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 1yx6_9_A DATA FIRST_RESID 1 DATA SEQUENCE HMLGLGASDF EFGVDPSADP ELALALRVSM EEQRQRQEEE ARRAAAASAA DATA SEQUENCE EAGIATTGTE DSDDALLKMT ISQQEFGRTG LPDLSSMTEE EQIAYAMQMS DATA SEQUENCE LQGAEFGQAE SA 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 H HA 0.000 4.556 4.556 -0.000 0.000 0.296 1 H C 0.000 175.328 175.328 0.000 0.000 0.993 1 H CA 0.000 56.048 56.048 0.000 0.000 1.023 1 H CB 0.000 29.762 29.762 0.000 0.000 1.292 2 M N -2.046 117.678 119.600 0.208 0.000 7.319 2 M HA -0.320 4.209 4.480 0.082 0.000 0.273 2 M C -0.739 175.651 176.300 0.151 0.000 0.480 2 M CA 1.071 56.443 55.300 0.119 0.000 1.311 2 M CB 0.335 32.975 32.600 0.067 0.000 0.421 2 M HN -0.295 8.110 8.290 0.193 0.000 0.240 3 L N -0.655 120.620 121.223 0.087 0.000 3.017 3 L HA 0.243 4.651 4.340 0.113 0.000 0.255 3 L C -0.054 176.851 176.870 0.058 0.000 1.247 3 L CA -0.339 54.549 54.840 0.080 0.000 1.038 3 L CB -0.101 41.987 42.059 0.048 0.000 1.380 3 L HN 0.153 8.420 8.230 0.060 0.000 0.548 4 G N -0.779 108.049 108.800 0.048 0.000 2.426 4 G HA2 -0.076 3.897 3.960 0.021 0.000 0.214 4 G HA3 -0.076 3.892 3.960 0.013 0.000 0.214 4 G C 0.056 174.967 174.900 0.017 0.000 1.156 4 G CA 0.583 45.697 45.100 0.023 0.000 0.802 4 G HN -0.267 7.981 8.290 0.057 0.076 0.534 5 L N 1.492 122.724 121.223 0.016 0.000 2.400 5 L HA -0.108 4.224 4.340 -0.013 0.000 0.262 5 L C 0.027 176.913 176.870 0.027 0.000 1.309 5 L CA 0.357 55.197 54.840 -0.000 0.000 1.186 5 L CB -1.054 40.980 42.059 -0.043 0.000 1.375 5 L HN -0.115 8.130 8.230 0.025 0.000 0.433 6 G N 1.489 110.305 108.800 0.027 0.000 4.547 6 G HA2 0.257 4.245 3.960 0.047 0.000 0.301 6 G HA3 0.257 4.252 3.960 0.059 0.000 0.301 6 G C -1.037 173.889 174.900 0.043 0.000 1.240 6 G CA -0.163 44.965 45.100 0.046 0.000 0.970 6 G HN 0.002 8.275 8.290 0.016 0.027 0.574 7 A N 1.286 124.114 122.820 0.013 0.000 1.903 7 A HA 0.037 4.352 4.320 -0.008 0.000 0.213 7 A C 1.759 179.341 177.584 -0.004 0.000 1.185 7 A CA 1.568 53.600 52.037 -0.008 0.000 0.628 7 A CB 0.288 19.267 19.000 -0.036 0.000 0.830 7 A HN -0.086 8.009 8.150 0.005 0.058 0.446 8 S N -2.191 113.505 115.700 -0.007 0.000 2.419 8 S HA -0.248 4.214 4.470 -0.013 0.000 0.233 8 S C 1.615 176.179 174.600 -0.060 0.000 1.016 8 S CA 2.500 60.688 58.200 -0.020 0.000 0.974 8 S CB -0.755 62.437 63.200 -0.014 0.000 0.786 8 S HN 0.096 8.404 8.310 -0.003 0.000 0.492 9 D N -0.742 119.629 120.400 -0.049 0.000 2.221 9 D HA -0.200 4.302 4.640 -0.229 0.000 0.204 9 D C 0.021 176.063 176.300 -0.430 0.000 0.982 9 D CA 1.969 55.870 54.000 -0.165 0.000 0.857 9 D CB 0.235 41.049 40.800 0.023 0.000 0.934 9 D HN 0.023 8.364 8.370 -0.001 0.028 0.475 10 F N -1.714 118.223 119.950 -0.022 0.000 3.065 10 F HA 0.098 4.624 4.527 -0.003 0.000 0.383 10 F C -1.224 174.542 175.800 -0.057 0.000 1.259 10 F CA -1.412 56.574 58.000 -0.024 0.000 1.217 10 F CB 1.624 40.607 39.000 -0.029 0.000 2.042 10 F HN -0.702 7.512 8.300 0.090 0.140 0.641 11 E N 3.313 123.562 120.200 0.081 0.000 2.129 11 E HA 0.081 4.333 4.350 -0.163 0.000 0.283 11 E C -0.533 176.164 176.600 0.163 0.000 1.080 11 E CA 0.036 56.449 56.400 0.022 0.000 0.867 11 E CB -0.659 29.114 29.700 0.122 0.000 1.056 11 E HN 0.297 8.679 8.360 0.037 0.000 0.404 12 F N -0.752 119.246 119.950 0.080 0.000 3.100 12 F HA -0.368 4.190 4.527 0.051 0.000 0.284 12 F C -0.833 175.017 175.800 0.083 0.000 0.875 12 F CA 0.601 58.639 58.000 0.063 0.000 1.039 12 F CB -2.656 36.369 39.000 0.042 0.000 1.111 12 F HN 0.242 8.170 8.300 -0.621 0.000 0.575 13 G N -3.501 105.437 108.800 0.230 0.000 3.899 13 G HA2 0.094 4.176 3.960 0.203 0.000 0.293 13 G HA3 0.094 4.254 3.960 0.333 0.000 0.293 13 G C -0.475 174.525 174.900 0.166 0.000 1.054 13 G CA -0.143 45.105 45.100 0.248 0.000 0.846 13 G HN -0.331 8.041 8.290 0.188 0.030 0.525 14 V N -6.129 113.823 119.914 0.064 0.000 3.572 14 V HA 0.306 4.346 4.120 -0.132 0.000 0.260 14 V C -0.957 