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 1o3x_1_A DATA FIRST_RESID 192 DATA SEQUENCE AANKLIKEMV QEDQKRMEKI SKRVNAIEEV NNNVKLLTEM VMSHSQGGAA DATA SEQUENCE AGSSEDLMKE LYQRCERMRP TLFRLASDTE DNDEALAEIL QANDNLTQVI DATA SEQUENCE NLYKQLVRGE EV 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 192 A HA 0.000 nan 4.320 nan 0.000 0.244 192 A C 0.000 177.583 177.584 -0.001 0.000 1.274 192 A CA 0.000 52.036 52.037 -0.001 0.000 0.836 192 A CB 0.000 18.999 19.000 -0.001 0.000 0.831 193 A N 0.433 123.252 122.820 -0.001 0.000 2.454 193 A HA 0.573 4.893 4.320 0.000 0.000 0.260 193 A C -0.056 177.527 177.584 -0.001 0.000 1.106 193 A CA 0.610 52.646 52.037 -0.001 0.000 0.780 193 A CB -0.587 18.413 19.000 -0.001 0.000 1.044 193 A HN 1.231 nan 8.150 nan 0.000 0.498 194 N N 0.991 119.690 118.700 -0.001 0.000 2.357 194 N HA 0.374 5.114 4.740 0.000 0.000 0.284 194 N C -1.315 174.194 175.510 -0.001 0.000 1.236 194 N CA -0.619 52.430 53.050 -0.001 0.000 0.774 194 N CB 1.591 40.077 38.487 -0.001 0.000 1.534 194 N HN 0.508 nan 8.380 nan 0.000 0.478 195 K N 2.850 123.249 120.400 -0.001 0.000 2.334 195 K HA 0.371 4.691 4.320 0.000 0.000 0.265 195 K C 0.002 176.601 176.600 -0.002 0.000 1.039 195 K CA -0.402 55.884 56.287 -0.001 0.000 0.920 195 K CB 0.198 32.697 32.500 -0.001 0.000 1.160 195 K HN 0.613 nan 8.250 nan 0.000 0.451 196 L N 3.618 124.840 121.223 -0.002 0.000 4.988 196 L HA -0.260 4.080 4.340 0.000 0.000 0.439 196 L C 0.267 177.136 176.870 -0.002 0.000 1.080 196 L CA 0.644 55.483 54.840 -0.002 0.000 1.018 196 L CB -0.964 41.094 42.059 -0.002 0.000 1.945 196 L HN 0.784 nan 8.230 nan 0.000 0.782 197 I N -0.206 120.362 120.570 -0.002 0.000 3.858 197 I HA 0.007 4.177 4.170 0.000 0.000 0.325 197 I C 1.843 177.958 176.117 -0.002 0.000 1.403 197 I CA 0.561 61.860 61.300 -0.002 0.000 1.169 197 I CB 0.131 38.130 38.000 -0.002 0.000 1.077 197 I HN 0.113 nan 8.210 nan 0.000 0.403 198 K N 1.614 122.013 120.400 -0.002 0.000 2.361 198 K HA -0.041 4.279 4.320 0.000 0.000 0.196 198 K C 1.839 178.437 176.600 -0.003 0.000 1.039 198 K CA 0.670 56.955 56.287 -0.002 0.000 1.001 198 K CB 0.182 32.681 32.500 -0.002 0.000 0.795 198 K HN 0.472 nan 8.250 nan 0.000 0.495 199 E N -0.379 119.820 120.200 -0.003 0.000 2.347 199 E HA -0.135 4.216 4.350 0.000 0.000 0.196 199 E C 1.208 177.806 176.600 -0.003 0.000 1.008 199 E CA 0.658 57.056 56.400 -0.003 0.000 0.852 199 E CB -0.037 29.661 29.700 -0.003 0.000 0.783 199 E HN 0.126 nan 8.360 nan 0.000 0.505 200 M N 0.737 120.335 119.600 -0.003 0.000 2.299 200 M HA 0.027 4.507 4.480 0.000 0.000 0.264 200 M C 2.373 178.671 176.300 -0.003 0.000 1.095 200 M CA 0.622 55.920 55.300 -0.003 0.000 1.165 200 M CB -0.737 31.861 32.600 -0.003 0.000 1.349 200 M HN 0.098 nan 8.290 nan 0.000 0.446 201 V N 0.788 120.700 119.914 -0.003 0.000 2.970 201 V HA -0.198 3.922 4.120 0.000 0.000 0.260 201 V C 2.116 178.208 176.094 -0.003 0.000 1.100 201 V CA 1.518 63.816 62.300 -0.003 0.000 1.122 201 V CB -0.308 31.513 31.823 -0.003 0.000 0.721 201 V HN 0.535 nan 8.190 nan 0.000 0.483 202 Q N -0.732 119.066 119.800 -0.003 0.000 2.250 202 Q HA -0.135 4.206 4.340 0.000 0.000 0.200 202 Q C 2.118 178.115 176.000 -0.004 0.000 0.941 202 Q CA 1.248 57.049 55.803 -0.004 0.000 0.872 202 Q CB 0.080 28.816 28.738 -0.003 0.000 0.965 202 Q HN 0.787 nan 8.270 nan 0.000 0.480 203 E N 1.443 121.640 120.200 -0.004 0.000 2.072 203 E HA -0.232 4.118 4.350 0.000 0.000 0.190 203 E C 1.362 177.959 176.600 -0.005 0.000 0.982 203 E CA 1.386 57.783 56.400 -0.005 0.000 0.803 203 E CB 0.034 29.731 29.700 -0.005 0.000 0.755 203 E HN 0.179 nan 8.360 nan 0.000 0.453 204 D N 0.152 120.549 120.400 -0.005 0.000 2.123 204 D HA -0.210 4.430 4.640 0.000 0.000 0.196 204 D C 2.063 178.360 176.300 -0.005 0.000 0.992 204 D CA 1.586 55.583 54.000 -0.005 0.000 0.833 204 D CB 0.011 40.809 40.800 -0.004 0.000 0.954 204 D HN 0.289 nan 8.370 nan 0.000 0.455 205 Q N -0.429 119.368 119.800 -0.004 0.000 2.084 205 Q HA -0.128 4.212 