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 1l0o_1_C DATA FIRST_RESID 102 DATA SEQUENCE DGTVKVSRSL KEMGNKIRKA KDELSKTRGR APTVTEIADH LGISPEDVVL DATA SEQUENCE AQEAVRL 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 102 D HA 0.000 nan 4.640 nan 0.000 0.175 102 D C 0.000 176.299 176.300 -0.001 0.000 2.045 102 D CA 0.000 53.999 54.000 -0.001 0.000 0.868 102 D CB 0.000 40.799 40.800 -0.001 0.000 0.688 103 G N 0.219 109.018 108.800 -0.001 0.000 4.655 103 G HA2 -0.278 3.682 3.960 0.000 0.000 0.220 103 G HA3 -0.278 3.682 3.960 0.000 0.000 0.220 103 G C 1.433 176.333 174.900 -0.001 0.000 1.403 103 G CA 1.026 46.125 45.100 -0.001 0.000 0.931 103 G HN 1.239 nan 8.290 nan 0.000 0.654 104 T N 2.247 116.801 114.554 -0.001 0.000 3.500 104 T HA 0.373 4.723 4.350 0.000 0.000 0.244 104 T C 1.535 176.235 174.700 -0.000 0.000 0.962 104 T CA 0.619 62.719 62.100 -0.000 0.000 0.932 104 T CB 0.319 69.187 68.868 -0.000 0.000 1.096 104 T HN 0.529 nan 8.240 nan 0.000 0.617 105 V N 1.509 121.422 119.914 -0.000 0.000 3.559 105 V HA -0.057 4.063 4.120 0.000 0.000 0.272 105 V C 1.359 177.453 176.094 0.000 0.000 1.235 105 V CA 0.231 62.531 62.300 -0.000 0.000 1.192 105 V CB -1.190 30.633 31.823 -0.000 0.000 0.930 105 V HN 0.608 nan 8.190 nan 0.000 0.492 106 K N -2.067 118.333 120.400 0.000 0.000 3.557 106 K HA -0.345 3.975 4.320 0.000 0.000 0.292 106 K C 1.275 177.875 176.600 0.001 0.000 1.167 106 K CA 1.282 57.569 56.287 0.000 0.000 1.048 106 K CB -1.796 30.705 32.500 0.001 0.000 1.368 106 K HN 0.566 nan 8.250 nan 0.000 0.425 107 V N -2.418 117.496 119.914 0.001 0.000 0.404 107 V HA -0.423 3.697 4.120 0.000 0.000 0.091 107 V C 1.994 178.089 176.094 0.001 0.000 2.708 107 V CA 2.643 64.944 62.300 0.001 0.000 3.794 107 V CB -1.481 30.342 31.823 0.001 0.000 1.058 107 V HN 0.423 nan 8.190 nan 0.000 1.110 108 S N -0.446 115.255 115.700 0.001 0.000 2.348 108 S HA -0.171 4.299 4.470 0.000 0.000 0.221 108 S C 1.760 176.361 174.600 0.002 0.000 1.033 108 S CA 1.839 60.040 58.200 0.001 0.000 1.010 108 S CB -0.278 62.922 63.200 0.001 0.000 0.891 108 S HN 0.605 nan 8.310 nan 0.000 0.442 109 R N 1.282 121.782 120.500 0.001 0.000 2.070 109 R HA 0.035 4.375 4.340 0.000 0.000 0.233 109 R C 2.734 179.035 176.300 0.002 0.000 1.137 109 R CA 1.321 57.422 56.100 0.002 0.000 0.945 109 R CB -1.535 28.765 30.300 0.001 0.000 0.845 109 R HN 0.430 nan 8.270 nan 0.000 0.430 110 S N 0.916 116.617 115.700 0.001 0.000 2.365 110 S HA -0.140 4.330 4.470 0.000 0.000 0.225 110 S C 1.985 176.586 174.600 0.002 0.000 1.039 110 S CA 1.183 59.384 58.200 0.001 0.000 1.033 110 S CB -0.188 63.013 63.200 0.000 0.000 0.887 110 S HN 0.202 nan 8.310 nan 