175.123 176.094 -0.024 0.000 1.324 14 V CA -0.218 62.047 62.300 -0.059 0.000 1.068 14 V CB 1.261 33.018 31.823 -0.110 0.000 0.837 14 V HN -0.534 7.639 8.190 0.083 0.066 0.450 15 D N -0.754 119.661 120.400 0.026 0.000 2.527 15 D HA 0.391 5.036 4.640 0.008 0.000 0.233 15 D C -1.033 175.298 176.300 0.052 0.000 1.063 15 D CA -2.199 51.818 54.000 0.030 0.000 0.880 15 D CB 2.714 43.536 40.800 0.037 0.000 1.457 15 D HN -0.646 7.760 8.370 0.060 0.000 0.475 16 P HA 0.084 4.656 4.420 0.041 -0.127 0.225 16 P C 0.521 177.848 177.300 0.044 0.000 1.156 16 P CA 1.185 64.307 63.100 0.037 0.000 0.787 16 P CB 0.627 32.341 31.700 0.023 0.000 0.802 17 S N -0.202 115.528 115.700 0.049 0.000 2.555 17 S HA -0.115 4.376 4.470 0.035 0.000 0.230 17 S C 0.140 174.780 174.600 0.068 0.000 0.978 17 S CA 1.746 59.976 58.200 0.050 0.000 0.934 17 S CB -0.863 62.368 63.200 0.052 0.000 0.766 17 S HN 0.098 8.399 8.310 0.047 0.038 0.533 18 A N -0.530 122.349 122.820 0.098 0.000 2.624 18 A HA 0.300 4.653 4.320 0.054 0.000 0.287 18 A C -1.672 175.971 177.584 0.097 0.000 1.087 18 A CA -0.320 51.789 52.037 0.121 0.000 0.964 18 A CB 1.399 20.596 19.000 0.328 0.000 1.231 18 A HN -0.682 7.447 8.150 0.097 0.079 0.551 19 D N -0.993 119.449 120.400 0.070 0.000 2.726 19 D HA 0.291 4.958 4.640 0.046 0.000 0.203 19 D C -2.407 173.917 176.300 0.041 0.000 1.297 19 D CA -0.810 53.225 54.000 0.060 0.000 0.863 19 D CB 2.459 43.313 40.800 0.090 0.000 1.669 19 D HN -0.773 7.533 8.370 0.060 0.100 0.561 20 P HA -0.065 4.366 4.420 0.019 0.000 0.226 20 P C 0.537 177.852 177.300 0.024 0.000 1.153 20 P CA 1.519 64.632 63.100 0.021 0.000 0.777 20 P CB 0.691 32.398 31.700 0.013 0.000 0.794 21 E N -1.559 118.660 120.200 0.032 0.000 2.216 21 E HA -0.166 4.199 4.350 0.026 0.000 0.192 21 E C 1.674 178.294 176.600 0.034 0.000 0.988 21 E CA 2.532 58.951 56.400 0.033 0.000 0.834 21 E CB -0.231 29.494 29.700 0.041 0.000 0.772 21 E HN 0.085 8.414 8.360 0.037 0.054 0.479 22 L N -1.301 119.944 121.223 0.038 0.000 2.354 22 L HA -0.082 4.275 4.340 0.029 0.000 0.212 22 L C 1.201 178.085 176.870 0.023 0.000 1.091 22 L CA 1.801 56.661 54.840 0.032 0.000 0.828 22 L CB 0.272 42.355 42.059 0.040 0.000 0.973 22 L HN -0.683 7.449 8.230 0.044 0.124 0.461 23 A N 0.013 122.847 122.820 0.024 0.000 1.897 23 A HA -0.177 4.153 4.320 0.016 0.000 0.215 23 A C 1.961 179.553 177.584 0.014 0.000 1.181 23 A CA 3.087 55.135 52.037 0.018 0.000 0.620 23 A CB -0.580 18.431 19.000 0.018 0.000 0.821 23 A HN -0.351 7.729 8.150 0.028 0.087 0.443 24 L N -2.947 118.285 121.223 0.015 0.000 2.179 24 L HA -0.210 4.136 4.340 0.010 0.000 0.208 24 L C 1.656 178.533 176.870 0.012 0.000 1.096 24 L CA 1.918 56.765 54.840 0.012 0.000 0.779 24 L CB 0.047 42.113 42.059 0.012 0.000 0.922 24 L HN -0.406 7.835 8.230 0.017 0.000 0.443 25 A N -0.947 121.882 122.820 0.014 0.000 1.930 25 A HA -0.309 4.019 4.320 0.012 0.000 0.217 25 A C 1.639 179.229 177.584 0.010 0.000 1.175 25 A CA 2.975 55.020 52.037 0.013 0.000 0.627 25 A CB -0.600 18.411 19.000 0.017 0.000 0.815 25 A HN -0.509 7.651 8.150 0.017 0.000 0.443 26 L N -3.213 118.015 121.223 0.009 0.000 2.341 26 L HA -0.179 4.163 4.340 0.004 0.000 0.214 26 L C 1.742 178.615 176.870 0.005 0.000 1.115 26 L CA 1.669 56.512 54.840 0.005 0.000 0.820 26 L CB -0.010 42.051 42.059 0.004 0.000 0.944 26 L HN -0.538 7.698 8.230 0.011 0.000 0.452 27 R N -0.569 119.935 120.500 0.006 0.000 2.161 27 R HA -0.179 4.163 4.340 0.004 0.000 0.213 27 R C 2.311 178.613 176.300 0.005 0.000 1.055 27 R CA 3.202 59.305 56.100 0.005 0.000 0.996 27 R CB -0.078 30.226 30.300 0.006 0.000 0.901 27 R HN -0.660 7.476 8.270 0.008 0.139 0.456 28 V N -0.443 119.474 119.914 0.006 0.000 2.788 28 V HA -0.229 3.894 4.120 0.005 0.000 0.251 28 V C 1.640 177.737 176.094 0.004 0.000 1.068 28 V CA 3.042 65.345 62.300 0.005 0.000 1.090 28 V CB -0.261 31.566 31.823 0.006 0.000 0.710 28 V HN -0.275 7.896 8.190 0.007 0.023 0.467 29 S N 0.513 116.215 