4.340 0.000 0.000 0.202 205 Q C 2.152 178.149 176.000 -0.005 0.000 0.978 205 Q CA 1.050 56.851 55.803 -0.004 0.000 0.844 205 Q CB 0.007 28.743 28.738 -0.004 0.000 0.898 205 Q HN 0.256 nan 8.270 nan 0.000 0.426 206 K N 0.438 120.835 120.400 -0.006 0.000 2.217 206 K HA -0.095 4.225 4.320 0.000 0.000 0.202 206 K C 2.006 178.601 176.600 -0.008 0.000 1.051 206 K CA 0.559 56.842 56.287 -0.007 0.000 0.952 206 K CB -0.081 32.414 32.500 -0.007 0.000 0.736 206 K HN 0.137 nan 8.250 nan 0.000 0.453 207 R N 0.785 121.280 120.500 -0.007 0.000 2.062 207 R HA -0.113 4.227 4.340 0.000 0.000 0.231 207 R C 2.397 178.692 176.300 -0.007 0.000 1.136 207 R CA 1.502 57.598 56.100 -0.008 0.000 0.948 207 R CB -0.174 30.122 30.300 -0.007 0.000 0.845 207 R HN 0.011 nan 8.270 nan 0.000 0.430 208 M N 1.229 120.825 119.600 -0.006 0.000 2.086 208 M HA -0.177 4.303 4.480 0.000 0.000 0.261 208 M C 1.901 178.197 176.300 -0.006 0.000 1.067 208 M CA 1.948 57.245 55.300 -0.006 0.000 1.116 208 M CB -0.347 32.251 32.600 -0.005 0.000 1.348 208 M HN 0.219 nan 8.290 nan 0.000 0.407 209 E N -0.347 119.850 120.200 -0.006 0.000 2.077 209 E HA -0.282 4.068 4.350 0.000 0.000 0.193 209 E C 2.077 178.673 176.600 -0.007 0.000 0.989 209 E CA 1.611 58.008 56.400 -0.006 0.000 0.800 209 E CB -0.191 29.506 29.700 -0.006 0.000 0.746 209 E HN 0.622 nan 8.360 nan 0.000 0.452 210 K N 0.458 120.853 120.400 -0.009 0.000 2.009 210 K HA -0.159 4.161 4.320 0.000 0.000 0.210 210 K C 2.156 178.749 176.600 -0.010 0.000 1.049 210 K CA 1.769 58.050 56.287 -0.011 0.000 0.929 210 K CB -0.179 32.313 32.500 -0.012 0.000 0.714 210 K HN 0.164 nan 8.250 nan 0.000 0.440 211 I N 0.375 120.940 120.570 -0.009 0.000 2.179 211 I HA -0.277 3.893 4.170 0.000 0.000 0.242 211 I C 2.588 178.700 176.117 -0.007 0.000 1.088 211 I CA 1.320 62.615 61.300 -0.008 0.000 1.357 211 I CB -0.314 37.682 38.000 -0.007 0.000 1.051 211 I HN 0.305 nan 8.210 nan 0.000 0.409 212 S N 0.508 116.204 115.700 -0.006 0.000 2.368 212 S HA -0.190 4.280 4.470 0.000 0.000 0.224 212 S C 2.107 176.704 174.600 -0.006 0.000 1.029 212 S CA 1.304 59.500 58.200 -0.006 0.000 0.988 212 S CB -0.114 63.083 63.200 -0.005 0.000 0.838 212 S HN 0.264 nan 8.310 nan 0.000 0.462 213 K N 0.358 120.755 120.400 -0.006 0.000 2.103 213 K HA -0.065 4.255 4.320 0.000 0.000 0.207 213 K C 2.511 179.107 176.600 -0.006 0.000 1.048 213 K CA 1.126 57.409 56.287 -0.006 0.000 0.930 213 K CB -0.141 32.355 32.500 -0.006 0.000 0.716 213 K HN 0.340 nan 8.250 nan 0.000 0.444 214 R N 0.139 120.635 120.500 -0.008 0.000 2.070 214 R HA -0.116 4.224 4.340 0.000 0.000 0.233 214 R C 2.339 178.636 176.300 -0.006 0.000 1.137 214 R CA 1.362 57.457 56.100 -0.008 0.000 0.945 214 R CB -0.521 29.774 30.300 -0.009 0.000 0.845 214 R HN -0.007 nan 8.270 nan 0.000 0.430 215 V N 2.026 121.936 119.914 -0.006 0.000 2.252 215 V HA -0.325 3.795 4.120 0.000 0.000 0.249 215 V C 1.835 177.927 176.094 -0.004 0.000 1.056 215 V CA 2.038 64.335 62.300 -0.005 0.000 1.022 215 V CB -0.595 31.226 31.823 -0.004 0.000 0.641 215 V HN 0.374 nan 8.190 nan 0.000 0.445 216 N N 0.193 118.891 118.700 -0.005 0.000 2.120 216 N HA -0.124 4.616 4.740 0.000 0.000 0.188 216 N C 1.842 177.349 175.510 -0.005 0.000 1.024 216 N CA 1.706 54.753 53.050 -0.005 0.000 0.852 216 N CB -0.647 37.837 38.487 -0.005 0.000 1.003 216 N HN 0.507 nan 8.380 nan 0.000 0.424 217 A N 1.189 124.006 122.820 -0.005 0.000 1.858 217 A HA -0.089 4.231 4.320 0.000 0.000 0.216 217 A C 2.354 179.936 177.584 -0.004 0.000 1.190 217 A CA 1.120 53.154 52.037 -0.005 0.000 0.617 217 A CB -0.806 18.192 19.000 -0.002 0.000 0.827 217 A HN 0.231 nan 8.150 nan 0.000 0.443 218 I N -0.482 120.086 120.570 -0.003 0.000 2.226 218 I HA -0.227 3.943 4.170 0.000 0.000 0.245 218 I C 2.567 178.682 176.117 -0.002 0.000 1.100 218 I CA 1.270 62.569 61.300 -0.002 0.000 1.374 218 I CB -0.357 37.642 38.000 -0.002 0.000 1.057 218 I HN 0.328 nan 8.210 nan 0.000 0.413 219 E N 0.613 120.811 120.200 -0.003 0.000 2.031 219 E HA -0.292 4.058 4.350 0.000 0.000 0.193 219 E C 2.002 178.600 176.600 -0.004 0.000 0.994 219 E CA 1.448 57.846 56.400 -0.003 0.000 0.800 219 E CB -0.298 29.400 29.700 -0.003 0.000 0.752 219 E HN 0.506 nan 8.360 nan 0.000 0.447 220 E N 0.603 120.800 120.200 -0.006 0.000 2.097 220 E HA -0.173 4.177 4.350 0.000 0.000 0.196 220 E C 2.141 178.735 176.600 -0.011 0.000 1.000 220 E CA 1.444 57.838 56.400 -0.010 0.000 0.804 220 E CB 0.032 29.725 29.700 -0.012 0.000 0.740 220 E HN -0.015 nan 8.360 nan 0.000 0.454 221 V N 1.474 121.383 119.914 -0.009 0.000 2.233 221 V HA -0.327 3.793 4.120 0.000 0.000 0.247 221 V C 2.058 178.150 176.094 -0.004 0.000 1.050 221 V CA 2.147 64.443 62.300 -0.008 0.000 1.010 221 V CB -0.755 31.065 31.823 -0.004 0.000 0.637 221 V HN 0.381 nan 8.190 nan 0.000 0.444 222 N N 0.756 119.455 118.700 -0.001 0.000 2.091 222 N HA -0.185 4.555 4.740 0.000 0.000 0.193 222 N C 1.621 177.131 175.510 0.001 0.000 1.021 222 N CA 1.752 54.803 53.050 0.002 0.000 0.862 222 N CB -0.709 37.779 38.487 0.002 0.000 1.018 222 N HN 0.489 nan 8.380 nan 0.000 0.429 223 N N 1.001 119.700 118.700 -0.001 0.000 2.058 223 N HA -0.055 4.685 4.740 0.000 0.000 0.191 223 N C 1.377 176.885 175.510 -0.003 0.000 1.037 223 N CA 0.879 53.928 53.050 -0.002 0.000 0.848 223 N CB -0.655 37.829 38.487 -0.004 0.000 1.021 223 N HN 0.470 nan 8.380 nan 0.000 0.422 224 N N 0.072 118.767 118.700 -0.009 0.000 2.142 224 N HA -0.073 4.667 4.740 0.000 0.000 0.186 224 N C 1.715 177.221 175.510 -0.007 0.000 1.023 224 N CA 0.715 53.757 53.050 -0.014 0.000 0.852 224 N CB 0.106 38.577 38.487 -0.027 0.000 0.998 224 N HN -0.048 nan 8.380 nan 0.000 0.424 225 V N 1.765 121.678 119.914 -0.001 0.000 2.295 225 V HA -0.245 3.875 4.120 0.000 0.000 0.246 225 V C 2.360 178.463 176.094 0.015 0.000 1.049 225 V CA 1.565 63.870 62.300 0.009 0.000 1.024 225 V CB -0.461 31.369 31.823 0.012 0.000 0.648 225 V HN 0.297 nan 8.190 nan 0.000 0.447 226 K N -0.380 120.027 120.400 0.012 0.000 2.026 226 K HA -0.210 4.110 4.320 0.000 0.000 0.208 226 K C 2.205 178.817 176.600 0.019 0.000 1.048 226 K CA 1.838 58.135 56.287 0.016 0.000 0.929 226 K CB -0.257 32.251 32.500 0.012 0.000 0.713 226 K HN 0.336 nan 8.250 nan 0.000 0.439 227 L N 1.354 122.586 121.223 0.014 0.000 2.027 227 L HA -0.141 4.199 4.340 0.000 0.000 0.206 227 L C 2.149 179.031 176.870 0.019 0.000 1.074 227 L CA 1.362 56.212 54.840 0.016 0.000 0.745 227 L CB -0.737 41.327 42.059 0.009 0.000 0.898 227 L HN 0.198 nan 8.230 nan 0.000 0.433 228 L N -0.768 120.462 121.223 0.011 0.000 2.127 228 L HA -0.194 4.146 4.340 0.000 0.000 0.211 228 L C 2.302 179.197 176.870 0.041 0.000 1.089 228 L CA 2.318 57.167 54.840 0.014 0.000 0.757 228 L CB -1.137 40.925 42.059 0.005 0.000 0.899 228 L HN 0.381 nan 8.230 nan 0.000 0.434 229 T N -0.658 113.920 114.554 0.041 0.000 2.668 229 T HA -0.161 4.189 4.350 0.000 0.000 0.262 229 T C 1.651 176.384 174.700 0.053 0.000 1.045 229 T CA 1.563 63.692 62.100 0.049 0.000 1.152 229 T CB -0.098 68.793 68.868 0.039 0.000 0.864 229 T HN 0.448 nan 8.240 nan 0.000 0.419 230 E N 0.700 120.929 120.200 0.048 0.000 2.086 230 E HA -0.212 4.138 4.350 0.000 0.000 0.205 230 E C 2.273 178.924 176.600 0.084 0.000 1.027 230 E CA 1.558 57.991 56.400 0.055 0.000 0.830 230 E CB -0.268 29.459 29.700 0.045 0.000 0.751 230 E HN 0.477 nan 8.360 nan 0.000 0.456 231 M N 0.206 119.857 119.600 0.085 0.000 2.086 231 M HA -0.159 4.321 4.480 0.000 0.000 0.261 231 M C 2.504 178.892 176.300 0.147 0.000 1.067 231 M CA 1.104 56.476 55.300 0.121 0.000 1.116 231 M CB -0.213 32.403 32.600 0.028 0.000 1.348 231 M HN 0.023 nan 8.290 nan 0.000 0.407 232 V N 0.309 120.271 119.914 0.081 0.000 2.407 232 V HA -0.277 3.843 4.120 0.000 0.000 0.248 232 V C 2.530 178.693 176.094 0.115 0.000 1.055 232 V CA 1.396 63.746 62.300 0.084 0.000 1.049 232 V CB -0.532 31.344 31.823 0.089 0.000 0.662 232 V HN 0.456 nan 8.190 nan 0.000 0.455 233 M N 0.592 120.253 119.600 0.103 0.000 2.132 233 M HA -0.092 4.388 4.480 0.000 