014 176.600 0.108 0.000 0.932 250 K CA -0.760 55.633 56.287 0.176 0.000 0.829 250 K CB 2.110 34.671 32.500 0.103 0.000 1.358 250 K HN -0.261 nan 8.250 nan 0.000 0.430 251 V N 2.047 121.988 119.914 0.044 0.000 2.495 251 V HA 0.648 4.768 4.120 0.000 0.000 0.298 251 V C -0.619 175.470 176.094 -0.009 0.000 1.031 251 V CA -0.217 62.099 62.300 0.027 0.000 0.871 251 V CB 1.685 33.492 31.823 -0.026 0.000 0.988 251 V HN 1.036 nan 8.190 nan 0.000 0.432 252 T N 2.463 116.999 114.554 -0.029 0.000 2.923 252 T HA 0.843 5.193 4.350 0.000 0.000 0.311 252 T C -0.913 173.605 174.700 -0.303 0.000 1.183 252 T CA -1.079 60.929 62.100 -0.152 0.000 1.020 252 T CB 2.284 71.098 68.868 -0.091 0.000 1.165 252 T HN 0.871 nan 8.240 nan 0.000 0.482 253 R N 0.050 120.238 120.500 -0.520 0.000 2.651 253 R HA 0.780 5.120 4.340 0.000 0.000 0.278 253 R C -1.517 174.520 176.300 -0.438 0.000 1.010 253 R CA -0.819 54.845 56.100 -0.727 0.000 0.896 253 R CB 1.767 31.038 30.300 -1.715 0.000 1.211 253 R HN 0.557 nan 8.270 nan 0.000 0.456 254 T N 2.673 117.048 114.554 -0.297 0.000 2.847 254 T HA 0.355 4.705 4.350 0.000 0.000 0.291 254 T C -0.470 174.157 174.700 -0.121 0.000 0.998 254 T CA -0.529 61.469 62.100 -0.171 0.000 0.967 254 T CB 1.289 70.096 68.868 -0.102 0.000 0.954 254 T HN 0.780 nan 8.240 nan 0.000 0.441 255 K N 2.263 122.606 120.400 -0.095 0.000 2.075 255 K HA -0.261 4.059 4.320 0.000 0.000 0.144 255 K C 1.265 177.878 176.600 0.022 0.000 1.038 255 K CA 1.892 58.169 56.287 -0.018 0.000 0.321 255 K CB -1.607 30.901 32.500 0.013 0.000 0.709 255 K HN 0.712 nan 8.250 nan 0.000 0.762 256 A N 0.697 123.588 122.820 0.117 0.000 2.470 256 A HA 0.283 4.603 4.320 0.000 0.000 0.251 256 A C -0.233 177.546 177.584 0.325 0.000 1.245 256 A CA 0.153 52.369 52.037 0.298 0.000 0.932 256 A CB 0.024 19.231 19.000 0.345 0.000 1.037 256 A HN 0.253 nan 8.150 nan 0.000 0.522 257 R N 0.010 120.588 120.500 0.131 0.000 2.196 257 R HA 0.319 4.659 4.340 0.000 0.000 0.340 257 R C -1.527 174.817 176.300 0.073 0.000 1.043 257 R CA -0.276 55.910 56.100 0.143 0.000 0.883 257 R CB 0.472 30.810 30.300 0.064 0.000 1.078 257 R HN 0.450 nan 8.270 nan 0.000 0.462 258 W N 2.467 123.786 121.300 0.032 0.000 2.449 258 W HA 0.389 5.049 4.660 0.000 0.000 0.331 258 W C 0.173 176.692 176.519 -0.000 0.000 1.119 258 W CA -0.533 56.816 57.345 0.006 0.000 1.240 258 W CB 1.097 30.559 29.460 0.003 0.000 1.251 258 W HN 0.159 nan 8.180 nan 0.000 0.576 259 K N 2.558 123.077 120.400 0.199 0.000 2.578 259 K HA 0.528 4.848 4.320 0.000 0.000 0.250 259 K C -1.589 175.080 176.600 0.116 0.000 