115.700 0.004 0.000 2.395 29 S HA -0.186 4.286 4.470 0.003 0.000 0.225 29 S C 1.405 176.006 174.600 0.002 0.000 1.027 29 S CA 3.829 62.031 58.200 0.003 0.000 0.965 29 S CB -0.040 63.161 63.200 0.002 0.000 0.812 29 S HN -0.666 7.646 8.310 0.005 0.000 0.482 30 M N 2.622 122.223 119.600 0.002 0.000 2.200 30 M HA -0.165 4.566 4.480 0.000 -0.251 0.265 30 M C 1.420 177.721 176.300 0.001 0.000 1.066 30 M CA 3.271 58.571 55.300 0.001 0.000 1.127 30 M CB 0.271 32.872 32.600 0.001 0.000 1.379 30 M HN -0.645 7.646 8.290 0.002 0.000 0.420 31 E N -1.767 118.434 120.200 0.002 0.000 2.152 31 E HA -0.309 4.042 4.350 0.002 0.000 0.192 31 E C 2.364 178.965 176.600 0.002 0.000 0.983 31 E CA 3.291 59.692 56.400 0.002 0.000 0.818 31 E CB -0.409 29.293 29.700 0.003 0.000 0.758 31 E HN -0.536 7.825 8.360 0.002 0.000 0.467 32 E N -0.332 119.869 120.200 0.002 0.000 2.028 32 E HA -0.344 4.007 4.350 0.002 0.000 0.191 32 E C 2.366 178.967 176.600 0.002 0.000 0.988 32 E CA 3.119 59.520 56.400 0.002 0.000 0.799 32 E CB -0.044 29.657 29.700 0.002 0.000 0.755 32 E HN -0.579 7.763 8.360 0.002 0.019 0.447 33 Q N -2.701 117.100 119.800 0.001 0.000 2.226 33 Q HA -0.328 4.012 4.340 0.001 0.000 0.204 33 Q C 2.382 178.383 176.000 0.001 0.000 0.975 33 Q CA 2.693 58.496 55.803 0.001 0.000 0.866 33 Q CB -0.511 28.227 28.738 0.000 0.000 0.915 33 Q HN -0.453 7.817 8.270 0.001 0.000 0.440 34 R N 0.664 121.165 120.500 0.001 0.000 2.061 34 R HA -0.301 4.039 4.340 0.001 0.000 0.230 34 R C 2.328 178.628 176.300 0.001 0.000 1.140 34 R CA 3.268 59.368 56.100 0.001 0.000 0.940 34 R CB -0.162 30.138 30.300 0.001 0.000 0.839 34 R HN -0.541 7.598 8.270 0.001 0.132 0.429 35 Q N -2.619 117.182 119.800 0.001 0.000 2.297 35 Q HA -0.303 4.037 4.340 0.001 0.000 0.208 35 Q C 2.949 178.950 176.000 0.001 0.000 0.981 35 Q CA 3.141 58.945 55.803 0.001 0.000 0.876 35 Q CB -0.362 28.377 28.738 0.001 0.000 0.921 35 Q HN -0.350 7.921 8.270 0.001 0.000 0.446 36 R N -1.201 119.300 120.500 0.001 0.000 2.075 36 R HA -0.133 4.208 4.340 0.001 0.000 0.226 36 R C 2.637 178.937 176.300 0.001 0.000 1.114 36 R CA 2.518 58.619 56.100 0.001 0.000 0.972 36 R CB -0.308 29.993 30.300 0.001 0.000 0.869 36 R HN -0.412 7.726 8.270 0.001 0.133 0.437 37 Q N -1.015 118.786 119.800 0.000 0.000 2.311 37 Q HA -0.159 4.181 4.340 0.000 0.000 0.203 37 Q C 2.381 178.381 176.000 0.000 0.000 0.954 37 Q CA 2.916 58.719 55.803 0.000 0.000 0.885 37 Q CB 0.322 29.060 28.738 0.000 0.000 0.963 37 Q HN -0.040 8.231 8.270 0.001 0.000 0.471 38 E N 1.000 121.200 120.200 0.001 0.000 2.024 38 E HA -0.312 4.039 4.350 0.001 0.000 0.190 38 E C 1.817 178.418 176.600 0.001 0.000 0.974 38 E CA 3.369 59.770 56.400 0.001 0.000 0.810 38 E CB 0.101 29.801 29.700 0.001 0.000 0.775 38 E HN 0.521 8.852 8.360 0.001 0.029 0.453 39 E N -1.681 118.520 120.200 0.001 0.000 2.171 39 E HA -0.351 3.999 4.350 0.001 0.000 0.197 39 E C 2.576 179.176 176.600 0.001 0.000 0.997 39 E CA 3.098 59.498 56.400 0.001 0.000 0.810 39 E CB -0.412 29.288 29.700 0.001 0.000 0.738 39 E HN -0.385 7.873 8.360 0.001 0.102 0.467 40 E N -1.319 118.882 120.200 0.001 0.000 2.122 40 E HA -0.142 4.208 4.350 0.001 0.000 0.190 40 E C 1.624 178.225 176.600 0.000 0.000 0.977 40 E CA 2.316 58.716 56.400 0.000 0.000 0.820 40 E CB 0.171 29.871 29.700 0.000 0.000 0.770 40 E HN -0.612 7.723 8.360 0.001 0.026 0.462 41 A N 0.278 123.098 122.820 0.000 0.000 1.840 41 A HA -0.199 4.121 4.320 0.000 0.000 0.214 41 A C 2.266 179.850 177.584 0.000 0.000 1.198 41 A CA 3.008 55.045 52.037 0.000 0.000 0.608 41 A CB -0.670 18.330 19.000 0.000 0.000 0.839 41 A HN -0.241 7.713 8.150 0.000 0.196 0.443 42 R N -2.264 118.236 120.500 0.001 0.000 2.117 42 R HA -0.378 3.962 4.340 0.001 0.000 0.243 42 R C 2.221 178.521 176.300 0.001 0.000 1.143 42 R CA 3.378 59.479 56.100 0.001 0.000 0.968 42 R CB -0.312 29.988 30.300 0.001 0.000 0.863 42 R HN 0.328 8.491 8.270 0.001 0.107 0.444 43 R N -0.884 119.616 120.500 