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 1fhs_1_A DATA FIRST_RESID 1 DATA SEQUENCE GIEMKPHPWF FGKIPRAKAE EMLSKQRHDG AFLIRESESA PGDFSLSVKF DATA SEQUENCE GNDVQHFKVL RDGAGKYFLW VVKFNSLNEL VDYHRSTSVS RNQQIFLRDI DATA SEQUENCE EQVPQQPTYV QA 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 1 G HA2 0.000 nan 3.960 nan 0.000 0.244 1 G HA3 0.000 3.954 3.960 -0.010 0.000 0.244 1 G C 0.000 174.894 174.900 -0.009 0.000 0.946 1 G CA 0.000 45.097 45.100 -0.006 0.000 0.502 2 I N 2.828 123.388 120.570 -0.017 0.000 3.083 2 I HA 0.162 4.322 4.170 -0.018 0.000 0.336 2 I C -1.497 174.599 176.117 -0.035 0.000 1.497 2 I CA 0.063 61.350 61.300 -0.021 0.000 0.936 2 I CB -0.230 37.760 38.000 -0.017 0.000 1.671 2 I HN 0.015 8.214 8.210 -0.018 0.000 0.535 3 E N 3.093 123.268 120.200 -0.042 0.000 2.055 3 E HA 0.074 4.377 4.350 -0.078 0.000 0.274 3 E C -1.344 175.205 176.600 -0.084 0.000 0.949 3 E CA -0.718 55.641 56.400 -0.068 0.000 0.775 3 E CB -0.016 29.648 29.700 -0.060 0.000 1.097 3 E HN -0.183 8.158 8.360 -0.032 0.000 0.404 4 M N 4.852 124.387 119.600 -0.109 0.000 2.080 4 M HA 0.020 4.458 4.480 -0.069 0.000 0.350 4 M C -0.805 175.388 176.300 -0.179 0.000 1.173 4 M CA -0.574 54.666 55.300 -0.100 0.000 1.052 4 M CB 0.872 33.438 32.600 -0.057 0.000 1.577 4 M HN 0.239 8.460 8.290 -0.115 0.000 0.455 5 K N 4.152 124.480 120.400 -0.119 0.000 5.423 5 K HA -0.227 4.045 4.320 -0.079 0.000 0.410 5 K C -2.184 174.233 176.600 -0.305 0.000 0.929 5 K CA 0.043 56.259 56.287 -0.118 0.000 1.129 5 K CB -0.668 31.829 32.500 -0.004 0.000 1.934 5 K HN 0.308 8.512 8.250 -0.077 0.000 0.348 6 P HA -0.132 4.158 4.420 -0.317 -0.060 0.258 6 P C -1.226 175.964 177.300 -0.184 0.000 1.172 6 P CA 0.273 63.231 63.100 -0.237 0.000 0.762 6 P CB 0.388 32.026 31.700 -0.102 0.000 0.764 7 H N 4.921 123.924 119.070 -0.111 0.000 2.652 7 H HA 0.286 4.727 4.556 -0.192 0.000 0.298 7 H C -1.046 174.157 175.328 -0.209 0.000 1.076 7 H CA -3.686 52.269 56.048 -0.154 0.000 1.360 7 H CB 0.041 29.739 29.762 -0.107 0.000 1.421 7 H HN 0.183 8.241 8.280 -0.369 0.000 0.464 8 P HA 0.237 3.934 4.420 -1.206 0.000 0.292 8 P C -1.517 175.381 177.300 -0.671 0.000 1.326 8 P CA -0.176 62.209 63.100 -1.191 0.000 0.787 8 P CB 0.754 31.264 31.700 -1.983 0.000 0.903 9 W N 2.648 124.111 121.300 0.271 0.000 1.590 9 W HA 0.208 5.212 4.660 0.287 -0.172 0.299 9 W C -2.322 174.475 176.519 0.463 0.000 0.872 9 W CA -1.399 56.134 57.345 0.313 0.000 1.961 9 W CB 0.921 30.553 29.460 0.286 0.000 2.140 9 W HN 0.156 8.842 8.180 0.844 0.000 0.433 10 F N 2.992 123.178 119.950 0.394 0.000 2.411 10 F HA 0.352 5.306 4.527 0.456 -0.153 0.355 10 F C -1.193 174.738 175.800 0.217 0.000 1.117 10 F CA -0.453 57.748 58.000 0.333 0.000 1.139 10 F CB 1.764 40.840 39.000 0.127 0.000 1.120 10 F HN -0.465 8.132 8.300 0.495 0.000 0.493 11 F N 8.020 127.743 119.950 -0.378 0.000 2.552 11 F HA 0.221 4.726 4.527 -0.038 0.000 0.369 11 F C -0.572 174.882 175.800 -0.577 0.000 1.112 11 F CA -1.677 56.161 58.000 -0.269 0.000 1.129 11 F CB 1.299 40.246 39.000 -0.090 0.000 1.360 11 F HN 0.423 8.657 8.300 -0.111 0.000 0.473 12 G N 1.741 110.228 108.800 -0.522 0.000 2.192 12 G HA2 -0.284 3.072 3.960 -1.007 0.000 0.258 12 G HA3 -0.284 3.863 3.960 0.312 0.000 0.258 12 G C -0.891 173.965 174.900 -0.074 0.000 1.185 12 G CA 0.236 45.131 45.100 -0.341 0.000 0.976 12 G HN 0.220 8.434 8.290 -0.127 0.000 0.446 13 K N -1.017 119.318 120.400 -0.108 0.000 3.139 13 K HA -0.593 3.779 4.320 -0.046 -0.079 0.261 13 K C -1.084 175.521 176.600 0.009 0.000 0.895 13 K CA 0.546 56.816 56.287 -0.028 0.000 0.664 13 K CB -2.618 29.888 32.500 0.010 0.000 1.388 13 K HN -0.410 7.719 8.250 -0.214 -0.007 0.472 14 I N 1.770 122.353 120.570 0.023 0.000 2.668 14 I HA -0.135 4.079 4.170 0.073 0.000 0.285 14 I C -2.025 174.116 176.117 0.039 0.000 1.168 14 I CA -2.232 59.108 61.300 0.068 0.000 1.424 14 I CB 0.675 38.765 38.000 0.150 0.000 1.377 14 I HN -0.593 