0.000 0.263 233 M C 2.597 178.951 176.300 0.090 0.000 1.065 233 M CA 2.234 57.582 55.300 0.079 0.000 1.122 233 M CB -1.560 31.075 32.600 0.058 0.000 1.365 233 M HN 0.627 nan 8.290 nan 0.000 0.411 234 S N -0.756 115.018 115.700 0.124 0.000 2.399 234 S HA -0.174 4.296 4.470 0.000 0.000 0.231 234 S C 1.570 176.181 174.600 0.019 0.000 1.022 234 S CA 1.290 59.534 58.200 0.073 0.000 0.983 234 S CB -0.799 62.452 63.200 0.084 0.000 0.803 234 S HN 0.534 nan 8.310 nan 0.000 0.480 235 H N 1.031 120.110 119.070 0.015 0.000 2.539 235 H HA 0.393 4.949 4.556 0.000 0.000 0.267 235 H C 0.939 176.266 175.328 -0.001 0.000 0.982 235 H CA 0.297 56.350 56.048 0.008 0.000 1.146 235 H CB -0.096 29.675 29.762 0.014 0.000 1.382 235 H HN 0.410 nan 8.280 nan 0.000 0.577 236 S N 2.088 117.845 115.700 0.095 0.000 4.175 236 S HA -0.024 4.446 4.470 0.000 0.000 0.193 236 S C -0.180 174.431 174.600 0.018 0.000 1.373 236 S CA -0.472 57.755 58.200 0.046 0.000 0.908 236 S CB -0.624 62.600 63.200 0.039 0.000 1.547 236 S HN 0.359 nan 8.310 nan 0.000 0.440 237 Q N 0.097 119.903 119.800 0.010 0.000 2.453 237 Q HA -0.173 4.167 4.340 0.000 0.000 0.330 237 Q C 0.462 176.451 176.000 -0.018 0.000 1.417 237 Q CA 1.138 56.937 55.803 -0.007 0.000 0.902 237 Q CB -2.072 26.663 28.738 -0.004 0.000 1.154 237 Q HN 0.821 nan 8.270 nan 0.000 0.395 238 G N -0.934 107.843 108.800 -0.037 0.000 3.226 238 G HA2 0.514 4.474 3.960 0.000 0.000 0.175 238 G HA3 0.514 4.474 3.960 0.000 0.000 0.175 238 G C -0.052 174.802 174.900 -0.078 0.000 1.509 238 G CA 0.236 45.309 45.100 -0.046 0.000 1.046 238 G HN 0.487 nan 8.290 nan 0.000 0.768 239 G N 0.535 109.268 108.800 -0.111 0.000 2.335 239 G HA2 0.746 4.706 3.960 0.000 0.000 0.314 239 G HA3 0.746 4.706 3.960 0.000 0.000 0.314 239 G C -0.316 174.397 174.900 -0.312 0.000 1.129 239 G CA 0.860 45.871 45.100 -0.148 0.000 0.912 239 G HN 1.036 nan 8.290 nan 0.000 0.443 240 A N 1.446 124.098 122.820 -0.280 0.000 2.443 240 A HA 0.972 5.292 4.320 0.000 0.000 0.278 240 A C 0.551 178.039 177.584 -0.160 0.000 1.252 240 A CA 0.087 51.880 52.037 -0.406 0.000 0.816 240 A CB 1.456 20.322 19.000 -0.223 0.000 1.369 240 A HN 1.819 nan 8.150 nan 0.000 0.446 241 A N -2.499 120.312 122.820 -0.015 0.000 2.212 241 A HA 0.702 5.022 4.320 0.000 0.000 0.169 241 A C 1.117 178.751 177.584 0.084 0.000 1.802 241 A CA 1.653 53.723 52.037 0.055 0.000 1.344 241 A CB -0.979 18.075 19.000 0.090 0.000 1.566 241 A HN 2.839 nan 8.150 nan 0.000 0.419 242 A N -1.223 121.682 122.820 0.141 0.000 5.699 242 A HA 0.241 4.561 4.320 0.000 0.000 0.280 242 A C 2.237 179.868 177.584 0.079 0.000 2.071 242 A CA 2.085 54.185 52.037 0.105 0.000 0.714 242 A CB -2.030 17.007 19.000 0.062 0.000 1.162 242 A HN 2.435 nan 8.150 nan 0.000 0.363 243 G N -2.248 106.583 108.800 0.052 0.000 2.850 243 G HA2 -0.367 3.593 3.960 0.000 0.000 0.353 243 G HA3 -0.367 3.593 3.960 0.000 0.000 0.353 243 G C 1.736 176.660 174.900 0.040 0.000 0.983 243 G CA 2.805 47.928 45.100 0.040 0.000 0.832 243 G HN 2.247 nan 8.290 nan 0.000 0.889 244 S N 0.021 115.745 115.700 0.039 0.000 2.399 244 S HA -0.033 4.437 4.470 0.000 0.000 0.231 244 S C 2.694 177.318 174.600 0.039 0.000 1.022 244 S CA 1.678 59.899 58.200 0.035 0.000 0.983 244 S CB -0.272 62.946 63.200 0.031 0.000 0.803 244 S HN 0.542 nan 8.310 nan 0.000 0.480 245 S N 0.894 116.631 115.700 0.062 0.000 2.383 245 S HA -0.111 4.359 4.470 0.000 0.000 0.227 245 S C 1.916 176.522 174.600 0.010 0.000 1.026 245 S CA 0.976 59.217 58.200 0.069 0.000 0.981 245 S CB -0.220 63.101 63.200 0.201 0.000 0.818 245 S HN 0.660 nan 8.310 nan 0.000 0.472 246 E N 1.025 121.244 120.200 0.031 0.000 2.072 246 E HA -0.203 4.147 4.350 0.000 0.000 0.191 246 E C 1.126 177.746 176.600 0.033 0.000 0.985 246 E CA 1.308 57.722 56.400 0.025 0.000 0.801 246 E CB -0.088 29.636 29.700 0.040 0.000 0.750 246 E HN 0.284 nan 8.360 nan 0.000 0.452 247 D N 0.651 121.068 120.400 0.028 0.000 2.097 247 D HA -0.165 4.475 4.640 0.000 0.000 0.195 247 D C 1.988 