0.001 0.000 2.096 43 R HA -0.230 4.110 4.340 0.001 0.000 0.235 43 R C 1.632 177.932 176.300 0.001 0.000 1.127 43 R CA 2.979 59.079 56.100 0.001 0.000 0.968 43 R CB -0.567 29.733 30.300 0.001 0.000 0.861 43 R HN -0.498 7.763 8.270 0.001 0.009 0.440 44 A N -2.088 120.733 122.820 0.000 0.000 1.968 44 A HA -0.094 4.226 4.320 0.000 0.000 0.217 44 A C 1.849 179.433 177.584 0.000 0.000 1.169 44 A CA 2.451 54.488 52.037 0.000 0.000 0.638 44 A CB -0.850 18.150 19.000 0.000 0.000 0.812 44 A HN -0.385 7.658 8.150 0.000 0.107 0.446 45 A N -2.240 120.581 122.820 0.000 0.000 2.016 45 A HA -0.153 4.168 4.320 0.000 0.000 0.217 45 A C 1.790 179.374 177.584 0.001 0.000 1.162 45 A CA 2.426 54.463 52.037 0.001 0.000 0.662 45 A CB -0.515 18.485 19.000 0.001 0.000 0.812 45 A HN -0.109 7.922 8.150 0.000 0.120 0.450 46 A N -1.878 120.942 122.820 0.001 0.000 1.898 46 A HA -0.172 4.148 4.320 0.001 0.000 0.214 46 A C 1.666 179.250 177.584 0.001 0.000 1.183 46 A CA 2.598 54.636 52.037 0.001 0.000 0.622 46 A CB -0.493 18.508 19.000 0.001 0.000 0.824 46 A HN 0.051 8.089 8.150 0.001 0.113 0.444 47 A N -1.970 120.851 122.820 0.001 0.000 1.933 47 A HA -0.232 4.088 4.320 0.001 0.000 0.218 47 A C 1.454 179.039 177.584 0.001 0.000 1.175 47 A CA 2.785 54.823 52.037 0.001 0.000 0.628 47 A CB -0.834 18.166 19.000 0.001 0.000 0.814 47 A HN -0.393 7.757 8.150 0.001 0.000 0.444 48 S N -2.156 113.544 115.700 0.001 0.000 2.428 48 S HA -0.141 4.329 4.470 0.001 0.000 0.230 48 S C 1.713 176.313 174.600 0.001 0.000 1.014 48 S CA 2.161 60.361 58.200 0.001 0.000 0.957 48 S CB 0.561 63.761 63.200 0.001 0.000 0.784 48 S HN -0.607 7.693 8.310 0.001 0.010 0.499 49 A N 0.799 123.620 122.820 0.001 0.000 1.968 49 A HA -0.103 4.217 4.320 0.001 0.000 0.217 49 A C 1.000 178.585 177.584 0.001 0.000 1.169 49 A CA 2.551 54.588 52.037 0.001 0.000 0.638 49 A CB -0.395 18.606 19.000 0.001 0.000 0.812 49 A HN -0.574 7.456 8.150 0.001 0.120 0.446 50 A N -5.895 116.925 122.820 0.001 0.000 2.415 50 A HA 0.094 4.414 4.320 0.001 0.000 0.248 50 A C -0.135 177.450 177.584 0.001 0.000 1.299 50 A CA 0.608 52.646 52.037 0.001 0.000 0.899 50 A CB -0.560 18.440 19.000 0.001 0.000 0.997 50 A HN -0.319 7.817 8.150 0.001 0.014 0.506 51 E N -0.695 119.506 120.200 0.001 0.000 2.290 51 E HA 0.067 4.418 4.350 0.001 0.000 0.195 51 E C 0.463 177.064 176.600 0.001 0.000 0.938 51 E CA 0.815 57.215 56.400 0.001 0.000 1.018 51 E CB 1.555 31.255 29.700 0.001 0.000 1.042 51 E HN -0.467 7.698 8.360 0.001 0.196 0.483 52 A N -2.635 120.185 122.820 0.001 0.000 2.574 52 A HA 0.234 4.555 4.320 0.001 0.000 0.283 52 A C 0.316 177.900 177.584 0.001 0.000 1.270 52 A CA -0.239 51.798 52.037 0.001 0.000 0.945 52 A CB -0.002 18.998 19.000 0.001 0.000 1.127 52 A HN -0.338 7.812 8.150 0.001 0.000 0.522 53 G N -0.814 107.986 108.800 0.001 0.000 2.709 53 G HA2 0.004 3.964 3.960 0.001 0.000 0.208 53 G HA3 0.004 4.102 3.960 0.001 -0.138 0.208 53 G C 0.146 175.047 174.900 0.001 0.000 1.129 53 G CA -0.192 44.908 45.100 0.001 0.000 0.793 53 G HN 0.057 8.275 8.290 0.001 0.073 0.524 54 I N -1.716 118.855 120.570 0.001 0.000 2.566 54 I HA 0.069 4.240 4.170 0.001 0.000 0.286 54 I C -1.137 174.980 176.117 0.001 0.000 1.060 54 I CA -0.578 60.722 61.300 0.001 0.000 2.222 54 I CB -1.990 36.011 38.000 0.001 0.000 1.534 54 I HN -0.407 7.803 8.210 0.001 0.000 0.987 55 A N 5.271 128.091 122.820 0.001 0.000 2.512 55 A HA 0.212 4.533 4.320 0.001 0.000 0.290 55 A C -1.955 175.630 177.584 0.001 0.000 1.041 55 A CA -0.063 51.974 52.037 0.001 0.000 0.911 55 A CB 1.182 20.183 19.000 0.001 0.000 1.407 55 A HN 0.154 8.241 8.150 0.001 0.064 0.398 56 T N 1.343 115.897 114.554 0.001 0.000 2.804 56 T HA 0.443 4.794 4.350 0.001 0.000 0.272 56 T C -1.064 173.637 174.700 0.001 0.000 0.986 56 T CA -0.972 61.129 62.100 0.001 0.000 0.999 56 T CB 0.967 69.836 68.868 0.001 0.000 1.307 56 T HN -0.206 8.034 8.240 0.001 0.000 0.586 57 T N -2.172 112.383 114.554 