7.601 8.210 -0.003 0.014 0.560 15 P HA -0.011 4.417 4.420 0.014 0.000 0.258 15 P C 0.601 177.907 177.300 0.009 0.000 1.172 15 P CA 0.384 63.496 63.100 0.020 0.000 0.762 15 P CB 0.357 32.069 31.700 0.021 0.000 0.764 16 R N 7.009 127.508 120.500 -0.002 0.000 2.165 16 R HA -0.631 3.700 4.340 -0.015 0.000 0.254 16 R C 1.350 177.636 176.300 -0.023 0.000 1.153 16 R CA 4.225 60.315 56.100 -0.017 0.000 0.971 16 R CB -0.071 30.212 30.300 -0.028 0.000 0.878 16 R HN 0.528 8.798 8.270 -0.001 0.000 0.449 17 A N -1.685 121.127 122.820 -0.014 0.000 1.830 17 A HA -0.242 4.065 4.320 -0.023 0.000 0.214 17 A C 1.761 179.341 177.584 -0.006 0.000 1.218 17 A CA 2.653 54.682 52.037 -0.013 0.000 0.628 17 A CB -1.053 17.943 19.000 -0.006 0.000 0.860 17 A HN 0.167 8.307 8.150 -0.010 0.004 0.454 18 K N -0.243 120.162 120.400 0.009 0.000 2.148 18 K HA -0.369 3.964 4.320 0.021 0.000 0.213 18 K C 2.154 178.763 176.600 0.015 0.000 1.050 18 K CA 2.782 59.083 56.287 0.023 0.000 0.932 18 K CB -0.385 32.142 32.500 0.045 0.000 0.717 18 K HN -0.083 8.174 8.250 0.011 0.000 0.462 19 A N -1.623 121.198 122.820 0.002 0.000 1.834 19 A HA -0.418 3.871 4.320 -0.052 0.000 0.216 19 A C 1.713 179.271 177.584 -0.043 0.000 1.203 19 A CA 3.280 55.295 52.037 -0.036 0.000 0.621 19 A CB -0.519 18.455 19.000 -0.042 0.000 0.841 19 A HN 0.304 8.448 8.150 0.007 0.010 0.446 20 E N -1.827 118.351 120.200 -0.037 0.000 2.065 20 E HA -0.530 3.799 4.350 -0.035 0.000 0.201 20 E C 2.746 179.332 176.600 -0.024 0.000 1.016 20 E CA 3.076 59.455 56.400 -0.035 0.000 0.818 20 E CB -0.204 29.470 29.700 -0.043 0.000 0.749 20 E HN -0.108 8.230 8.360 -0.035 0.000 0.453 21 E N -1.780 118.410 120.200 -0.017 0.000 1.998 21 E HA -0.387 3.956 4.350 -0.011 0.000 0.221 21 E C 2.724 179.321 176.600 -0.006 0.000 1.018 21 E CA 2.585 58.980 56.400 -0.009 0.000 0.891 21 E CB -0.705 28.994 29.700 -0.001 0.000 0.807 21 E HN 0.155 8.388 8.360 -0.017 0.116 0.523 22 M N -1.171 118.429 119.600 0.001 0.000 2.073 22 M HA -0.349 4.137 4.480 0.010 0.000 0.258 22 M C 2.665 178.961 176.300 -0.007 0.000 1.070 22 M CA 3.101 58.405 55.300 0.006 0.000 1.103 22 M CB -0.308 32.308 32.600 0.026 0.000 1.321 22 M HN -0.551 7.743 8.290 0.007 0.000 0.405 23 L N -1.986 119.219 121.223 -0.031 0.000 2.270 23 L HA -0.260 4.051 4.340 -0.048 0.000 0.217 23 L C 1.287 178.153 176.870 -0.006 0.000 1.107 23 L CA 2.437 57.254 54.840 -0.039 0.000 0.772 23 L CB -0.664 41.355 42.059 -0.066 0.000 0.902 23 L HN 0.186 8.393 8.230 -0.039 0.000 0.439 24 S N -3.206 112.491 115.700 -0.005 0.000 2.406 24 S HA -0.181 4.294 4.470 0.009 0.000 0.224 24 S C 1.442 176.043 174.600 0.001 0.000 1.030 24 S CA 2.097 60.297 58.200 0.000 0.000 0.958 24 S CB -0.278 62.917 63.200 -0.008 0.000 0.811 24 S HN 0.100 8.176 8.310 -0.011 0.228 0.489 25 K N 0.388 120.788 120.400 -0.000 0.000 2.242 25 K HA -0.344 3.974 4.320 -0.004 0.000 0.206 25 K C -0.178 176.424 176.600 0.004 0.000 1.045 25 K CA 1.739 58.026 56.287 0.001 0.000 0.930 25 K CB -0.487 32.016 32.500 0.006 0.000 0.726 25 K HN -0.275 7.860 8.250 -0.001 0.115 0.462 26 Q N -0.544 119.264 119.800 0.014 0.000 2.333 26 Q HA -0.201 4.160 4.340 0.035 0.000 0.299 26 Q C 0.078 176.084 176.000 0.010 0.000 1.067 26 Q CA 1.065 56.886 55.803 0.030 0.000 0.943 26 Q CB 0.208 28.976 28.738 0.051 0.000 1.233 26 Q HN -0.605 7.498 8.270 0.013 0.175 0.401 27 R N 3.408 123.910 120.500 0.002 0.000 2.046 27 R HA -0.097 4.180 4.340 -0.104 0.000 0.223 27 R C 0.472 176.679 176.300 -0.156 0.000 1.179 27 R CA 1.199 57.231 56.100 -0.113 0.000 0.952 27 R CB 0.457 30.644 30.300 -0.188 0.000 0.843 27 R HN 0.251 8.549 8.270 0.046 0.000 0.439 28 H N -2.322 116.768 119.070 0.034 0.000 2.103 28 H HA 0.145 4.722 4.556 0.035 0.000 0.293 28 H C -0.856 174.512 175.328 0.067 0.000 1.724 28 H CA 0.072 56.146 56.048 0.042 0.000 1.448 28 H CB 0.735 30.519 29.762 0.036 0.000 1.742 28 H HN 0.021 8.388 8.280 0.145 0.000 0.661 29 D N -2.632 