0.955 259 K CA -0.596 55.761 56.287 0.117 0.000 0.825 259 K CB 1.436 33.968 32.500 0.053 0.000 1.151 259 K HN 0.330 nan 8.250 nan 0.000 0.432 260 C N 2.257 121.617 119.300 0.100 0.000 2.319 260 C HA 0.395 4.855 4.460 0.000 0.000 0.323 260 C C 0.294 175.327 174.990 0.072 0.000 1.277 260 C CA -1.002 58.069 59.018 0.090 0.000 1.517 260 C CB 0.572 28.361 27.740 0.083 0.000 2.206 260 C HN 0.822 nan 8.230 nan 0.000 0.486 261 S N 4.385 120.140 115.700 0.092 0.000 2.410 261 S HA 0.743 5.213 4.470 0.000 0.000 0.304 261 S C -0.633 174.053 174.600 0.143 0.000 1.095 261 S CA -0.481 57.775 58.200 0.093 0.000 1.089 261 S CB 0.234 63.486 63.200 0.088 0.000 0.968 261 S HN 0.449 nan 8.310 nan 0.000 0.480 262 L N 2.659 123.965 121.223 0.139 0.000 2.304 262 L HA 0.794 5.134 4.340 0.000 0.000 0.268 262 L C 0.124 177.162 176.870 0.280 0.000 1.010 262 L CA -0.545 54.434 54.840 0.231 0.000 0.813 262 L CB 1.347 43.561 42.059 0.259 0.000 1.315 262 L HN 1.004 nan 8.230 nan 0.000 0.445 263 K N -1.756 118.845 120.400 0.336 0.000 2.578 263 K HA 0.441 4.761 4.320 0.000 0.000 0.287 263 K C -1.530 175.135 176.600 0.107 0.000 1.010 263 K CA -0.844 55.600 56.287 0.262 0.000 0.889 263 K CB 1.190 33.772 32.500 0.136 0.000 1.514 263 K HN 0.308 nan 8.250 nan 0.000 0.424 264 D N 0.147 120.539 120.400 -0.015 0.000 2.971 264 D HA -0.131 4.509 4.640 0.000 0.000 0.212 264 D C -0.156 175.927 176.300 -0.361 0.000 1.243 264 D CA 1.954 55.857 54.000 -0.160 0.000 0.781 264 D CB -1.061 39.699 40.800 -0.066 0.000 0.894 264 D HN 0.849 nan 8.370 nan 0.000 0.392 265 G N -1.574 106.643 108.800 -0.971 0.000 2.658 265 G HA2 0.700 4.660 3.960 0.000 0.000 0.292 265 G HA3 0.700 4.660 3.960 0.000 0.000 0.292 265 G C -1.134 173.221 174.900 -0.908 0.000 1.320 265 G CA -0.590 43.869 45.100 -1.069 0.000 0.933 265 G HN 0.422 nan 8.290 nan 0.000 0.476 266 V N -0.534 119.196 119.914 -0.307 0.000 2.841 266 V HA 0.837 4.957 4.120 0.000 0.000 0.310 266 V C -1.247 174.961 176.094 0.190 0.000 1.090 266 V CA -0.714 61.589 62.300 0.005 0.000 0.930 266 V CB 1.775 33.660 31.823 0.104 0.000 1.014 266 V HN 1.170 nan 8.190 nan 0.000 0.425 267 V N 4.927 125.013 119.914 0.286 0.000 2.888 267 V HA 0.730 4.850 4.120 0.000 0.000 0.309 267 V C -0.468 175.797 176.094 0.285 0.000 1.114 267 V CA 0.014 62.490 62.300 0.294 0.000 0.940 267 V CB 2.769 34.795 31.823 0.338 0.000 1.021 267 V HN 1.030 nan 8.190 nan 0.000 0.426 268 T N 7.789 122.475 114.554 0.220 0.000 2.772 268 T HA 0.626 4.976 4.350 0.000 0.000 0.288 268 T C -0.422 174.390 174.700 0.185 0.000 0.994 268 T CA 0.041 62.255 62.100 