0.000 0.447 111 L N 1.365 122.590 121.223 0.002 0.000 2.109 111 L HA 0.104 4.444 4.340 0.000 0.000 0.207 111 L C 2.435 179.307 176.870 0.004 0.000 1.086 111 L CA 1.622 56.464 54.840 0.003 0.000 0.760 111 L CB -0.433 41.628 42.059 0.003 0.000 0.910 111 L HN 0.249 nan 8.230 nan 0.000 0.437 112 K N -0.513 119.889 120.400 0.003 0.000 2.097 112 K HA -0.241 4.079 4.320 0.000 0.000 0.205 112 K C 2.059 178.662 176.600 0.005 0.000 1.050 112 K CA 1.557 57.847 56.287 0.004 0.000 0.938 112 K CB 0.020 32.522 32.500 0.003 0.000 0.718 112 K HN 0.422 nan 8.250 nan 0.000 0.442 113 E N 0.313 120.515 120.200 0.004 0.000 2.051 113 E HA -0.239 4.111 4.350 0.000 0.000 0.192 113 E C 1.963 178.567 176.600 0.007 0.000 0.991 113 E CA 1.286 57.689 56.400 0.005 0.000 0.799 113 E CB -0.092 29.610 29.700 0.003 0.000 0.748 113 E HN 0.177 nan 8.360 nan 0.000 0.449 114 M N 0.522 120.126 119.600 0.006 0.000 2.296 114 M HA 0.044 4.524 4.480 0.000 0.000 0.265 114 M C 1.848 178.155 176.300 0.012 0.000 1.064 114 M CA 1.805 57.111 55.300 0.008 0.000 1.109 114 M CB -0.404 32.200 32.600 0.006 0.000 1.396 114 M HN 0.198 nan 8.290 nan 0.000 0.430 115 G N -0.265 108.541 108.800 0.010 0.000 2.418 115 G HA2 -0.255 3.705 3.960 0.000 0.000 0.217 115 G HA3 -0.255 3.705 3.960 0.000 0.000 0.217 115 G C 1.278 176.185 174.900 0.012 0.000 1.158 115 G CA 1.169 46.275 45.100 0.010 0.000 0.771 115 G HN 0.583 nan 8.290 nan 0.000 0.545 116 N N 0.672 119.378 118.700 0.011 0.000 2.084 116 N HA -0.050 4.690 4.740 0.000 0.000 0.190 116 N C 2.044 177.564 175.510 0.018 0.000 1.030 116 N CA 1.185 54.242 53.050 0.012 0.000 0.849 116 N CB -0.162 38.331 38.487 0.010 0.000 1.012 116 N HN 0.233 nan 8.380 nan 0.000 0.423 117 K N 0.503 120.916 120.400 0.021 0.000 2.228 117 K HA -0.147 4.173 4.320 0.000 0.000 0.205 117 K C 1.722 178.349 176.600 0.044 0.000 1.045 117 K CA 0.935 57.242 56.287 0.033 0.000 0.931 117 K CB -0.250 32.267 32.500 0.029 0.000 0.727 117 K HN 0.336 nan 8.250 nan 0.000 0.458 118 I N 0.522 121.112 120.570 0.033 0.000 2.286 118 I HA -0.216 3.954 4.170 0.000 0.000 0.245 118 I C 2.399 178.530 176.117 0.023 0.000 1.104 118 I CA 0.719 62.039 61.300 0.034 0.000 1.397 118 I CB -0.196 37.819 38.000 0.024 0.000 1.072 118 I HN 0.120 nan 8.210 nan 0.000 0.417 119 R N 1.208 121.718 120.500 0.016 0.000 2.096 119 R HA -0.225 4.115 4.340 0.000 0.000 0.240 119 R C 2.190 178.494 176.300 0.006 0.000 1.139 119 R CA 1.443 57.547 56.100 0.008 0.000 0.952 119 R CB -0.837 29.467 30.300 0.007 0.000 0.854 119 R HN 0.390 nan 8.270 nan 0.000 0.436 120 K N 0.524 120.933 120.400 0.015 0.000 2.002 120 K HA -0.096 4.224 4.320 0.000 0.000 0.209 120 K C 1.973 178.576 176.600 