117.920 120.400 0.254 0.000 2.505 29 D HA -0.009 4.746 4.640 0.192 0.000 0.249 29 D C 0.185 176.619 176.300 0.223 0.000 1.082 29 D CA -0.891 53.234 54.000 0.210 0.000 0.839 29 D CB 1.284 42.205 40.800 0.201 0.000 1.317 29 D HN -0.126 8.425 8.370 0.302 0.000 0.497 30 G N 0.178 109.121 108.800 0.238 0.000 2.189 30 G HA2 -0.263 3.853 3.960 0.258 0.000 0.113 30 G HA3 -0.263 3.967 3.960 0.298 -0.092 0.113 30 G C -2.038 173.066 174.900 0.341 0.000 1.038 30 G CA 0.057 45.326 45.100 0.281 0.000 0.704 30 G HN 0.272 8.698 8.290 0.226 0.000 0.490 31 A N -0.233 122.746 122.820 0.265 0.000 2.290 31 A HA 0.899 5.534 4.320 0.225 -0.180 0.310 31 A C -1.790 175.937 177.584 0.240 0.000 1.202 31 A CA -1.800 50.362 52.037 0.207 0.000 0.837 31 A CB 2.261 21.319 19.000 0.097 0.000 1.139 31 A HN -0.351 7.934 8.150 0.224 0.000 0.509 32 F N -0.832 119.121 119.950 0.005 0.000 2.626 32 F HA 1.059 5.692 4.527 -0.046 -0.133 0.311 32 F C -2.889 172.843 175.800 -0.114 0.000 1.088 32 F CA -2.326 55.647 58.000 -0.045 0.000 0.949 32 F CB 3.862 42.833 39.000 -0.048 0.000 1.322 32 F HN -0.318 7.843 8.300 -0.233 0.000 0.461 33 L N -6.440 114.738 121.223 -0.075 0.000 2.465 33 L HA 0.482 4.719 4.340 -0.171 0.000 0.257 33 L C -2.211 174.702 176.870 0.072 0.000 0.988 33 L CA -0.662 54.040 54.840 -0.230 0.000 0.827 33 L CB 3.687 45.153 42.059 -0.990 0.000 1.397 33 L HN -0.065 8.228 8.230 0.104 0.000 0.410 34 I N 1.199 121.906 120.570 0.229 0.000 2.354 34 I HA 0.558 5.062 4.170 0.196 -0.216 0.286 34 I C -0.987 175.246 176.117 0.193 0.000 1.007 34 I CA -1.171 60.281 61.300 0.255 0.000 1.167 34 I CB 1.379 39.583 38.000 0.341 0.000 1.320 34 I HN 0.661 9.085 8.210 0.358 0.000 0.458 35 R N 6.883 127.449 120.500 0.110 0.000 2.265 35 R HA 0.577 5.077 4.340 -0.099 -0.220 0.319 35 R C -1.080 175.194 176.300 -0.043 0.000 1.006 35 R CA -2.441 53.653 56.100 -0.010 0.000 0.880 35 R CB 1.270 31.574 30.300 0.006 0.000 1.077 35 R HN -0.218 8.125 8.270 0.121 0.000 0.454 36 E N 6.475 126.543 120.200 -0.220 0.000 2.290 36 E HA 0.085 4.307 4.350 -0.214 0.000 0.277 36 E C -0.362 176.152 176.600 -0.143 0.000 1.035 36 E CA -0.682 55.620 56.400 -0.164 0.000 0.873 36 E CB 1.053 30.748 29.700 -0.009 0.000 1.029 36 E HN -0.312 7.793 8.360 -0.481 -0.034 0.419 37 S N 7.867 123.434 115.700 -0.221 0.000 2.552 37 S HA -0.258 4.157 4.470 -0.092 0.000 0.289 37 S C -0.048 174.507 174.600 -0.075 0.000 1.304 37 S CA 1.042 59.160 58.200 -0.138 0.000 1.063 37 S CB 0.746 63.842 63.200 -0.173 0.000 0.848 37 S HN -0.112 7.955 8.310 -0.404 0.000 0.499 38 E N 3.984 124.162 120.200 -0.037 0.000 1.986 38 E HA -0.309 4.047 4.350 0.010 0.000 0.229 38 E C 0.362 176.960 176.600 -0.004 0.000 0.997 38 E CA 2.385 58.780 56.400 -0.007 0.000 0.894 38 E CB 0.054 29.751 29.700 -0.004 0.000 0.813 38 E HN 0.391 8.728 8.360 -0.037 0.000 0.549 39 S N -1.432 114.262 115.700 -0.011 0.000 2.421 39 S HA -0.067 4.407 4.470 0.007 0.000 0.224 39 S C -0.827 173.761 174.600 -0.019 0.000 1.035 39 S CA 0.179 58.376 58.200 -0.005 0.000 0.953 39 S CB 0.297 63.496 63.200 -0.002 0.000 0.810 39 S HN -0.221 8.080 8.310 -0.014 0.000 0.497 40 A N 2.920 125.716 122.820 -0.039 0.000 2.615 40 A HA -0.063 4.236 4.320 -0.036 0.000 0.230 40 A C -0.587 176.956 177.584 -0.068 0.000 1.062 40 A CA -0.480 51.524 52.037 -0.055 0.000 0.758 40 A CB -0.950 18.002 19.000 -0.079 0.000 0.995 40 A HN -0.274 7.853 8.150 -0.038 0.000 0.511 41 P HA -0.039 4.392 4.420 0.018 0.000 0.251 41 P C 0.622 177.897 177.300 -0.042 0.000 1.289 41 P CA 0.245 63.341 63.100 -0.006 0.000 0.676 41 P CB 0.530 32.244 31.700 0.024 0.000 1.294 42 G N -1.349 107.500 108.800 0.080 0.000 3.401 42 G HA2 -0.102 4.095 3.960 0.395 0.000 0.251 42 G HA3 -0.102 4.181 3.960 0.538 0.000 0.251 42 G C -1.787 173.172 174.900 0.099 0.000 0.960 42 G CA -0.576 44.712 45.100 0.314 0.000 1.900 42 G HN 0.091 8.430 8.290 0.081 0.000 0.645 43 D N 2.342 122.503 120.400 -0.398 0.000 2.329 43 