0.191 0.000 0.951 268 T CB 0.406 69.361 68.868 0.144 0.000 0.933 268 T HN 0.513 nan 8.240 nan 0.000 0.447 269 I N 3.689 124.401 120.570 0.236 0.000 2.466 269 I HA 0.321 4.491 4.170 0.000 0.000 0.279 269 I C -0.037 176.174 176.117 0.157 0.000 1.033 269 I CA -0.783 60.627 61.300 0.183 0.000 1.123 269 I CB 0.845 38.948 38.000 0.172 0.000 1.237 269 I HN 0.761 nan 8.210 nan 0.000 0.460 270 N N 6.425 125.185 118.700 0.099 0.000 2.726 270 N HA -0.173 4.567 4.740 0.000 0.000 0.253 270 N C 0.133 175.685 175.510 0.069 0.000 1.059 270 N CA -0.130 52.964 53.050 0.074 0.000 0.701 270 N CB -0.391 38.136 38.487 0.067 0.000 0.899 270 N HN 0.606 nan 8.380 nan 0.000 0.548 271 R N -2.725 117.815 120.500 0.065 0.000 4.000 271 R HA -0.205 4.135 4.340 0.000 0.000 0.362 271 R C -0.775 175.541 176.300 0.028 0.000 1.183 271 R CA 1.217 57.347 56.100 0.051 0.000 1.011 271 R CB -2.323 28.000 30.300 0.038 0.000 1.501 271 R HN 0.690 nan 8.270 nan 0.000 0.553 272 N N 0.433 119.151 118.700 0.031 0.000 2.284 272 N HA 0.259 4.999 4.740 0.000 0.000 0.300 272 N C -1.291 174.132 175.510 -0.144 0.000 1.047 272 N CA -0.759 52.238 53.050 -0.087 0.000 0.821 272 N CB 1.664 40.098 38.487 -0.089 0.000 1.337 272 N HN -0.102 nan 8.380 nan 0.000 0.482 273 D N 1.029 121.236 120.400 -0.321 0.000 2.181 273 D HA 0.412 5.052 4.640 0.000 0.000 0.248 273 D C -1.152 174.783 176.300 -0.609 0.000 1.020 273 D CA 0.215 54.060 54.000 -0.258 0.000 0.891 273 D CB 1.017 41.751 40.800 -0.111 0.000 1.187 273 D HN 0.300 nan 8.370 nan 0.000 0.443 274 Y N -0.797 119.511 120.300 0.012 0.000 2.553 274 Y HA 0.537 5.087 4.550 0.000 0.000 0.347 274 Y C 0.316 176.263 175.900 0.077 0.000 1.019 274 Y CA -1.010 57.106 58.100 0.027 0.000 1.032 274 Y CB 2.064 40.571 38.460 0.078 0.000 1.284 274 Y HN 0.212 nan 8.280 nan 0.000 0.466 275 T N -0.396 114.287 114.554 0.216 0.000 2.907 275 T HA 0.861 5.211 4.350 0.000 0.000 0.292 275 T C -1.129 173.698 174.700 0.212 0.000 1.043 275 T CA -0.774 61.395 62.100 0.115 0.000 1.003 275 T CB 1.500 70.383 68.868 0.025 0.000 1.084 275 T HN 0.556 nan 8.240 nan 0.000 0.483 276 F N 0.075 120.075 119.950 0.083 0.000 2.626 276 F HA 0.760 5.287 4.527 0.000 0.000 0.311 276 F C 0.844 176.676 175.800 0.054 0.000 1.088 276 F CA -1.403 56.634 58.000 0.062 0.000 0.949 276 F CB 1.842 40.874 39.000 0.054 0.000 1.322 276 F HN 0.599 nan 8.300 nan 0.000 0.461 277 Q N 1.194 121.169 119.800 0.292 0.000 2.134 277 Q HA 0.338 4.678 4.340 0.000 0.000 0.195 277 Q C -0.651 175.519 176.000 0.285 0.000 0.958 277 Q CA 1.570 57.483 55.803 0.183 0.000 0.840 277 Q CB 