0.006 0.000 1.048 120 K CA 1.619 57.915 56.287 0.015 0.000 0.930 120 K CB -0.138 32.380 32.500 0.031 0.000 0.714 120 K HN 0.130 nan 8.250 nan 0.000 0.438 121 A N 1.730 124.569 122.820 0.031 0.000 2.024 121 A HA -0.198 4.122 4.320 0.000 0.000 0.220 121 A C 2.078 179.608 177.584 -0.091 0.000 1.164 121 A CA 1.771 53.805 52.037 -0.004 0.000 0.643 121 A CB -0.456 18.639 19.000 0.159 0.000 0.806 121 A HN 0.451 nan 8.150 nan 0.000 0.451 122 K N 0.328 120.704 120.400 -0.039 0.000 2.001 122 K HA -0.209 4.111 4.320 0.000 0.000 0.208 122 K C 1.736 178.303 176.600 -0.055 0.000 1.048 122 K CA 1.770 58.031 56.287 -0.042 0.000 0.932 122 K CB -0.279 32.210 32.500 -0.019 0.000 0.715 122 K HN 0.689 nan 8.250 nan 0.000 0.437 123 D N -0.038 120.335 120.400 -0.044 0.000 2.224 123 D HA -0.178 4.462 4.640 0.000 0.000 0.205 123 D C 1.361 177.625 176.300 -0.060 0.000 0.965 123 D CA 0.985 54.961 54.000 -0.041 0.000 0.852 123 D CB -0.109 40.676 40.800 -0.025 0.000 0.947 123 D HN 0.379 nan 8.370 nan 0.000 0.494 124 E N 0.298 120.445 120.200 -0.089 0.000 2.047 124 E HA -0.055 4.295 4.350 0.000 0.000 0.191 124 E C 2.420 178.930 176.600 -0.151 0.000 0.987 124 E CA 0.687 57.014 56.400 -0.120 0.000 0.799 124 E CB 0.040 29.639 29.700 -0.169 0.000 0.752 124 E HN 0.346 nan 8.360 nan 0.000 0.449 125 L N 0.760 121.867 121.223 -0.194 0.000 2.240 125 L HA -0.094 4.246 4.340 0.000 0.000 0.211 125 L C 2.647 179.466 176.870 -0.085 0.000 1.106 125 L CA 0.850 55.595 54.840 -0.158 0.000 0.793 125 L CB -0.509 41.450 42.059 -0.168 0.000 0.927 125 L HN 0.164 nan 8.230 nan 0.000 0.446 126 S N 0.235 115.894 115.700 -0.069 0.000 2.382 126 S HA -0.203 4.267 4.470 0.000 0.000 0.228 126 S C 1.943 176.521 174.600 -0.037 0.000 1.027 126 S CA 0.995 59.169 58.200 -0.044 0.000 0.991 126 S CB -0.188 62.991 63.200 -0.035 0.000 0.823 126 S HN 0.398 nan 8.310 nan 0.000 0.469 127 K N 0.319 120.695 120.400 -0.041 0.000 2.044 127 K HA 0.057 4.377 4.320 0.000 0.000 0.204 127 K C 2.518 179.100 176.600 -0.030 0.000 1.049 127 K CA 1.391 57.660 56.287 -0.031 0.000 0.945 127 K CB -0.678 31.805 32.500 -0.029 0.000 0.724 127 K HN 0.305 nan 8.250 nan 0.000 0.440 128 T N 0.624 115.153 114.554 -0.042 0.000 2.803 128 T HA -0.079 4.271 4.350 0.000 0.000 0.269 128 T C 1.674 176.358 174.700 -0.026 0.000 1.052 128 T CA 1.181 63.260 62.100 -0.035 0.000 1.136 128 T CB 0.099 68.936 68.868 -0.052 0.000 0.864 128 T HN 0.087 nan 8.240 nan 0.000 0.467 129 R N -0.552 119.929 120.500 -0.030 0.000 2.195 129 R HA 0.270 4.610 4.340 0.000 0.000 0.197 129 R C 1.680 177.970 176.300 -0.017 0.000 0.990 129 R CA 0.845 56.932 56.100 -0.021 0.000 1.048 129 R CB -0.164 30.122 30.300 -0.023 