0.002 0.000 2.816 57 T HA 0.205 4.556 4.350 0.002 0.000 0.299 57 T C -1.923 172.778 174.700 0.002 0.000 1.230 57 T CA -0.811 61.290 62.100 0.002 0.000 1.007 57 T CB 2.540 71.409 68.868 0.002 0.000 1.289 57 T HN -0.165 8.076 8.240 0.002 0.000 0.508 58 G N 0.027 108.828 108.800 0.002 0.000 5.580 58 G HA2 -0.015 4.057 3.960 0.002 0.000 0.197 58 G HA3 -0.015 3.946 3.960 0.001 0.000 0.197 58 G C -1.336 173.565 174.900 0.002 0.000 0.741 58 G CA 0.245 45.346 45.100 0.002 0.000 0.692 58 G HN 0.196 8.487 8.290 0.002 0.000 0.300 59 T N 3.158 117.713 114.554 0.002 0.000 3.400 59 T HA 0.036 4.387 4.350 0.002 0.000 0.364 59 T C -0.488 174.213 174.700 0.002 0.000 1.636 59 T CA 0.137 62.238 62.100 0.002 0.000 1.211 59 T CB -0.098 68.772 68.868 0.002 0.000 1.180 59 T HN -0.290 7.951 8.240 0.002 0.000 0.730 60 E N 5.821 126.022 120.200 0.002 0.000 2.201 60 E HA 0.118 4.469 4.350 0.002 0.000 0.272 60 E C -1.074 175.527 176.600 0.002 0.000 1.228 60 E CA -0.232 56.169 56.400 0.002 0.000 1.305 60 E CB -0.863 28.838 29.700 0.002 0.000 1.381 60 E HN 0.372 8.733 8.360 0.002 0.000 0.475 61 D N 0.949 121.350 120.400 0.002 0.000 2.262 61 D HA -0.023 4.618 4.640 0.001 0.000 0.212 61 D C 0.515 176.816 176.300 0.001 0.000 0.964 61 D CA 1.172 55.172 54.000 0.001 0.000 0.875 61 D CB 1.147 41.948 40.800 0.001 0.000 0.996 61 D HN -0.293 8.029 8.370 0.002 0.049 0.497 62 S N 1.849 117.550 115.700 0.002 0.000 2.891 62 S HA 0.225 4.695 4.470 0.001 0.000 0.186 62 S C -0.780 173.822 174.600 0.003 0.000 1.401 62 S CA -0.864 57.337 58.200 0.002 0.000 1.035 62 S CB 0.093 63.295 63.200 0.002 0.000 1.293 62 S HN 0.131 8.442 8.310 0.002 0.000 0.493 63 D N 4.198 124.599 120.400 0.002 0.000 2.123 63 D HA -0.212 4.430 4.640 0.003 0.000 0.200 63 D C 0.819 177.121 176.300 0.003 0.000 0.976 63 D CA 3.184 57.186 54.000 0.003 0.000 0.831 63 D CB 0.383 41.184 40.800 0.002 0.000 0.974 63 D HN -0.002 8.369 8.370 0.002 0.000 0.469 64 D N -0.572 119.829 120.400 0.002 0.000 2.224 64 D HA -0.119 4.523 4.640 0.003 0.000 0.205 64 D C 1.656 177.958 176.300 0.003 0.000 0.965 64 D CA 2.948 56.949 54.000 0.002 0.000 0.852 64 D CB -0.084 40.717 40.800 0.001 0.000 0.947 64 D HN 0.207 8.578 8.370 0.002 0.000 0.494 65 A N 0.673 123.495 122.820 0.003 0.000 1.877 65 A HA -0.144 4.178 4.320 0.003 0.000 0.216 65 A C 1.935 179.523 177.584 0.006 0.000 1.186 65 A CA 2.839 54.878 52.037 0.004 0.000 0.620 65 A CB -0.727 18.275 19.000 0.003 0.000 0.822 65 A HN 0.020 8.068 8.150 0.002 0.104 0.443 66 L N -2.138 119.088 121.223 0.006 0.000 2.191 66 L HA -0.270 4.074 4.340 0.008 0.000 0.212 66 L C 1.878 178.754 176.870 0.009 0.000 1.103 66 L CA 2.926 57.770 54.840 0.007 0.000 0.769 66 L CB 0.072 42.135 42.059 0.006 0.000 0.908 66 L HN -0.619 7.614 8.230 0.005 0.000 0.438 67 L N -2.211 119.016 121.223 0.008 0.000 2.179 67 L HA -0.286 4.060 4.340 0.010 0.000 0.208 67 L C 1.755 178.631 176.870 0.010 0.000 1.096 67 L CA 2.810 57.655 54.840 0.009 0.000 0.779 67 L CB -0.299 41.764 42.059 0.007 0.000 0.922 67 L HN -0.724 7.371 8.230 0.006 0.139 0.443 68 K N -0.486 119.919 120.400 0.009 0.000 2.044 68 K HA -0.209 4.117 4.320 0.010 0.000 0.204 68 K C 2.108 178.717 176.600 0.016 0.000 1.045 68 K CA 2.674 58.967 56.287 0.010 0.000 0.951 68 K CB -0.084 32.418 32.500 0.004 0.000 0.738 68 K HN 0.282 8.332 8.250 0.007 0.205 0.443 69 M N -1.071 118.538 119.600 0.015 0.000 2.144 69 M HA -0.368 4.126 4.480 0.024 0.000 0.260 69 M C 1.979 178.295 176.300 0.025 0.000 1.067 69 M CA 4.377 59.689 55.300 0.020 0.000 1.095 69 M CB 0.070 32.679 32.600 0.016 0.000 1.365 69 M HN 0.478 8.666 8.290 0.011 0.109 0.406 70 T N -0.202 114.364 114.554 0.021 0.000 2.777 70 T HA -0.260 4.103 4.350 0.021 0.000 0.266 70 T C 1.771 176.488 174.700 0.028 0.000 1.040 70 T CA 4.089 66.202 62.100 0.021 0.000 1.141 70 T CB -0.055 68.822 68.868 0.016 0.000 0.868 70 T HN -0.643 7.599 8.240 0.017 0.008 0.444 71 I N 0.162 120.749 120.570 0.028 0.000 3.226 