178.292 176.300 0.007 0.000 0.989 247 D CA 0.791 54.804 54.000 0.022 0.000 0.827 247 D CB -0.263 40.549 40.800 0.020 0.000 0.966 247 D HN 0.215 nan 8.370 nan 0.000 0.456 248 L N -0.014 121.209 121.223 0.000 0.000 2.093 248 L HA -0.017 4.323 4.340 0.000 0.000 0.208 248 L C 2.153 179.000 176.870 -0.039 0.000 1.085 248 L CA 1.386 56.218 54.840 -0.013 0.000 0.755 248 L CB -0.337 41.720 42.059 -0.003 0.000 0.904 248 L HN -0.016 nan 8.230 nan 0.000 0.435 249 M N -0.882 118.690 119.600 -0.047 0.000 2.175 249 M HA -0.197 4.283 4.480 0.000 0.000 0.264 249 M C 2.289 178.467 176.300 -0.203 0.000 1.063 249 M CA 1.597 56.845 55.300 -0.088 0.000 1.119 249 M CB -0.236 32.361 32.600 -0.005 0.000 1.377 249 M HN 0.238 nan 8.290 nan 0.000 0.415 250 K N 0.393 120.739 120.400 -0.090 0.000 2.002 250 K HA -0.191 4.129 4.320 0.000 0.000 0.209 250 K C 1.850 178.413 176.600 -0.061 0.000 1.048 250 K CA 1.372 57.616 56.287 -0.071 0.000 0.930 250 K CB 0.026 32.560 32.500 0.058 0.000 0.714 250 K HN 0.126 nan 8.250 nan 0.000 0.438 251 E N 1.024 121.197 120.200 -0.044 0.000 2.049 251 E HA -0.217 4.133 4.350 0.000 0.000 0.198 251 E C 2.159 178.713 176.600 -0.076 0.000 1.007 251 E CA 1.306 57.678 56.400 -0.046 0.000 0.809 251 E CB -0.351 29.329 29.700 -0.033 0.000 0.749 251 E HN 0.365 nan 8.360 nan 0.000 0.450 252 L N -0.208 120.963 121.223 -0.086 0.000 2.042 252 L HA -0.231 4.109 4.340 0.000 0.000 0.210 252 L C 2.606 179.400 176.870 -0.125 0.000 1.076 252 L CA 1.602 56.387 54.840 -0.091 0.000 0.749 252 L CB -0.605 41.409 42.059 -0.076 0.000 0.893 252 L HN 0.187 nan 8.230 nan 0.000 0.432 253 Y N 0.652 120.749 120.300 -0.339 0.000 2.165 253 Y HA -0.315 4.235 4.550 -0.000 0.000 0.286 253 Y C 2.683 178.457 175.900 -0.210 0.000 1.155 253 Y CA 1.742 59.602 58.100 -0.400 0.000 1.164 253 Y CB -0.037 37.897 38.460 -0.878 0.000 0.978 253 Y HN 0.212 nan 8.280 nan 0.000 0.513 254 Q N -0.206 119.426 119.800 -0.280 0.000 2.083 254 Q HA -0.136 4.204 4.340 0.000 0.000 0.198 254 Q C 2.304 178.158 176.000 -0.243 0.000 0.969 254 Q CA 1.238 56.863 55.803 -0.296 0.000 0.838 254 Q CB -0.189 28.479 28.738 -0.117 0.000 0.900 254 Q HN 0.480 nan 8.270 nan 0.000 0.436 255 R N 0.032 120.432 120.500 -0.166 0.000 2.105 255 R HA -0.147 4.193 4.340 0.000 0.000 0.239 255 R C 2.362 178.580 176.300 -0.137 0.000 1.135 255 R CA 1.340 57.367 56.100 -0.122 0.000 0.967 255 R CB -0.438 29.812 30.300 -0.083 0.000 0.861 255 R HN 0.312 nan 8.270 nan 0.000 0.442 256 C N 0.381 119.573 119.300 -0.180 0.000 2.446 256 C HA -0.054 4.406 4.460 0.000 0.000 0.277 256 C C 2.386 177.262 174.990 -0.191 0.000 1.275 256 C CA 0.583 59.506 59.018 -0.159 0.000 1.727 256 C CB -0.607 27.052 27.740 -0.135 0.000 2.010 256 C HN 0.512 nan 8.230 nan 0.000 0.486 257 E N 0.095 120.108 120.200 -0.312 0.000 2.106 257 E HA -0.145 4.205 4.350 0.000 0.000 0.192 257 E C 2.363 178.868 176.600 -0.158 0.000 0.984 257 E CA 0.790 57.029 56.400 -0.269 0.000 0.806 257 E CB -0.155 29.311 29.700 -0.389 0.000 0.750 257 E HN 0.570 nan 8.360 nan 0.000 0.458 258 R N -0.166 120.246 120.500 -0.146 0.000 2.189 258 R HA 0.024 4.364 4.340 0.000 0.000 0.218 258 R C 2.075 178.338 176.300 -0.062 0.000 1.074 258 R CA 0.615 56.658 56.100 -0.094 0.000 0.991 258 R CB 0.055 30.303 30.300 -0.086 0.000 0.883 258 R HN 0.151 nan 8.270 nan 0.000 0.457 259 M N -0.124 119.439 119.600 -0.063 0.000 2.506 259 M HA -0.017 4.463 4.480 0.000 0.000 0.260 259 M C 1.667 177.960 176.300 -0.012 0.000 1.104 259 M CA 1.137 56.418 55.300 -0.033 0.000 1.112 259 M CB -0.146 32.434 32.600 -0.033 0.000 1.401 259 M HN 0.055 nan 8.290 nan 0.000 0.473 260 R N 0.247 120.733 120.500 -0.023 0.000 2.073 260 R HA -0.140 4.200 4.340 0.000 0.000 0.234 260 R C -0.641 175.682 176.300 0.038 0.000 1.134 260 R CA 1.413 57.516 56.100 0.004 0.000 0.952 260 R CB -1.908 28.381 30.300 -0.018 0.000 0.850 260 R HN 0.258 nan 8.270 nan 0.000 0.433 261 P HA -0.128 nan 4.420 nan 0.000 0.216 261 P C 1.067 178.428 177.300 0.101 0.000 1.153 261 P CA 1.538 