0.000 0.997 129 R HN 0.423 nan 8.270 nan 0.000 0.502 130 G N 2.449 111.237 108.800 -0.019 0.000 2.203 130 G HA2 -0.282 3.678 3.960 0.000 0.000 0.231 130 G HA3 -0.282 3.678 3.960 0.000 0.000 0.231 130 G C -0.373 174.519 174.900 -0.013 0.000 1.058 130 G CA 0.399 45.491 45.100 -0.014 0.000 0.781 130 G HN 0.459 nan 8.290 nan 0.000 0.496 131 R N -2.670 117.821 120.500 -0.016 0.000 3.139 131 R HA 0.704 5.044 4.340 0.000 0.000 0.287 131 R C 0.011 176.301 176.300 -0.016 0.000 0.978 131 R CA -0.239 55.853 56.100 -0.013 0.000 0.837 131 R CB -0.405 29.889 30.300 -0.010 0.000 1.330 131 R HN 1.641 nan 8.270 nan 0.000 0.527 132 A N 1.628 124.439 122.820 -0.014 0.000 2.540 132 A HA 0.422 4.742 4.320 0.000 0.000 0.239 132 A C -1.788 175.787 177.584 -0.016 0.000 1.061 132 A CA -0.401 51.627 52.037 -0.015 0.000 0.758 132 A CB -0.589 18.404 19.000 -0.011 0.000 0.991 132 A HN 0.585 nan 8.150 nan 0.000 0.502 133 P HA 0.285 nan 4.420 nan 0.000 0.279 133 P C -0.179 177.115 177.300 -0.011 0.000 1.252 133 P CA -0.249 62.839 63.100 -0.020 0.000 0.811 133 P CB 0.940 32.619 31.700 -0.035 0.000 1.035 134 T N 0.489 115.039 114.554 -0.006 0.000 2.913 134 T HA 0.133 4.483 4.350 0.000 0.000 0.287 134 T C 1.779 176.482 174.700 0.005 0.000 1.008 134 T CA -0.492 61.608 62.100 -0.000 0.000 1.067 134 T CB 0.598 69.467 68.868 0.002 0.000 0.996 134 T HN 0.081 nan 8.240 nan 0.000 0.513 135 V N 2.827 122.745 119.914 0.006 0.000 2.332 135 V HA -0.187 3.933 4.120 0.000 0.000 0.248 135 V C 2.698 178.801 176.094 0.015 0.000 1.055 135 V CA 2.082 64.388 62.300 0.010 0.000 1.038 135 V CB -1.249 30.579 31.823 0.008 0.000 0.651 135 V HN 0.971 nan 8.190 nan 0.000 0.450 136 T N -0.097 114.465 114.554 0.013 0.000 2.708 136 T HA -0.207 4.143 4.350 0.000 0.000 0.266 136 T C 1.840 176.555 174.700 0.024 0.000 1.037 136 T CA 1.901 64.011 62.100 0.016 0.000 1.146 136 T CB -0.298 68.577 68.868 0.012 0.000 0.865 136 T HN 0.654 nan 8.240 nan 0.000 0.435 137 E N 0.610 120.823 120.200 0.022 0.000 2.085 137 E HA -0.086 4.264 4.350 0.000 0.000 0.194 137 E C 2.201 178.834 176.600 0.055 0.000 0.994 137 E CA 1.018 57.437 56.400 0.031 0.000 0.801 137 E CB -0.300 29.407 29.700 0.012 0.000 0.743 137 E HN 0.488 nan 8.360 nan 0.000 0.453 138 I N 1.137 121.732 120.570 0.042 0.000 2.315 138 I HA -0.238 3.932 4.170 0.000 0.000 0.248 138 I C 2.586 178.753 176.117 0.084 0.000 1.117 138 I CA 0.720 62.059 61.300 0.065 0.000 1.404 138 I CB -0.402 37.619 38.000 0.036 0.000 1.071 138 I HN 0.086 nan 8.210 nan 0.000 0.419 139 A N 0.986 123.837 122.820 0.051 0.000 1.865 139 A HA -0.251 4.069 4.320 0.000 0.000 0.217 139 A C 2.013 179.621 177.584 0.040 0.000 1.191 139 A CA 2.131 