D HA 0.256 4.870 4.640 -0.043 0.000 0.232 43 D C -1.887 174.030 176.300 -0.639 0.000 1.088 43 D CA -0.475 53.343 54.000 -0.304 0.000 0.835 43 D CB 0.889 41.567 40.800 -0.204 0.000 1.078 43 D HN -0.146 7.826 8.370 -0.501 0.097 0.495 44 F N 3.285 123.317 119.950 0.137 0.000 2.547 44 F HA 0.435 5.016 4.527 0.090 0.000 0.316 44 F C -1.373 174.469 175.800 0.071 0.000 1.121 44 F CA -1.371 56.694 58.000 0.109 0.000 0.911 44 F CB 3.881 42.958 39.000 0.128 0.000 1.179 44 F HN -0.487 7.982 8.300 0.281 0.000 0.443 45 S N 1.907 117.736 115.700 0.215 0.000 2.478 45 S HA 0.707 5.494 4.470 0.148 -0.228 0.312 45 S C -0.925 173.776 174.600 0.168 0.000 1.094 45 S CA -1.583 56.709 58.200 0.154 0.000 1.081 45 S CB 2.397 65.662 63.200 0.107 0.000 1.007 45 S HN 0.250 8.679 8.310 0.198 0.000 0.475 46 L N 7.220 128.547 121.223 0.175 0.000 2.260 46 L HA 0.463 5.041 4.340 0.152 -0.147 0.289 46 L C -0.847 176.182 176.870 0.265 0.000 1.057 46 L CA -1.287 53.654 54.840 0.168 0.000 0.811 46 L CB 1.896 43.964 42.059 0.015 0.000 1.184 46 L HN 0.952 9.190 8.230 0.191 0.107 0.429 47 S N 7.099 122.919 115.700 0.199 0.000 2.554 47 S HA 0.931 5.706 4.470 0.176 -0.200 0.278 47 S C -0.934 173.801 174.600 0.225 0.000 1.242 47 S CA -1.234 57.070 58.200 0.173 0.000 1.051 47 S CB 1.613 64.857 63.200 0.073 0.000 0.986 47 S HN 0.878 9.289 8.310 0.169 0.000 0.502 48 V N 0.002 120.046 119.914 0.217 0.000 2.851 48 V HA 0.475 5.024 4.120 0.248 -0.279 0.307 48 V C -1.290 174.933 176.094 0.214 0.000 1.129 48 V CA -1.790 60.656 62.300 0.244 0.000 0.932 48 V CB 4.655 36.651 31.823 0.287 0.000 1.024 48 V HN 1.098 9.271 8.190 0.166 0.116 0.426 49 K N 6.808 127.325 120.400 0.195 0.000 2.166 49 K HA 0.003 4.527 4.320 0.144 -0.117 0.273 49 K C -0.752 176.011 176.600 0.272 0.000 1.095 49 K CA 0.091 56.484 56.287 0.176 0.000 0.985 49 K CB -0.435 32.140 32.500 0.125 0.000 1.172 49 K HN -0.010 8.356 8.250 0.195 0.000 0.401 50 F N 8.443 128.433 119.950 0.066 0.000 2.949 50 F HA 0.089 4.670 4.527 0.091 0.000 0.291 50 F C -0.686 175.141 175.800 0.045 0.000 1.214 50 F CA -2.306 55.737 58.000 0.071 0.000 1.381 50 F CB -0.849 38.194 39.000 0.072 0.000 1.066 50 F HN -0.292 8.192 8.300 0.317 0.006 0.520 51 G N 2.338 111.159 108.800 0.036 0.000 2.999 51 G HA2 -0.464 3.475 3.960 -0.035 0.000 0.686 51 G HA3 -0.464 3.400 3.960 -0.161 0.000 0.686 51 G C -0.116 174.679 174.900 -0.175 0.000 1.551 51 G CA -0.362 44.677 45.100 -0.102 0.000 1.126 51 G HN -0.877 7.378 8.290 0.134 0.115 0.603 52 N N 0.867 119.498 118.700 -0.115 0.000 2.631 52 N HA -0.423 4.268 4.740 -0.082 0.000 0.218 52 N C -1.336 174.131 175.510 -0.071 0.000 0.972 52 N CA 2.085 55.072 53.050 -0.105 0.000 1.918 52 N CB 0.129 38.525 38.487 -0.152 0.000 0.895 52 N HN 0.548 8.878 8.380 -0.083 0.000 0.540 53 D N -6.789 113.576 120.400 -0.057 0.000 3.213 53 D HA 0.069 4.695 4.640 -0.024 0.000 0.357 53 D C -2.274 174.037 176.300 0.017 0.000 1.446 53 D CA -0.766 53.218 54.000 -0.025 0.000 0.893 53 D CB 1.570 42.347 40.800 -0.037 0.000 1.466 53 D HN -0.103 8.061 8.370 -0.073 0.163 0.541 54 V N -1.034 118.883 119.914 0.006 0.000 2.370 54 V HA 0.150 4.440 4.120 0.075 -0.125 0.283 54 V C -0.916 175.183 176.094 0.009 0.000 1.023 54 V CA -1.215 61.101 62.300 0.026 0.000 0.857 54 V CB 0.279 32.097 31.823 -0.007 0.000 0.985 54 V HN 0.180 8.356 8.190 -0.022 0.000 0.443 55 Q N 6.625 126.464 119.800 0.066 0.000 2.215 55 Q HA 0.242 4.574 4.340 -0.014 0.000 0.256 55 Q C -1.603 174.363 176.000 -0.057 0.000 0.972 55 Q CA -2.133 53.662 55.803 -0.014 0.000 0.889 55 Q CB 3.715 32.435 28.738 -0.031 0.000 1.281 55 Q HN 0.908 9.156 8.270 0.133 0.102 0.456 56 H N -1.148 117.678 119.070 -0.406 0.000 2.759 56 H HA 0.533 5.166 4.556 -0.165 -0.176 0.354 56 H C -1.312 173.731 175.328 -0.476 0.000 1.074 56 H CA -3.159 52.710 56.048 -0.299 0.000 1.226 56 H CB 2.796 32.487 29.762 -0.118 0.000 1.648 56 H HN 0.036 8.428 8.280 0.186 0.000 0.529 57 F N 2.785 