64.660 63.100 0.037 0.000 0.858 261 P CB -0.128 31.567 31.700 -0.008 0.000 0.789 262 T N -0.113 114.472 114.554 0.052 0.000 2.720 262 T HA -0.137 4.213 4.350 0.000 0.000 0.268 262 T C 1.640 176.378 174.700 0.063 0.000 1.037 262 T CA 1.165 63.293 62.100 0.048 0.000 1.144 262 T CB -0.842 68.036 68.868 0.018 0.000 0.864 262 T HN -0.046 nan 8.240 nan 0.000 0.444 263 L N 0.208 121.471 121.223 0.067 0.000 2.201 263 L HA 0.129 4.469 4.340 0.000 0.000 0.212 263 L C 1.912 178.837 176.870 0.093 0.000 1.105 263 L CA 1.196 56.073 54.840 0.062 0.000 0.775 263 L CB -1.023 41.069 42.059 0.055 0.000 0.913 263 L HN 0.274 nan 8.230 nan 0.000 0.440 264 F N 0.190 120.133 119.950 -0.013 0.000 2.163 264 F HA -0.148 4.379 4.527 0.000 0.000 0.297 264 F C 2.552 178.346 175.800 -0.009 0.000 1.094 264 F CA 1.293 59.287 58.000 -0.010 0.000 1.290 264 F CB -0.091 38.903 39.000 -0.010 0.000 1.017 264 F HN -0.077 nan 8.300 nan 0.000 0.483 265 R N 0.329 120.906 120.500 0.128 0.000 2.092 265 R HA -0.084 4.256 4.340 0.000 0.000 0.231 265 R C 2.239 178.505 176.300 -0.056 0.000 1.119 265 R CA 1.526 57.636 56.100 0.016 0.000 0.970 265 R CB -0.614 29.739 30.300 0.088 0.000 0.864 265 R HN 0.387 nan 8.270 nan 0.000 0.440 266 L N 0.156 121.360 121.223 -0.031 0.000 2.093 266 L HA -0.085 4.255 4.340 0.000 0.000 0.208 266 L C 2.615 179.439 176.870 -0.077 0.000 1.085 266 L CA 1.094 55.909 54.840 -0.041 0.000 0.755 266 L CB -0.571 41.477 42.059 -0.019 0.000 0.904 266 L HN 0.205 nan 8.230 nan 0.000 0.435 267 A N 0.039 122.793 122.820 -0.110 0.000 2.067 267 A HA -0.148 4.172 4.320 0.000 0.000 0.219 267 A C 2.318 179.796 177.584 -0.177 0.000 1.158 267 A CA 1.532 53.489 52.037 -0.132 0.000 0.661 267 A CB -0.479 18.439 19.000 -0.136 0.000 0.801 267 A HN 0.506 nan 8.150 nan 0.000 0.452 268 S N -1.299 114.255 115.700 -0.244 0.000 2.650 268 S HA 0.060 4.530 4.470 0.000 0.000 0.219 268 S C 0.306 174.831 174.600 -0.125 0.000 0.960 268 S CA 0.688 58.758 58.200 -0.217 0.000 0.925 268 S CB -0.116 62.920 63.200 -0.273 0.000 0.775 268 S HN 0.369 nan 8.310 nan 0.000 0.525 269 D N 1.820 122.162 120.400 -0.096 0.000 2.957 269 D HA 0.191 4.831 4.640 0.000 0.000 0.352 269 D C 0.306 176.576 176.300 -0.049 0.000 1.352 269 D CA -0.081 53.882 54.000 -0.061 0.000 0.831 269 D CB 0.310 41.082 40.800 -0.047 0.000 1.147 269 D HN 0.359 nan 8.370 nan 0.000 0.467 270 T N -1.772 112.750 114.554 -0.053 0.000 3.415 270 T HA 0.275 4.625 4.350 0.000 0.000 0.282 270 T C 0.127 174.805 174.700 -0.035 0.000 1.007 270 T CA -0.708 61.367 62.100 -0.041 0.000 0.958 270 T CB -0.248 68.594 68.868 -0.043 0.000 1.171 270 T HN -0.137 nan 8.240 nan 0.000 0.500 271 E N 2.687 122.867 120.200 -0.034 0.000 2.966 271 E HA 0.029 4.379 4.350 0.000 0.000 0.254 271 E C 0.550 177.137 176.600 -0.022 0.000 0.923 271 E CA 0.739 57.123 56.400 -0.028 0.000 0.960 271 E CB -0.235 29.451 29.700 -0.024 0.000 0.901 271 E HN 0.353 nan 8.360 nan 0.000 0.525 272 D N 1.130 121.518 120.400 -0.020 0.000 3.077 272 D HA -0.218 4.422 4.640 0.000 0.000 0.217 272 D C -0.395 175.896 176.300 -0.015 0.000 1.162 272 D CA 0.976 54.966 54.000 -0.016 0.000 0.943 272 D CB -0.724 40.068 40.800 -0.014 0.000 1.122 272 D HN 0.458 nan 8.370 nan 0.000 0.413 273 N N 0.915 119.604 118.700 -0.018 0.000 2.804 273 N HA 0.104 4.844 4.740 0.000 0.000 0.251 273 N C 0.127 175.626 175.510 -0.017 0.000 1.250 273 N CA -0.343 52.697 53.050 -0.016 0.000 0.820 273 N CB 0.928 39.405 38.487 -0.016 0.000 1.156 273 N HN -0.225 nan 8.380 nan 0.000 0.512 274 D N 1.286 121.677 120.400 -0.015 0.000 2.219 274 D HA -0.108 4.532 4.640 0.000 0.000 0.205 274 D C 1.031 177.324 176.300 -0.012 0.000 0.970 274 D CA 1.136 55.127 54.000 -0.015 0.000 0.851 274 D CB 0.519 41.312 40.800 -0.012 0.000 0.943 274 D HN 0.584 nan 8.370 nan 0.000 0.488 275 E N 1.002 121.196 120.200 -0.011 0.000 2.077 275 E HA -0.101 4.250 4.350 0.000 0.000 0.193 275 E C 2.041 178.635 176.600 -0.010 0.000 0.989 275 E CA 1.280 57.675 56.400 -0.009 0.000 0.800 275 E