0.361 29.173 28.738 0.123 0.000 0.918 277 Q HN 0.683 nan 8.270 nan 0.000 0.467 278 K N -0.750 119.854 120.400 0.340 0.000 2.469 278 K HA 0.789 5.109 4.320 0.000 0.000 0.254 278 K C -1.730 174.912 176.600 0.069 0.000 0.939 278 K CA -0.598 55.836 56.287 0.246 0.000 0.812 278 K CB 2.281 34.849 32.500 0.113 0.000 1.301 278 K HN 0.083 nan 8.250 nan 0.000 0.433 279 A N 1.872 124.640 122.820 -0.086 0.000 2.449 279 A HA 0.525 4.845 4.320 0.000 0.000 0.302 279 A C -1.478 176.014 177.584 -0.152 0.000 1.048 279 A CA -0.714 51.092 52.037 -0.385 0.000 0.708 279 A CB 1.672 20.128 19.000 -0.906 0.000 1.274 279 A HN 0.443 nan 8.150 nan 0.000 0.410 280 Q N 1.105 120.820 119.800 -0.142 0.000 2.325 280 Q HA 0.538 4.878 4.340 0.000 0.000 0.270 280 Q C -1.104 174.858 176.000 -0.062 0.000 1.020 280 Q CA -0.387 55.378 55.803 -0.063 0.000 0.785 280 Q CB 1.965 30.678 28.738 -0.042 0.000 1.259 280 Q HN 0.524 nan 8.270 nan 0.000 0.452 281 V N 2.214 122.115 119.914 -0.022 0.000 2.513 281 V HA 0.468 4.588 4.120 0.000 0.000 0.299 281 V C -0.134 175.979 176.094 0.032 0.000 1.035 281 V CA -0.641 61.654 62.300 -0.008 0.000 0.889 281 V CB 1.978 33.801 31.823 0.000 0.000 0.988 281 V HN 0.672 nan 8.190 nan 0.000 0.440 282 E N 2.961 123.179 120.200 0.030 0.000 2.731 282 E HA 0.616 4.966 4.350 0.000 0.000 0.248 282 E C -0.742 175.897 176.600 0.065 0.000 1.084 282 E CA -0.242 56.193 56.400 0.058 0.000 0.776 282 E CB 1.827 31.548 29.700 0.035 0.000 1.404 282 E HN 0.825 nan 8.360 nan 0.000 0.395 283 A N 2.640 125.523 122.820 0.105 0.000 2.350 283 A HA 0.488 4.808 4.320 0.000 0.000 0.324 283 A C -0.585 177.107 177.584 0.180 0.000 1.118 283 A CA -0.638 51.455 52.037 0.092 0.000 0.783 283 A CB 1.321 20.340 19.000 0.032 0.000 1.236 283 A HN 0.498 nan 8.150 nan 0.000 0.457 284 E N 2.061 122.350 120.200 0.149 0.000 2.113 284 E HA 0.195 4.545 4.350 0.000 0.000 0.273 284 E C -1.249 175.485 176.600 0.222 0.000 0.924 284 E CA -0.578 55.951 56.400 0.214 0.000 0.764 284 E CB 0.656 30.433 29.700 0.128 0.000 1.104 284 E HN 0.654 nan 8.360 nan 0.000 0.406 285 W N 6.939 128.333 121.300 0.156 0.000 1.839 285 W HA 0.222 4.882 4.660 0.000 0.000 0.489 285 W C -1.312 175.250 176.519 0.071 0.000 0.789 285 W CA -0.024 57.369 57.345 0.080 0.000 1.900 285 W CB -0.311 29.264 29.460 0.192 0.000 1.773 285 W HN 0.236 nan 8.180 nan 0.000 0.251 286 V N 0.000 119.805 119.914 -0.181 0.000 2.409 286 V HA 0.000 4.120 4.120 0.000 0.000 0.244 286 V CA 0.000 62.156 62.300 -0.241 0.000 1.235 286 V CB 0.000 31.779 31.823 -0.073 0.000 1.184 286 V HN 0.000 nan 8.190 nan 0.000 0.556