122.712 119.950 -0.039 0.000 2.375 57 F HA 0.188 4.677 4.527 -0.062 0.000 0.361 57 F C -0.419 175.335 175.800 -0.077 0.000 1.117 57 F CA -1.403 56.554 58.000 -0.071 0.000 1.037 57 F CB 1.511 40.460 39.000 -0.085 0.000 1.192 57 F HN 0.898 9.174 8.300 0.185 0.135 0.452 58 K N 6.059 126.455 120.400 -0.007 0.000 2.294 58 K HA -0.016 4.309 4.320 0.009 0.000 0.288 58 K C -0.617 176.011 176.600 0.046 0.000 1.072 58 K CA -0.680 55.596 56.287 -0.019 0.000 0.960 58 K CB -1.215 31.210 32.500 -0.125 0.000 1.043 58 K HN 0.645 8.825 8.250 -0.117 0.000 0.455 59 V N 7.175 127.166 119.914 0.129 0.000 2.324 59 V HA -0.187 4.039 4.120 0.177 0.000 0.244 59 V C -0.837 175.328 176.094 0.119 0.000 1.144 59 V CA 0.105 62.517 62.300 0.186 0.000 1.158 59 V CB -2.135 29.845 31.823 0.261 0.000 1.254 59 V HN 0.805 8.994 8.190 0.155 0.093 0.492 60 L N 6.583 127.676 121.223 -0.217 0.000 2.472 60 L HA -0.038 4.186 4.340 -0.194 0.000 0.260 60 L C -0.101 176.513 176.870 -0.428 0.000 1.209 60 L CA 0.343 54.940 54.840 -0.405 0.000 0.817 60 L CB 0.563 42.178 42.059 -0.739 0.000 1.106 60 L HN -0.186 7.845 8.230 -0.316 0.009 0.479 61 R N -0.768 119.553 120.500 -0.298 0.000 2.606 61 R HA -0.034 4.141 4.340 -0.437 -0.098 0.249 61 R C -0.354 175.973 176.300 0.045 0.000 1.127 61 R CA -0.537 55.395 56.100 -0.278 0.000 1.133 61 R CB 1.010 31.131 30.300 -0.298 0.000 1.243 61 R HN 0.099 8.235 8.270 -0.225 0.000 0.558 62 D N -2.586 117.850 120.400 0.060 0.000 4.084 62 D HA -0.289 4.381 4.640 0.050 0.000 0.147 62 D C 0.676 177.138 176.300 0.269 0.000 0.905 62 D CA 1.433 55.522 54.000 0.148 0.000 1.071 62 D CB -0.571 40.302 40.800 0.122 0.000 0.563 62 D HN 0.034 8.341 8.370 -0.105 0.000 0.588 63 G N 1.499 110.391 108.800 0.154 0.000 5.266 63 G HA2 -0.396 3.279 3.960 -0.475 0.000 0.262 63 G HA3 -0.396 2.895 3.960 -1.116 0.000 0.262 63 G C -1.169 173.564 174.900 -0.279 0.000 1.359 63 G CA 1.006 45.849 45.100 -0.429 0.000 0.955 63 G HN 0.278 8.674 8.290 0.177 0.000 0.754 64 A N 2.228 124.938 122.820 -0.185 0.000 2.676 64 A HA 0.199 4.457 4.320 -0.103 0.000 0.258 64 A C -0.946 176.614 177.584 -0.040 0.000 0.898 64 A CA -0.738 51.230 52.037 -0.114 0.000 1.087 64 A CB 1.032 19.945 19.000 -0.144 0.000 1.214 64 A HN 0.212 8.237 8.150 -0.127 0.048 0.474 65 G N -1.218 107.577 108.800 -0.007 0.000 2.141 65 G HA2 -0.373 3.592 3.960 0.008 0.000 0.242 65 G HA3 -0.373 3.596 3.960 0.015 0.000 0.242 65 G C -0.859 174.067 174.900 0.043 0.000 0.982 65 G CA 0.488 45.597 45.100 0.015 0.000 0.662 65 G HN -0.186 7.987 8.290 -0.003 0.115 0.527 66 K N -0.882 119.563 120.400 0.074 0.000 2.399 66 K HA 0.409 4.839 4.320 0.182 0.000 0.260 66 K C -0.974 175.756 176.600 0.216 0.000 1.049 66 K CA -2.038 54.351 56.287 0.170 0.000 0.890 66 K CB 3.144 35.756 32.500 0.186 0.000 1.430 66 K HN -0.365 7.888 8.250 0.073 0.041 0.459 67 Y N -1.284 119.216 120.300 0.334 0.000 2.299 67 Y HA 0.396 5.358 4.550 0.297 -0.233 0.326 67 Y C -0.554 175.553 175.900 0.345 0.000 1.164 67 Y CA -0.224 58.130 58.100 0.423 0.000 1.234 67 Y CB 1.258 40.036 38.460 0.529 0.000 1.219 67 Y HN -0.355 8.453 8.280 0.880 0.000 0.497 68 F N -4.091 116.014 119.950 0.257 0.000 2.670 68 F HA 0.506 4.518 4.527 -0.858 0.000 0.332 68 F C -1.620 174.309 175.800 0.214 0.000 1.179 68 F CA -1.124 56.795 58.000 -0.134 0.000 1.076 68 F CB 1.439 40.280 39.000 -0.265 0.000 1.322 68 F HN 0.545 8.708 8.300 -0.054 0.104 0.515 69 L N 2.964 124.444 121.223 0.429 0.000 1.913 69 L HA -0.168 4.487 4.340 0.265 -0.156 0.217 69 L C 1.241 178.410 176.870 0.498 0.000 1.086 69 L CA 3.468 58.561 54.840 0.422 0.000 0.772 69 L CB 0.094 42.422 42.059 0.447 0.000 0.887 69 L HN 0.568 9.199 8.230 0.668 0.000 0.432 70 W N -5.246 116.165 121.300 0.185 0.000 2.952 70 W HA 0.062 4.847 4.660 0.208 0.000 0.251 70 W C 0.557 177.199 176.519 0.205 0.000 1.144 70 W CA 1.323 58.784 57.345 0.194 0.000 1.551 70 W CB 0.176 29.715 29.460 0.133 0.000 0.978 70 W HN -0.168 