CB -0.462 29.233 29.700 -0.007 0.000 0.746 275 E HN 0.232 nan 8.360 nan 0.000 0.452 276 A N 0.992 123.804 122.820 -0.012 0.000 1.873 276 A HA -0.109 4.211 4.320 0.000 0.000 0.215 276 A C 2.160 179.734 177.584 -0.017 0.000 1.186 276 A CA 1.215 53.244 52.037 -0.014 0.000 0.616 276 A CB -0.754 18.236 19.000 -0.016 0.000 0.823 276 A HN 0.251 nan 8.150 nan 0.000 0.442 277 L N 0.131 121.341 121.223 -0.021 0.000 2.021 277 L HA -0.199 4.141 4.340 0.000 0.000 0.215 277 L C 2.681 179.541 176.870 -0.016 0.000 1.074 277 L CA 2.403 57.228 54.840 -0.025 0.000 0.760 277 L CB -1.018 41.023 42.059 -0.030 0.000 0.889 277 L HN 0.385 nan 8.230 nan 0.000 0.433 278 A N -1.012 121.801 122.820 -0.011 0.000 1.908 278 A HA -0.261 4.059 4.320 0.000 0.000 0.218 278 A C 2.184 179.767 177.584 -0.003 0.000 1.181 278 A CA 1.933 53.967 52.037 -0.006 0.000 0.627 278 A CB -0.697 18.301 19.000 -0.004 0.000 0.818 278 A HN 0.635 nan 8.150 nan 0.000 0.445 279 E N -0.518 119.680 120.200 -0.004 0.000 2.118 279 E HA -0.173 4.177 4.350 0.000 0.000 0.195 279 E C 1.900 178.500 176.600 -0.001 0.000 0.992 279 E CA 1.235 57.634 56.400 -0.002 0.000 0.804 279 E CB -0.292 29.406 29.700 -0.004 0.000 0.741 279 E HN 0.721 nan 8.360 nan 0.000 0.458 280 I N 0.842 121.409 120.570 -0.004 0.000 2.226 280 I HA -0.291 3.879 4.170 0.000 0.000 0.245 280 I C 2.300 178.421 176.117 0.007 0.000 1.100 280 I CA 1.003 62.302 61.300 -0.001 0.000 1.374 280 I CB -0.139 37.854 38.000 -0.011 0.000 1.057 280 I HN 0.118 nan 8.210 nan 0.000 0.413 281 L N 0.005 121.231 121.223 0.005 0.000 2.044 281 L HA -0.225 4.115 4.340 0.000 0.000 0.205 281 L C 2.699 179.578 176.870 0.015 0.000 1.075 281 L CA 1.340 56.188 54.840 0.013 0.000 0.747 281 L CB -0.677 41.388 42.059 0.009 0.000 0.903 281 L HN 0.323 nan 8.230 nan 0.000 0.435 282 Q N 0.559 120.365 119.800 0.010 0.000 2.077 282 Q HA -0.273 4.067 4.340 0.000 0.000 0.206 282 Q C 2.234 178.242 176.000 0.013 0.000 0.989 282 Q CA 2.289 58.099 55.803 0.011 0.000 0.853 282 Q CB -0.183 28.560 28.738 0.008 0.000 0.907 282 Q HN 0.464 nan 8.270 nan 0.000 0.418 283 A N 0.817 123.644 122.820 0.011 0.000 1.908 283 A HA -0.266 4.054 4.320 0.000 0.000 0.218 283 A C 1.879 179.472 177.584 0.015 0.000 1.181 283 A CA 1.794 53.838 52.037 0.011 0.000 0.627 283 A CB -1.074 17.930 19.000 0.007 0.000 0.818 283 A HN 0.676 nan 8.150 nan 0.000 0.445 284 N N -0.107 118.605 118.700 0.020 0.000 2.223 284 N HA -0.158 4.582 4.740 0.000 0.000 0.185 284 N C 1.103 176.628 175.510 0.025 0.000 1.016 284 N CA 1.699 54.765 53.050 0.027 0.000 0.863 284 N CB -0.215 38.298 38.487 0.042 0.000 0.983 284 N HN 0.395 nan 8.380 nan 0.000 0.429 285 D N -0.226 120.189 120.400 0.024 0.000 2.117 285 D HA -0.093 4.547 4.640 0.000 0.000 0.198 285 D C 1.388 177.702 176.300 0.024 0.000 0.982 285 D CA 0.894 54.908 54.000 0.024 0.000 0.828 285 D CB -0.537 40.276 40.800 0.021 0.000 0.967 285 D HN 0.492 nan 8.370 nan 0.000 0.464 286 N N 0.184 118.896 118.700 0.020 0.000 2.149 286 N HA -0.101 4.639 4.740 0.000 0.000 0.188 286 N C 1.945 177.470 175.510 0.024 0.000 1.019 286 N CA 0.465 53.527 53.050 0.021 0.000 0.857 286 N CB -0.007 38.490 38.487 0.016 0.000 0.997 286 N HN 0.141 nan 8.380 nan 0.000 0.426 287 L N 0.508 121.742 121.223 0.019 0.000 2.027 287 L HA -0.131 4.209 4.340 0.000 0.000 0.206 287 L C 2.417 179.305 176.870 0.030 0.000 1.074 287 L CA 1.138 55.988 54.840 0.016 0.000 0.745 287 L CB -0.749 41.312 42.059 0.002 0.000 0.898 287 L HN 0.189 nan 8.230 nan 0.000 0.433 288 T N -1.009 113.563 114.554 0.031 0.000 2.684 288 T HA -0.292 4.058 4.350 0.000 0.000 0.267 288 T C 1.795 176.528 174.700 0.055 0.000 1.036 288 T CA 1.560 63.685 62.100 0.042 0.000 1.148 288 T CB -0.173 68.716 68.868 0.034 0.000 0.863 288 T HN 0.328 nan 8.240 nan 0.000 0.436 289 Q N 0.171 119.999 119.800 0.047 0.000 2.014 289 Q HA -0.144 4.196 4.340 0.000 0.000 0.207 289 Q C 2.418 178.458 176.000 0.067 0.000 0.993 289 Q CA 1.792 57.624 55.803 0.049 0.000 0.850 289 Q CB -0.502 28.259 28.738 