71 I HA -0.107 4.084 4.170 0.035 0.000 0.277 71 I C 1.039 177.189 176.117 0.054 0.000 1.243 71 I CA -0.047 61.275 61.300 0.036 0.000 1.459 71 I CB 0.016 38.032 38.000 0.027 0.000 1.093 71 I HN -0.719 7.429 8.210 0.024 0.076 0.453 72 S N 1.497 117.229 115.700 0.054 0.000 2.387 72 S HA -0.242 4.276 4.470 0.079 0.000 0.226 72 S C 2.099 176.778 174.600 0.132 0.000 1.026 72 S CA 3.700 61.948 58.200 0.080 0.000 0.972 72 S CB -0.120 63.110 63.200 0.051 0.000 0.814 72 S HN 0.474 8.574 8.310 0.041 0.235 0.477 73 Q N -0.310 119.545 119.800 0.092 0.000 2.302 73 Q HA -0.062 4.347 4.340 0.114 0.000 0.202 73 Q C 1.265 177.298 176.000 0.055 0.000 0.936 73 Q CA 2.099 57.951 55.803 0.082 0.000 0.886 73 Q CB 0.297 29.065 28.738 0.049 0.000 0.986 73 Q HN -0.689 7.620 8.270 0.065 0.000 0.487 74 Q N -1.519 118.311 119.800 0.051 0.000 2.165 74 Q HA -0.160 4.189 4.340 0.016 0.000 0.197 74 Q C 1.613 177.640 176.000 0.044 0.000 0.952 74 Q CA 2.222 58.044 55.803 0.032 0.000 0.848 74 Q CB 0.214 28.969 28.738 0.028 0.000 0.931 74 Q HN -0.741 7.562 8.270 0.054 0.000 0.470 75 E N -2.151 118.094 120.200 0.076 0.000 2.076 75 E HA -0.161 4.230 4.350 0.067 0.000 0.190 75 E C 0.269 176.964 176.600 0.158 0.000 0.979 75 E CA 1.401 57.859 56.400 0.096 0.000 0.807 75 E CB 0.599 30.356 29.700 0.096 0.000 0.761 75 E HN -0.360 7.926 8.360 0.080 0.122 0.454 76 F N 1.737 121.687 119.950 0.001 0.000 2.309 76 F HA 0.179 4.707 4.527 0.001 0.000 0.366 76 F C -1.476 174.324 175.800 -0.000 0.000 1.104 76 F CA -0.898 57.103 58.000 0.001 0.000 1.179 76 F CB 0.108 39.109 39.000 0.001 0.000 1.437 76 F HN -0.895 7.561 8.300 0.260 0.000 0.528 77 G N 5.677 114.257 108.800 -0.367 0.000 3.332 77 G HA2 -0.068 3.609 3.960 -0.470 0.000 0.300 77 G HA3 -0.068 3.781 3.960 -0.184 0.000 0.300 77 G C -1.316 173.434 174.900 -0.250 0.000 2.973 77 G CA 0.442 45.343 45.100 -0.331 0.000 0.684 77 G HN -0.212 7.921 8.290 -0.261 0.000 0.317 78 R N 1.972 122.290 120.500 -0.303 0.000 2.164 78 R HA -0.271 3.965 4.340 -0.174 0.000 0.342 78 R C -1.197 175.031 176.300 -0.120 0.000 1.144 78 R CA 0.784 56.778 56.100 -0.177 0.000 1.018 78 R CB -0.792 29.430 30.300 -0.129 0.000 2.924 78 R HN 0.215 8.212 8.270 -0.456 0.000 0.497 79 T N 0.444 114.940 114.554 -0.095 0.000 3.296 79 T HA 0.294 4.618 4.350 -0.043 0.000 0.285 79 T C 0.397 175.081 174.700 -0.027 0.000 1.014 79 T CA -0.303 61.770 62.100 -0.046 0.000 0.920 79 T CB 0.742 69.598 68.868 -0.020 0.000 1.143 79 T HN -0.068 8.108 8.240 -0.107 0.000 0.522 80 G N 1.779 110.557 108.800 -0.036 0.000 3.591 80 G HA2 0.081 4.035 3.960 -0.010 0.000 0.282 80 G HA3 0.081 4.026 3.960 -0.024 0.000 0.282 80 G C -1.519 173.365 174.900 -0.026 0.000 1.238 80 G CA 0.028 45.115 45.100 -0.022 0.000 0.993 80 G HN -0.084 8.113 8.290 -0.052 0.062 0.542 81 L N -1.021 120.183 121.223 -0.032 0.000 2.612 81 L HA 0.254 4.569 4.340 -0.043 0.000 0.256 81 L C -1.864 174.974 176.870 -0.054 0.000 0.949 81 L CA -1.446 53.366 54.840 -0.045 0.000 0.867 81 L CB 3.082 45.109 42.059 -0.053 0.000 1.417 81 L HN -0.574 7.539 8.230 -0.030 0.100 0.414 82 P HA 0.136 4.529 4.420 -0.045 0.000 0.254 82 P C -1.445 175.787 177.300 -0.113 0.000 1.631 82 P CA -0.617 62.420 63.100 -0.105 0.000 0.861 82 P CB -1.072 30.482 31.700 -0.243 0.000 1.663 83 D N -3.212 117.140 120.400 -0.079 0.000 2.708 83 D HA -0.505 4.100 4.640 -0.058 0.000 0.236 83 D C 0.530 176.778 176.300 -0.087 0.000 1.146 83 D CA 1.080 55.040 54.000 -0.068 0.000 0.662 83 D CB -0.769 40.003 40.800 -0.046 0.000 1.059 83 D HN -0.092 8.114 8.370 -0.067 0.124 0.428 84 L N -1.470 119.689 121.223 -0.107 0.000 2.017 84 L HA -0.232 4.024 4.340 -0.140 0.000 0.208 84 L C 1.267 178.093 176.870 -0.073 0.000 1.073 84 L CA 3.083 57.855 54.840 -0.113 0.000 0.745 84 L CB -0.131 41.858 42.059 -0.117 0.000 0.894 84 L HN -0.223 7.940 8.230 -0.106 0.003 0.432 85 S N -2.059 113.606 115.700 -0.059 0.000 2.515 85 S HA -0.109 4.337 4.470 -0.040 0.000 0.231 85 S C 