8.388 8.180 0.626 0.000 0.648 71 V N -1.884 118.245 119.914 0.358 0.000 4.771 71 V HA 0.131 4.300 4.120 0.081 0.000 0.148 71 V C -0.615 175.432 176.094 -0.078 0.000 1.138 71 V CA 0.471 62.841 62.300 0.117 0.000 1.282 71 V CB 0.107 31.991 31.823 0.102 0.000 1.742 71 V HN -0.796 7.609 8.190 0.358 0.000 0.563 72 V N 0.028 119.844 119.914 -0.163 0.000 2.681 72 V HA -0.156 3.777 4.120 -0.312 0.000 0.306 72 V C -0.850 174.848 176.094 -0.661 0.000 1.077 72 V CA 1.344 63.403 62.300 -0.401 0.000 1.224 72 V CB -0.213 31.198 31.823 -0.687 0.000 0.879 72 V HN -0.226 7.922 8.190 -0.069 0.000 0.494 73 K N 5.498 125.552 120.400 -0.576 0.000 2.109 73 K HA 0.417 4.258 4.320 -0.992 -0.116 0.243 73 K C -0.323 175.905 176.600 -0.620 0.000 1.006 73 K CA -0.334 55.540 56.287 -0.689 0.000 0.917 73 K CB 1.715 34.021 32.500 -0.323 0.000 1.081 73 K HN -0.205 7.807 8.250 -0.397 0.000 0.468 74 F N -3.577 116.409 119.950 0.060 0.000 2.704 74 F HA 0.223 4.759 4.527 0.015 0.000 0.312 74 F C -2.422 173.449 175.800 0.118 0.000 1.108 74 F CA -1.572 56.454 58.000 0.044 0.000 1.005 74 F CB 0.660 39.657 39.000 -0.006 0.000 1.277 74 F HN -0.165 7.904 8.300 -0.387 0.000 0.445 75 N N 0.875 119.771 118.700 0.326 0.000 2.373 75 N HA -0.039 4.911 4.740 0.350 0.000 0.181 75 N C -0.611 174.977 175.510 0.129 0.000 1.082 75 N CA 0.629 53.831 53.050 0.254 0.000 0.885 75 N CB 0.497 39.082 38.487 0.163 0.000 0.977 75 N HN 0.155 8.690 8.380 0.259 0.000 0.462 76 S N -2.460 113.287 115.700 0.078 0.000 2.619 76 S HA 0.100 4.486 4.470 -0.141 0.000 0.280 76 S C -0.092 174.402 174.600 -0.177 0.000 1.150 76 S CA -1.794 56.371 58.200 -0.059 0.000 0.978 76 S CB 1.364 64.571 63.200 0.011 0.000 1.041 76 S HN -0.783 7.589 8.310 0.169 0.040 0.485 77 L N 6.760 127.808 121.223 -0.291 0.000 2.089 77 L HA -0.504 3.430 4.340 -0.677 0.000 0.213 77 L C 1.319 178.022 176.870 -0.278 0.000 1.079 77 L CA 2.987 57.583 54.840 -0.407 0.000 0.758 77 L CB -0.137 41.764 42.059 -0.263 0.000 0.891 77 L HN 0.771 8.812 8.230 -0.315 0.000 0.433 78 N N -1.573 117.217 118.700 0.150 0.000 2.061 78 N HA -0.450 4.572 4.740 0.471 0.000 0.193 78 N C 2.186 177.704 175.510 0.014 0.000 1.030 78 N CA 3.548 56.758 53.050 0.267 0.000 0.856 78 N CB -0.752 37.901 38.487 0.278 0.000 1.023 78 N HN -0.358 8.138 8.380 0.200 0.004 0.424 79 E N -0.080 120.111 120.200 -0.015 0.000 2.160 79 E HA -0.286 4.097 4.350 0.054 0.000 0.195 79 E C 2.154 178.720 176.600 -0.055 0.000 0.991 79 E CA 2.594 59.003 56.400 0.015 0.000 0.810 79 E CB -0.436 29.323 29.700 0.098 0.000 0.742 79 E HN -0.115 8.145 8.360 -0.004 0.097 0.466 80 L N -0.381 120.617 121.223 -0.375 0.000 1.971 80 L HA -0.288 3.878 4.340 -0.291 0.000 0.208 80 L C 1.703 178.398 176.870 -0.291 0.000 1.083 80 L CA 3.175 57.692 54.840 -0.538 0.000 0.753 80 L CB 0.018 41.354 42.059 -1.205 0.000 0.893 80 L HN -0.686 7.120 8.230 -0.442 0.159 0.436 81 V N -2.529 117.054 119.914 -0.551 0.000 2.357 81 V HA -0.495 3.164 4.120 -0.768 0.000 0.257 81 V C 1.498 177.370 176.094 -0.370 0.000 1.082 81 V CA 3.767 65.685 62.300 -0.637 0.000 1.078 81 V CB -0.993 30.287 31.823 -0.905 0.000 0.663 81 V HN 0.465 8.145 8.190 -0.698 0.091 0.455 82 D N -2.965 117.319 120.400 -0.193 0.000 2.162 82 D HA -0.187 4.359 4.640 -0.155 0.000 0.205 82 D C 2.006 178.209 176.300 -0.162 0.000 0.964 82 D CA 2.298 56.222 54.000 -0.126 0.000 0.847 82 D CB 0.722 41.509 40.800 -0.021 0.000 0.988 82 D HN -0.014 8.036 8.370 -0.173 0.216 0.480 83 Y N 0.988 121.151 120.300 -0.228 0.000 2.165 83 Y HA -0.467 3.945 4.550 -0.230 0.000 0.286 83 Y C 1.149 176.757 175.900 -0.487 0.000 1.155 83 Y CA 3.628 61.547 58.100 -0.301 0.000 1.164 83 Y CB 0.556 38.863 38.460 -0.255 0.000 0.978 83 Y HN -0.050 8.036 8.280 0.042 0.218 0.513 84 H N -3.182 115.764 119.070 -0.208 0.000 2.770 84 H HA 0.276 4.717 4.556 -0.378 -0.111 0.315 84 H C 0.269 175.241 175.328 -0.594 0.000 1.127 84 H CA 1.031 56.845 56.048 -0.390 0.000 1.155 84 H