54.190 52.037 0.038 0.000 0.623 139 A CB -0.675 18.340 19.000 0.024 0.000 0.826 139 A HN 0.343 nan 8.150 nan 0.000 0.444 140 D N -1.439 118.989 120.400 0.046 0.000 2.123 140 D HA -0.177 4.463 4.640 0.000 0.000 0.196 140 D C 1.730 178.060 176.300 0.050 0.000 0.992 140 D CA 1.865 55.889 54.000 0.040 0.000 0.833 140 D CB -0.560 40.265 40.800 0.042 0.000 0.954 140 D HN 0.723 nan 8.370 nan 0.000 0.455 141 H N 0.188 119.258 119.070 -0.000 0.000 2.456 141 H HA 0.005 4.561 4.556 -0.000 0.000 0.296 141 H C 1.840 177.168 175.328 -0.000 0.000 1.079 141 H CA 1.059 57.107 56.048 -0.000 0.000 1.322 141 H CB -0.143 29.619 29.762 -0.000 0.000 1.388 141 H HN 0.070 nan 8.280 nan 0.000 0.538 142 L N -1.140 120.073 121.223 -0.017 0.000 2.585 142 L HA 0.241 4.581 4.340 0.000 0.000 0.226 142 L C 1.294 178.132 176.870 -0.053 0.000 1.113 142 L CA 0.336 55.144 54.840 -0.054 0.000 0.876 142 L CB 0.363 42.432 42.059 0.017 0.000 1.072 142 L HN 0.507 nan 8.230 nan 0.000 0.468 143 G N 1.482 110.257 108.800 -0.042 0.000 2.272 143 G HA2 -0.269 3.691 3.960 0.000 0.000 0.280 143 G HA3 -0.269 3.691 3.960 0.000 0.000 0.280 143 G C -0.177 174.713 174.900 -0.016 0.000 1.067 143 G CA 0.276 45.357 45.100 -0.031 0.000 0.902 143 G HN 0.299 nan 8.290 nan 0.000 0.500 144 I N -0.579 119.988 120.570 -0.005 0.000 3.191 144 I HA 0.539 4.709 4.170 0.000 0.000 0.313 144 I C 0.661 176.781 176.117 0.005 0.000 1.193 144 I CA -0.700 60.600 61.300 0.000 0.000 0.968 144 I CB 2.201 40.203 38.000 0.003 0.000 1.262 144 I HN 0.358 nan 8.210 nan 0.000 0.456 145 S N 2.682 118.385 115.700 0.005 0.000 2.610 145 S HA 0.403 4.873 4.470 0.000 0.000 0.273 145 S C -2.220 172.385 174.600 0.009 0.000 1.274 145 S CA -1.059 57.145 58.200 0.006 0.000 1.023 145 S CB 1.553 64.756 63.200 0.004 0.000 0.962 145 S HN 0.333 nan 8.310 nan 0.000 0.523 146 P HA -0.078 nan 4.420 nan 0.000 0.218 146 P C 0.843 178.148 177.300 0.008 0.000 1.146 146 P CA 1.168 64.274 63.100 0.010 0.000 0.813 146 P CB 0.065 31.770 31.700 0.009 0.000 0.778 147 E N -0.770 119.434 120.200 0.006 0.000 2.072 147 E HA -0.127 4.223 4.350 0.000 0.000 0.190 147 E C 1.688 178.291 176.600 0.005 0.000 0.982 147 E CA 1.005 57.408 56.400 0.005 0.000 0.803 147 E CB -0.890 28.812 29.700 0.004 0.000 0.755 147 E HN 0.290 nan 8.360 nan 0.000 0.453 148 D N -0.080 120.324 120.400 0.006 0.000 2.219 148 D HA -0.085 4.555 4.640 0.000 0.000 0.205 148 D C 1.832 178.137 176.300 0.007 0.000 0.970 148 D CA 0.546 54.549 54.000 0.005 0.000 0.851 148 D CB 0.179 40.982 40.800 0.004 0.000 0.943 148 D HN 0.041 nan 8.370 nan 0.000 0.488 149 V N 0.819 120.739 119.914 0.009 0.000 2.270 149 V HA -0.190 3.930 4.120 0.000 0.000 0.245 