0.499 175.076 174.600 -0.038 0.000 0.987 85 S CA 1.932 60.106 58.200 -0.044 0.000 0.936 85 S CB -0.173 63.003 63.200 -0.040 0.000 0.766 85 S HN -0.125 8.148 8.310 -0.062 0.000 0.528 86 S N -0.314 115.362 115.700 -0.041 0.000 2.502 86 S HA 0.039 4.493 4.470 -0.027 0.000 0.215 86 S C -0.302 174.281 174.600 -0.028 0.000 1.009 86 S CA 0.756 58.937 58.200 -0.032 0.000 0.908 86 S CB 0.623 63.804 63.200 -0.032 0.000 0.801 86 S HN -0.775 7.315 8.310 -0.050 0.189 0.505 87 M N 0.447 120.025 119.600 -0.037 0.000 1.898 87 M HA 0.109 4.795 4.480 -0.019 -0.217 0.191 87 M C -0.336 175.951 176.300 -0.022 0.000 1.181 87 M CA 1.370 56.652 55.300 -0.029 0.000 0.990 87 M CB 1.214 33.786 32.600 -0.047 0.000 1.143 87 M HN -0.029 8.120 8.290 -0.049 0.112 0.540 88 T N -7.084 107.462 114.554 -0.014 0.000 2.654 88 T HA 0.406 4.748 4.350 -0.013 0.000 0.289 88 T C 0.453 175.150 174.700 -0.004 0.000 1.062 88 T CA -2.012 60.083 62.100 -0.009 0.000 1.041 88 T CB 1.885 70.751 68.868 -0.003 0.000 1.417 88 T HN -0.332 7.902 8.240 -0.010 0.000 0.510 89 E N -0.973 119.226 120.200 -0.000 0.000 2.153 89 E HA -0.317 4.035 4.350 0.004 0.000 0.194 89 E C 1.722 178.330 176.600 0.013 0.000 0.988 89 E CA 3.356 59.759 56.400 0.005 0.000 0.811 89 E CB -0.381 29.321 29.700 0.004 0.000 0.746 89 E HN 0.626 8.985 8.360 -0.002 0.000 0.466 90 E N -0.224 119.983 120.200 0.013 0.000 2.102 90 E HA -0.132 4.231 4.350 0.021 0.000 0.190 90 E C 2.049 178.666 176.600 0.028 0.000 0.971 90 E CA 2.317 58.728 56.400 0.019 0.000 0.821 90 E CB -0.163 29.546 29.700 0.014 0.000 0.777 90 E HN -0.578 7.770 8.360 0.009 0.017 0.460 91 E N 0.490 120.704 120.200 0.023 0.000 2.077 91 E HA -0.346 4.027 4.350 0.039 0.000 0.193 91 E C 2.615 179.247 176.600 0.053 0.000 0.989 91 E CA 3.096 59.515 56.400 0.032 0.000 0.800 91 E CB 0.018 29.728 29.700 0.015 0.000 0.746 91 E HN -0.198 8.171 8.360 0.014 0.000 0.452 92 Q N -2.128 117.691 119.800 0.032 0.000 2.167 92 Q HA -0.259 4.100 4.340 0.032 0.000 0.202 92 Q C 2.616 178.680 176.000 0.106 0.000 0.970 92 Q CA 2.650 58.480 55.803 0.043 0.000 0.855 92 Q CB 0.137 28.872 28.738 -0.005 0.000 0.911 92 Q HN 0.214 8.373 8.270 0.015 0.120 0.438 93 I N 0.087 120.699 120.570 0.070 0.000 2.264 93 I HA -0.488 3.723 4.170 0.068 0.000 0.248 93 I C 1.085 177.248 176.117 0.078 0.000 1.111 93 I CA 3.050 64.389 61.300 0.066 0.000 1.382 93 I CB -0.134 37.890 38.000 0.039 0.000 1.060 93 I HN -0.506 7.531 8.210 0.047 0.202 0.418 94 A N -0.406 122.463 122.820 0.081 0.000 1.978 94 A HA -0.315 4.030 4.320 0.042 0.000 0.220 94 A C 1.562 179.202 177.584 0.094 0.000 1.170 94 A CA 3.261 55.341 52.037 0.071 0.000 0.636 94 A CB -1.238 17.804 19.000 0.070 0.000 0.810 94 A HN 0.113 8.204 8.150 0.074 0.104 0.448 95 Y N -0.872 119.429 120.300 0.002 0.000 2.293 95 Y HA -0.313 4.323 4.550 0.003 -0.084 0.291 95 Y C 1.636 177.537 175.900 0.002 0.000 1.137 95 Y CA 3.456 61.557 58.100 0.002 0.000 1.202 95 Y CB -0.131 38.330 38.460 0.001 0.000 0.990 95 Y HN -0.632 7.661 8.280 0.256 0.140 0.537 96 A N -0.879 122.007 122.820 0.111 0.000 1.930 96 A HA -0.247 4.089 4.320 0.025 0.000 0.215 96 A C 1.627 179.203 177.584 -0.013 0.000 1.176 96 A CA 2.590 54.651 52.037 0.040 0.000 0.632 96 A CB -0.397 18.645 19.000 0.069 0.000 0.819 96 A HN -0.323 7.788 8.150 0.162 0.136 0.445 97 M N -2.550 117.048 119.600 -0.003 0.000 2.447 97 M HA -0.308 4.164 4.480 -0.014 0.000 0.264 97 M C 2.541 178.817 176.300 -0.039 0.000 1.095 97 M CA 3.355 58.646 55.300 -0.015 0.000 1.125 97 M CB 0.155 32.755 32.600 0.001 0.000 1.389 97 M HN 0.212 8.439 8.290 0.022 0.077 0.459 98 Q N -0.383 119.377 119.800 -0.067 0.000 2.163 98 Q HA -0.186 4.118 4.340 -0.060 0.000 0.198 98 Q C 2.199 178.120 176.000 -0.132 0.000 0.954 98 Q CA 2.719 58.466 55.803 -0.094 0.000 0.851 98 Q CB 0.245 28.914 28.738 -0.114 0.000 0.928 98 Q HN 0.284 8.293 8.270 -0.064 0.222 0.459 99 M N -2.634 116.851 119.600 -0.192 0.000 2.388 99 M HA -0.062 4.319 4.480 -0.164 0.000 0.265 99 M C 1.334 177.577 176.300 -0.095 0.000 1.088 99 M CA 1.492 56.685 55.300 -0.177 0.000 1.134 99 M CB 0.377 32.816 32.600 -0.269 0.000 1.384 99 M HN -0.642 7.514 8.290 -0.224 0.000 0.447 100 S N 0.232 115.889 115.700 -0.072 0.000 2.414 100 S HA -0.179 4.270 4.470 -0.035 0.000 0.227 100 S C 2.742 177.323 174.600 -0.032 0.000 1.022 100 S CA 3.181 61.357 58.200 -0.040 0.000 0.958 100 S CB -0.022 63.161 63.200 -0.027 0.000 0.797 100 S HN -0.438 7.824 8.310 -0.080 0.000 0.493 101 L N 0.285 121.487 121.223 -0.035 0.000 2.265 101 L HA -0.218 4.111 4.340 -0.019 0.000 0.215 101 L C 0.536 177.392 176.870 -0.024 0.000 1.117 101 L CA 2.036 56.861 54.840 -0.025 0.000 0.782 101 L CB 0.405 42.449 42.059 -0.026 0.000 0.914 101 L HN -0.752 7.451 8.230 -0.044 0.000 0.441 102 Q N -3.561 116.221 119.800 -0.031 0.000 2.855 102 Q HA 0.080 4.411 4.340 -0.014 0.000 0.297 102 Q C -1.015 174.969 176.000 -0.026 0.000 0.740 102 Q CA -0.226 55.563 55.803 -0.023 0.000 1.027 102 Q CB 0.684 29.408 28.738 -0.023 0.000 1.482 102 Q HN -0.754 7.345 8.270 -0.043 0.146 0.373 103 G N 0.025 108.809 108.800 -0.026 0.000 4.477 103 G HA2 0.221 4.165 3.960 -0.026 0.000 0.319 103 G HA3 0.221 4.257 3.960 -0.034 -0.097 0.319 103 G C -1.629 173.267 174.900 -0.007 0.000 1.391 103 G CA 0.069 45.154 45.100 -0.025 0.000 1.261 103 G HN -0.405 7.870 8.290 -0.025 0.000 0.556 104 A N 2.455 125.278 122.820 0.006 0.000 2.626 104 A HA 0.208 4.538 4.320 0.016 0.000 0.293 104 A C -0.978 176.634 177.584 0.048 0.000 1.111 104 A CA 0.598 52.646 52.037 0.018 0.000 0.874 104 A CB 1.042 20.046 19.000 0.007 0.000 1.451 104 A HN -0.424 7.729 8.150 0.006 0.000 0.396 105 E N 2.591 122.838 120.200 0.077 0.000 2.121 105 E HA 0.034 4.454 4.350 0.117 0.000 0.194 105 E C 0.019 176.798 176.600 0.299 0.000 0.940 105 E CA -0.104 56.379 56.400 0.139 0.000 0.884 105 E CB 0.645 30.408 29.700 0.104 0.000 0.874 105 E HN 0.030 8.430 8.360 0.067 0.000 0.471 106 F N 1.128 121.074 119.950 -0.006 0.000 3.228 106 F HA 0.238 4.762 4.527 -0.004 0.000 0.390 106 F C -0.245 175.553 175.800 -0.003 0.000 1.235 106 F CA -0.025 57.973 58.000 -0.004 0.000 1.236 106 F CB 1.170 40.168 39.000 -0.003 0.000 1.855 106 F HN -0.337 8.096 8.300 0.220 0.000 0.647 107 G N 2.219 110.951 108.800 -0.114 0.000 2.673 107 G HA2 -0.028 3.919 3.960 -0.022 0.000 0.208 107 G HA3 -0.028 3.895 3.960 -0.063 0.000 0.208 107 G C 0.585 175.388 174.900 -0.162 0.000 1.128 107 G CA 0.282 45.331 45.100 -0.085 0.000 0.805 107 G HN 0.082 8.275 8.290 -0.162 0.000 0.526 108 Q N 1.913 121.546 119.800 -0.278 0.000 2.938 108 Q HA 0.154 4.573 4.340 -0.161 -0.176 0.343 108 Q C -0.313 175.479 176.000 -0.348 0.000 1.185 108 Q CA -0.840 54.809 55.803 -0.256 0.000 0.939 108 Q CB -1.616 26.981 28.738 -0.236 0.000 1.480 108 Q HN 0.303 8.374 8.270 -0.332 0.000 0.442 109 A N -0.054 122.601 122.820 -0.275 0.000 1.887 109 A HA -0.035 4.127 4.320 -0.263 0.000 0.212 109 A C 0.394 177.954 177.584 -0.040 0.000 1.198 109 A CA 1.848 53.793 52.037 -0.153 0.000 0.628 109 A CB 0.615 19.662 19.000 0.078 0.000 0.847 109 A HN -0.070 7.884 8.150 -0.188 0.083 0.449 110 E N -1.880 118.303 120.200 -0.028 0.000 2.520 110 E HA 0.019 4.366 4.350 -0.003 0.000 0.201 110 E C 0.109 176.695 176.600 -0.023 0.000 0.894 110 E CA -0.356 56.038 56.400 -0.010 0.000 1.161 110 E CB 1.209 30.915 29.700 0.010 0.000 1.137 110 E HN 0.367 8.706 8.360 -0.034 0.000 0.510 111 S N 0.659 116.343 115.700 -0.027 0.000 2.537 111 S HA 0.179 4.636 4.470 -0.021 0.000 0.275 111 S C 0.011 174.585 174.600 -0.043 0.000 1.272 111 S CA -0.337 57.846 58.200 -0.027 0.000 1.050 111 S CB 0.847 64.035 63.200 -0.020 0.000 0.961 111 S HN -0.098 8.197 8.310 -0.025 0.000 0.496 112 A N 0.000 122.798 122.820 -0.037 0.000 2.254 112 A HA 0.000 4.284 4.320 -0.060 0.000 0.244 112 A CA 0.000 52.011 52.037 -0.044 0.000 0.836 112 A CB 0.000 18.978 19.000 -0.037 0.000 0.831 112 A HN 0.000 8.133 8.150 -0.029 0.000 0.486