0.038 0.000 0.916 289 Q HN 0.354 nan 8.270 nan 0.000 0.417 290 V N 1.366 121.322 119.914 0.069 0.000 2.490 290 V HA -0.216 3.904 4.120 0.000 0.000 0.250 290 V C 2.266 178.449 176.094 0.148 0.000 1.061 290 V CA 1.701 64.056 62.300 0.091 0.000 1.064 290 V CB -0.518 31.347 31.823 0.070 0.000 0.670 290 V HN 0.607 nan 8.190 nan 0.000 0.461 291 I N -0.840 119.824 120.570 0.157 0.000 2.916 291 I HA -0.106 4.064 4.170 0.000 0.000 0.267 291 I C 1.878 178.143 176.117 0.246 0.000 1.263 291 I CA 1.635 63.109 61.300 0.289 0.000 1.471 291 I CB -0.466 37.703 38.000 0.282 0.000 1.089 291 I HN 0.243 nan 8.210 nan 0.000 0.468 292 N N 1.364 120.150 118.700 0.143 0.000 2.173 292 N HA 0.008 4.748 4.740 0.000 0.000 0.184 292 N C 1.802 177.352 175.510 0.067 0.000 1.025 292 N CA 1.579 54.683 53.050 0.090 0.000 0.852 292 N CB -0.381 38.143 38.487 0.061 0.000 0.998 292 N HN 0.389 nan 8.380 nan 0.000 0.427 293 L N -0.319 120.950 121.223 0.078 0.000 1.994 293 L HA -0.205 4.135 4.340 0.000 0.000 0.208 293 L C 2.244 179.141 176.870 0.046 0.000 1.071 293 L CA 1.331 56.204 54.840 0.055 0.000 0.745 293 L CB -0.774 41.324 42.059 0.065 0.000 0.892 293 L HN 0.131 nan 8.230 nan 0.000 0.431 294 Y N 1.331 121.609 120.300 -0.036 0.000 2.102 294 Y HA -0.363 4.187 4.550 -0.000 0.000 0.280 294 Y C 2.603 178.394 175.900 -0.182 0.000 1.178 294 Y CA 1.915 59.944 58.100 -0.117 0.000 1.146 294 Y CB -0.254 38.105 38.460 -0.168 0.000 0.968 294 Y HN 0.007 nan 8.280 nan 0.000 0.504 295 K N -0.296 119.989 120.400 -0.193 0.000 2.097 295 K HA -0.207 4.113 4.320 0.000 0.000 0.206 295 K C 2.248 178.716 176.600 -0.220 0.000 1.049 295 K CA 1.849 57.986 56.287 -0.249 0.000 0.933 295 K CB -0.185 32.273 32.500 -0.070 0.000 0.717 295 K HN 0.492 nan 8.250 nan 0.000 0.442 296 Q N 0.257 119.974 119.800 -0.138 0.000 2.016 296 Q HA -0.136 4.204 4.340 0.000 0.000 0.200 296 Q C 2.062 177.976 176.000 -0.143 0.000 0.978 296 Q CA 1.044 56.785 55.803 -0.104 0.000 0.833 296 Q CB -0.176 28.529 28.738 -0.054 0.000 0.895 296 Q HN 0.271 nan 8.270 nan 0.000 0.427 297 L N 0.697 121.815 121.223 -0.174 0.000 2.043 297 L HA -0.175 4.165 4.340 0.000 0.000 0.212 297 L C 2.160 178.874 176.870 -0.260 0.000 1.075 297 L CA 1.572 56.301 54.840 -0.185 0.000 0.752 297 L CB -0.516 41.434 42.059 -0.182 0.000 0.891 297 L HN 0.146 nan 8.230 nan 0.000 0.432 298 V N 0.982 120.638 119.914 -0.430 0.000 2.809 298 V HA -0.155 3.965 4.120 0.000 0.000 0.256 298 V C 2.196 178.150 176.094 -0.233 0.000 1.080 298 V CA 1.720 63.769 62.300 -0.418 0.000 1.102 298 V CB -0.456 30.965 31.823 -0.670 0.000 0.705 298 V HN 0.600 nan 8.190 nan 0.000 0.475 299 R N -0.751 119.638 120.500 -0.184 0.000 2.629 299 R HA 0.391 4.731 4.340 0.000 0.000 0.386 299 R C 1.079 177.330 176.300 -0.082 0.000 1.071 299 R CA 0.676 56.706 56.100 -0.116 0.000 1.104 299 R CB 0.321 30.561 30.300 -0.100 0.000 1.370 299 R HN 0.274 nan 8.270 nan 0.000 0.574 300 G N 0.916 109.667 108.800 -0.082 0.000 2.176 300 G HA2 -0.316 3.644 3.960 0.000 0.000 0.253 300 G HA3 -0.316 3.644 3.960 0.000 0.000 0.253 300 G C -0.035 174.838 174.900 -0.045 0.000 0.979 300 G CA 0.350 45.417 45.100 -0.056 0.000 0.641 300 G HN 0.488 nan 8.290 nan 0.000 0.530 301 E N 0.770 120.941 120.200 -0.049 0.000 2.585 301 E HA 0.453 4.803 4.350 0.000 0.000 0.256 301 E C 1.246 177.829 176.600 -0.028 0.000 1.383 301 E CA 0.382 56.761 56.400 -0.035 0.000 1.029 301 E CB 0.289 29.968 29.700 -0.034 0.000 1.044 301 E HN 0.740 nan 8.360 nan 0.000 0.595 302 E N -0.465 119.724 120.200 -0.019 0.000 3.751 302 E HA 0.452 4.802 4.350 0.000 0.000 0.281 302 E C -0.014 176.581 176.600 -0.008 0.000 1.086 302 E CA -0.552 55.841 56.400 -0.012 0.000 1.579 302 E CB 0.355 30.050 29.700 -0.008 0.000 1.666 302 E HN 0.371 nan 8.360 nan 0.000 0.655 303 V N 0.000 119.913 119.914 -0.002 0.000 2.409 303 V HA 0.000 4.120 4.120 0.000 0.000 0.244 303 V CA 0.000 62.302 62.300 0.003 0.000 1.235 303 V CB 0.000 31.826 31.823 0.005 0.000 1.184 303 V HN 0.000 nan 8.190 nan 0.000 0.556