CB -1.349 28.158 29.762 -0.425 0.000 1.397 84 H HN 0.278 8.436 8.280 -0.025 0.108 0.538 85 R N -0.287 119.879 120.500 -0.557 0.000 2.164 85 R HA -0.001 3.594 4.340 -1.243 0.000 0.198 85 R C 0.257 176.107 176.300 -0.750 0.000 1.028 85 R CA 1.772 57.358 56.100 -0.856 0.000 1.083 85 R CB 1.101 31.053 30.300 -0.579 0.000 1.026 85 R HN -0.407 7.385 8.270 -0.494 0.182 0.514 86 S N -1.590 113.843 115.700 -0.444 0.000 2.404 86 S HA 0.052 4.440 4.470 -0.136 0.000 0.223 86 S C 0.696 175.144 174.600 -0.254 0.000 1.040 86 S CA 2.041 60.084 58.200 -0.262 0.000 0.957 86 S CB 0.976 64.040 63.200 -0.226 0.000 0.826 86 S HN -0.365 7.666 8.310 -0.465 0.000 0.491 87 T N 2.526 116.854 114.554 -0.378 0.000 3.268 87 T HA 0.154 4.379 4.350 -0.208 0.000 0.258 87 T C -1.357 173.177 174.700 -0.277 0.000 0.966 87 T CA -0.265 61.649 62.100 -0.310 0.000 0.952 87 T CB 0.041 68.683 68.868 -0.376 0.000 1.132 87 T HN -0.581 7.353 8.240 -0.511 0.000 0.536 88 S N -0.541 114.995 115.700 -0.273 0.000 2.865 88 S HA -0.408 4.029 4.470 -0.282 -0.136 0.630 88 S C -0.842 173.648 174.600 -0.183 0.000 3.160 88 S CA 1.605 59.669 58.200 -0.228 0.000 3.629 88 S CB 0.249 63.365 63.200 -0.140 0.000 0.312 88 S HN -0.105 7.937 8.310 -0.305 0.085 1.632 89 V N 1.305 121.073 119.914 -0.244 0.000 3.342 89 V HA 0.114 4.188 4.120 -0.078 0.000 0.494 89 V C -1.857 173.989 176.094 -0.414 0.000 1.598 89 V CA 0.060 62.160 62.300 -0.334 0.000 1.948 89 V CB -0.273 31.072 31.823 -0.797 0.000 1.274 89 V HN 0.101 8.138 8.190 -0.255 0.000 0.650 90 S N 0.387 115.916 115.700 -0.284 0.000 2.605 90 S HA 0.098 4.397 4.470 -0.285 0.000 0.324 90 S C -0.498 174.018 174.600 -0.140 0.000 0.978 90 S CA -0.141 57.896 58.200 -0.272 0.000 0.864 90 S CB 1.019 63.943 63.200 -0.460 0.000 1.095 90 S HN -0.458 7.725 8.310 -0.212 0.000 0.460 91 R N 4.789 125.231 120.500 -0.098 0.000 2.115 91 R HA -0.325 3.990 4.340 -0.040 0.000 0.230 91 R C 1.552 177.866 176.300 0.023 0.000 1.111 91 R CA 2.255 58.335 56.100 -0.034 0.000 0.976 91 R CB 0.045 30.332 30.300 -0.023 0.000 0.870 91 R HN 0.588 8.781 8.270 -0.129 0.000 0.445 92 N N -1.362 117.377 118.700 0.065 0.000 2.133 92 N HA -0.295 4.513 4.740 0.115 0.000 0.193 92 N C 0.213 175.812 175.510 0.148 0.000 1.012 92 N CA 2.277 55.418 53.050 0.151 0.000 0.871 92 N CB 0.272 38.956 38.487 0.327 0.000 1.011 92 N HN -0.093 8.292 8.380 0.035 0.015 0.435 93 Q N -4.887 114.998 119.800 0.143 0.000 2.573 93 Q HA 0.119 4.514 4.340 0.092 0.000 0.388 93 Q C -2.488 173.558 176.000 0.077 0.000 0.613 93 Q CA -0.555 55.326 55.803 0.129 0.000 0.962 93 Q CB 1.256 30.117 28.738 0.205 0.000 1.032 93 Q HN -0.869 7.454 8.270 0.103 0.008 0.466 94 Q N -0.339 119.519 119.800 0.096 0.000 2.333 94 Q HA 0.202 4.556 4.340 0.022 0.000 0.268 94 Q C -2.100 173.956 176.000 0.094 0.000 1.007 94 Q CA -1.150 54.693 55.803 0.066 0.000 0.810 94 Q CB 1.471 30.250 28.738 0.069 0.000 1.264 94 Q HN -0.052 8.294 8.270 0.127 0.000 0.452 95 I N 1.897 122.485 120.570 0.030 0.000 2.693 95 I HA 0.140 4.388 4.170 0.130 0.000 0.303 95 I C -1.819 174.340 176.117 0.069 0.000 1.025 95 I CA -1.241 60.084 61.300 0.043 0.000 1.086 95 I CB 3.420 41.359 38.000 -0.101 0.000 1.268 95 I HN 0.198 8.391 8.210 -0.029 0.000 0.440 96 F N 3.632 123.559 119.950 -0.038 0.000 2.581 96 F HA 0.234 4.699 4.527 -0.103 0.000 0.311 96 F C -2.567 173.205 175.800 -0.046 0.000 1.113 96 F CA -1.299 56.667 58.000 -0.056 0.000 0.935 96 F CB 3.888 42.877 39.000 -0.019 0.000 1.232 96 F HN 0.035 8.470 8.300 0.225 0.000 0.445 97 L N 5.234 126.359 121.223 -0.165 0.000 2.278 97 L HA 0.076 4.419 4.340 0.004 0.000 0.287 97 L C -1.538 175.655 176.870 0.539 0.000 1.072 97 L CA -0.095 54.655 54.840 -0.151 0.000 0.819 97 L CB 0.019 41.459 42.059 -1.032 0.000 1.176 97 L HN 0.455 8.141 8.230 -0.905 0.000 0.435 98 R N 1.041 122.027 120.500 0.810 0.000 2.750 98 R HA 0.325 5.061 4.340 0.659 0.000 0.281 98 R C -1.543 175.018 176.300 0.435 0.000 0.972 