149 V C 2.700 178.799 176.094 0.009 0.000 1.043 149 V CA 0.934 63.241 62.300 0.012 0.000 1.014 149 V CB -0.330 31.502 31.823 0.015 0.000 0.645 149 V HN 0.034 nan 8.190 nan 0.000 0.447 150 V N -0.292 119.627 119.914 0.008 0.000 2.332 150 V HA -0.264 3.856 4.120 0.000 0.000 0.248 150 V C 2.371 178.468 176.094 0.005 0.000 1.055 150 V CA 2.196 64.500 62.300 0.006 0.000 1.038 150 V CB -0.540 31.286 31.823 0.005 0.000 0.651 150 V HN 0.495 nan 8.190 nan 0.000 0.450 151 L N 0.653 121.879 121.223 0.005 0.000 1.994 151 L HA -0.072 4.268 4.340 0.000 0.000 0.208 151 L C 2.481 179.354 176.870 0.005 0.000 1.071 151 L CA 2.435 57.278 54.840 0.004 0.000 0.745 151 L CB -0.999 41.062 42.059 0.004 0.000 0.892 151 L HN 0.226 nan 8.230 nan 0.000 0.431 152 A N -1.240 121.583 122.820 0.006 0.000 1.908 152 A HA -0.293 4.027 4.320 0.000 0.000 0.218 152 A C 2.305 179.893 177.584 0.006 0.000 1.181 152 A CA 1.865 53.906 52.037 0.006 0.000 0.627 152 A CB -0.754 18.251 19.000 0.008 0.000 0.818 152 A HN 0.663 nan 8.150 nan 0.000 0.445 153 Q N -0.726 119.078 119.800 0.007 0.000 2.045 153 Q HA -0.302 4.038 4.340 0.000 0.000 0.206 153 Q C 2.072 178.075 176.000 0.005 0.000 0.991 153 Q CA 2.206 58.013 55.803 0.006 0.000 0.851 153 Q CB -0.198 28.543 28.738 0.006 0.000 0.911 153 Q HN 0.669 nan 8.270 nan 0.000 0.418 154 E N 0.115 120.317 120.200 0.004 0.000 2.114 154 E HA -0.221 4.129 4.350 0.000 0.000 0.199 154 E C 1.646 178.248 176.600 0.003 0.000 1.008 154 E CA 1.746 58.148 56.400 0.003 0.000 0.810 154 E CB -0.391 29.310 29.700 0.003 0.000 0.739 154 E HN 0.467 nan 8.360 nan 0.000 0.456 155 A N -0.282 122.541 122.820 0.003 0.000 1.972 155 A HA -0.138 4.182 4.320 0.000 0.000 0.219 155 A C 2.489 180.075 177.584 0.003 0.000 1.169 155 A CA 1.520 53.559 52.037 0.003 0.000 0.635 155 A CB -0.573 18.429 19.000 0.003 0.000 0.810 155 A HN 0.226 nan 8.150 nan 0.000 0.446 156 V N 0.728 120.644 119.914 0.004 0.000 2.548 156 V HA -0.229 3.891 4.120 0.000 0.000 0.249 156 V C 2.736 178.832 176.094 0.003 0.000 1.055 156 V CA 2.233 64.536 62.300 0.004 0.000 1.065 156 V CB -0.712 31.114 31.823 0.005 0.000 0.681 156 V HN 0.870 nan 8.190 nan 0.000 0.462 157 R N 1.250 121.752 120.500 0.003 0.000 2.075 157 R HA 0.011 4.351 4.340 0.000 0.000 0.232 157 R C 1.168 177.469 176.300 0.002 0.000 1.126 157 R CA 1.754 57.855 56.100 0.002 0.000 0.963 157 R CB -1.445 28.856 30.300 0.002 0.000 0.858 157 R HN 0.334 nan 8.270 nan 0.000 0.435 158 L N 0.000 121.224 121.223 0.002 0.000 2.949 158 L HA 0.000 4.340 4.340 0.000 0.000 0.249 158 L CA 0.000 54.841 54.840 0.002 0.000 0.813 158 L CB 0.000 42.060 42.059 0.002 0.000 0.961 158 L HN 0.000 nan 8.230 nan 0.000 0.502