98 R CA -3.214 53.271 56.100 0.640 0.000 0.912 98 R CB 3.261 33.765 30.300 0.341 0.000 1.187 98 R HN 0.738 9.403 8.270 0.825 0.100 0.464 99 D N 1.611 122.160 120.400 0.248 0.000 2.520 99 D HA -0.102 4.391 4.640 -0.244 0.000 0.243 99 D C 1.118 177.380 176.300 -0.062 0.000 1.160 99 D CA 2.016 56.011 54.000 -0.008 0.000 0.877 99 D CB 0.053 40.904 40.800 0.084 0.000 1.150 99 D HN 0.305 8.861 8.370 0.311 0.000 0.494 100 I N 4.879 125.316 120.570 -0.221 0.000 3.518 100 I HA -0.196 3.935 4.170 -0.066 0.000 0.305 100 I C -1.802 174.318 176.117 0.004 0.000 1.204 100 I CA 0.395 61.623 61.300 -0.121 0.000 1.211 100 I CB -0.697 37.144 38.000 -0.265 0.000 1.018 100 I HN 0.459 8.406 8.210 -0.437 0.000 0.500 101 E N -0.010 120.206 120.200 0.027 0.000 2.313 101 E HA 0.172 4.557 4.350 0.057 0.000 0.280 101 E C -1.457 175.166 176.600 0.037 0.000 0.898 101 E CA -1.112 55.318 56.400 0.050 0.000 0.803 101 E CB 1.387 31.126 29.700 0.065 0.000 1.286 101 E HN -0.375 7.829 8.360 0.015 0.164 0.401 102 Q N 5.193 125.015 119.800 0.037 0.000 2.313 102 Q HA -0.014 4.346 4.340 0.032 0.000 0.266 102 Q C 0.234 176.246 176.000 0.019 0.000 0.989 102 Q CA -0.200 55.621 55.803 0.031 0.000 0.890 102 Q CB 0.616 29.374 28.738 0.034 0.000 1.200 102 Q HN 0.158 8.452 8.270 0.040 0.000 0.396 103 V N 6.859 126.783 119.914 0.015 0.000 3.005 103 V HA -0.205 3.918 4.120 0.005 0.000 0.287 103 V C -0.535 175.561 176.094 0.003 0.000 1.344 103 V CA 0.877 63.182 62.300 0.008 0.000 1.410 103 V CB 0.208 32.035 31.823 0.006 0.000 0.913 103 V HN 0.329 8.529 8.190 0.018 0.000 0.525 104 P HA -0.105 4.311 4.420 -0.008 0.000 0.231 104 P C -0.634 176.664 177.300 -0.003 0.000 1.158 104 P CA 0.646 63.742 63.100 -0.007 0.000 0.763 104 P CB 0.530 32.222 31.700 -0.013 0.000 0.805 105 Q N -3.822 115.978 119.800 0.000 0.000 1.160 105 Q HA -0.416 3.927 4.340 0.005 0.000 0.426 105 Q C -1.006 174.997 176.000 0.004 0.000 1.014 105 Q CA 1.704 57.509 55.803 0.003 0.000 0.499 105 Q CB -0.897 27.842 28.738 0.003 0.000 5.099 105 Q HN -0.195 7.993 8.270 0.001 0.083 0.531 106 Q N 0.260 120.064 119.800 0.007 0.000 2.571 106 Q HA 0.319 4.668 4.340 0.014 0.000 0.243 106 Q C -2.349 173.654 176.000 0.004 0.000 1.055 106 Q CA -2.166 53.645 55.803 0.015 0.000 0.815 106 Q CB 0.070 28.826 28.738 0.029 0.000 1.151 106 Q HN 0.216 8.490 8.270 0.007 0.000 0.519 107 P HA -0.119 4.272 4.420 -0.048 0.000 0.258 107 P C -1.137 176.108 177.300 -0.091 0.000 1.187 107 P CA 0.416 63.489 63.100 -0.045 0.000 0.767 107 P CB 0.182 31.858 31.700 -0.042 0.000 0.770 108 T N 3.803 118.270 114.554 -0.144 0.000 0.541 108 T HA -0.360 3.825 4.350 -0.275 0.000 0.774 108 T C -1.719 172.862 174.700 -0.199 0.000 0.992 108 T CA 0.812 62.717 62.100 -0.325 0.000 4.077 108 T CB 0.074 68.595 68.868 -0.579 0.000 2.303 108 T HN -0.039 8.138 8.240 -0.105 0.000 0.398 109 Y N -2.786 117.514 120.300 0.001 0.000 2.585 109 Y HA -0.282 4.268 4.550 0.001 0.000 0.029 109 Y C -1.150 174.751 175.900 0.000 0.000 1.781 109 Y CA 0.039 58.140 58.100 0.000 0.000 1.362 109 Y CB -0.978 37.482 38.460 -0.000 0.000 2.012 109 Y HN 0.077 8.206 8.280 -0.252 0.000 0.266 110 V N 5.176 125.197 119.914 0.179 0.000 2.384 110 V HA 0.077 4.248 4.120 0.085 0.000 0.287 110 V C -0.491 175.645 176.094 0.071 0.000 1.020 110 V CA -0.329 62.028 62.300 0.095 0.000 0.850 110 V CB 0.703 32.564 31.823 0.064 0.000 0.987 110 V HN 0.000 8.310 8.190 0.200 0.000 0.436 111 Q N 7.539 127.372 119.800 0.054 0.000 2.951 111 Q HA -0.349 4.008 4.340 0.028 0.000 0.101 111 Q C -1.052 174.961 176.000 0.022 0.000 1.562 111 Q CA 0.069 55.891 55.803 0.032 0.000 0.418 111 Q CB 0.097 28.849 28.738 0.022 0.000 0.625 111 Q HN 0.506 8.809 8.270 0.056 0.000 0.320 112 A N 0.000 122.827 122.820 0.012 0.000 2.254 112 A HA 0.000 4.312 4.320 -0.013 0.000 0.244 112 A CA 0.000 52.028 52.037 -0.015 0.000 0.836 112 A CB 0.000 18.985 19.000 -0.025 0.000 0.831 112 A HN 0.000 8.160 8.150 0.016 0.000 0.486